#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gqo s ALA 1 N 0.00 2.40 0.47 3.14 0.00 -1.26 -4.74 121.76 121.77 3gqo s ALA 1 Ca 0.00 -0.95 -0.06 0.00 0.00 0.00 0.00 51.96 50.95 3gqo s ALA 1 Cb 0.00 -0.96 -0.04 0.00 0.00 0.00 0.00 23.12 22.12 3gqo s ALA 1 CO 0.00 0.32 0.78 -1.25 0.00 0.00 0.00 175.76 175.61 3gqo s PRO 2 N 0.14 3.57 0.12 0.00 0.04 -1.21 -4.66 135.00 133.01 3gqo s PRO 2 Ca -0.10 0.22 0.11 0.00 0.04 0.00 0.00 61.00 61.27 3gqo s PRO 2 Cb -0.16 -2.39 -0.04 0.00 0.04 0.00 0.00 34.50 31.96 3gqo s PRO 2 CO 0.06 -0.17 -0.26 -1.12 0.04 0.00 0.00 177.00 175.55 3gqo s SER 3 N -3.98 3.40 -0.03 6.66 0.01 -0.65 -4.98 113.70 114.13 3gqo s SER 3 Ca 0.48 -0.71 0.03 0.00 1.31 0.00 0.00 55.95 57.06 3gqo s SER 3 Cb -0.10 -0.27 -0.00 0.00 0.21 0.00 0.00 66.02 65.86 3gqo s SER 3 CO 0.43 0.18 -0.13 -0.31 0.41 0.00 0.00 173.24 173.83 3gqo s TYR 4 N -1.06 1.29 0.04 2.43 1.51 -1.26 0.17 117.35 120.47 3gqo s TYR 4 Ca 0.14 -0.34 0.01 0.00 -1.01 0.00 0.00 57.07 55.88 3gqo s TYR 4 Cb -0.10 -0.88 -0.03 0.00 -0.11 0.00 0.00 41.96 40.84 3gqo s TYR 4 CO 0.06 -0.12 -0.05 -3.38 -1.11 0.00 0.00 175.55 170.95 3gqo s HIS 5 N 0.08 0.55 -0.02 2.71 -3.43 -0.39 -4.96 115.29 109.83 3gqo s HIS 5 Ca -0.03 -0.64 -0.02 0.00 -0.80 0.00 0.00 55.06 53.57 3gqo s HIS 5 Cb -0.09 -0.35 -0.04 0.00 -1.43 0.00 0.00 32.58 30.67 3gqo s HIS 5 CO 0.01 -0.17 0.14 0.08 -2.00 0.00 0.00 174.74 172.81 3gqo s VAL 6 N -2.06 5.20 -0.06 -5.38 1.01 -1.26 -0.56 120.40 117.29 3gqo s VAL 6 Ca -0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 61.98 61.67 3gqo s VAL 6 Cb -0.05 -3.40 0.04 0.00 0.00 0.00 0.00 36.38 32.96 3gqo s VAL 6 CO -0.02 0.36 0.08 -0.69 0.00 0.00 0.00 175.10 174.83 3gqo s VAL 7 N -1.26 -0.13 -0.44 2.92 1.01 0.33 -4.87 120.40 117.96 3gqo s VAL 7 Ca 0.25 0.35 -0.24 0.00 0.00 0.00 0.00 61.98 62.34 3gqo s VAL 7 Cb -0.12 -0.22 0.02 0.00 0.00 0.00 0.00 36.38 36.06 3gqo s VAL 7 CO 0.16 0.12 0.86 -0.60 0.00 0.00 0.00 175.10 175.65 3gqo s ARG 8 N 2.19 3.54 0.00 2.72 3.52 -1.26 -2.21 118.95 127.44 3gqo s ARG 8 Ca 0.04 0.12 0.00 0.00 -0.13 0.00 0.00 55.73 55.76 3gqo s ARG 8 Cb -0.12 -3.91 0.00 0.00 -1.56 0.00 0.00 34.95 29.36 3gqo s ARG 8 CO -0.04 -1.13 0.00 0.41 -0.81 0.00 0.00 175.30 173.73 3gqo n GLY 9 N 4.87 -1.72 3.65 8.12 0.00 -0.50 -4.98 105.19 114.62 3gqo n GLY 9 Ca 0.05 -1.10 -0.43 0.00 0.00 0.00 0.00 46.02 44.54 3gqo n GLY 9 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gqo s ASP 10 N -1.44 6.99 0.40 1.61 2.15 -1.26 -4.51 116.67 120.61 3gqo s ASP 10 Ca 0.00 1.20 0.29 0.00 0.43 0.00 0.00 52.55 54.47 3gqo s ASP 10 Cb 0.00 -2.52 1.26 0.00 -0.30 0.00 0.00 42.92 41.37 3gqo s ASP 10 CO 0.00 -0.69 1.86 -0.29 -0.17 0.00 0.00 175.17 175.87 3gqo h ILE 11 N 5.52 0.00 0.00 4.11 2.10 -1.96 0.24 117.51 127.52 3gqo h ILE 11 Ca -0.20 -0.28 0.00 0.00 1.08 0.00 0.00 64.86 65.46 3gqo h ILE 11 Cb 1.07 1.09 0.00 0.00 -1.09 0.00 0.00 36.82 37.89 3gqo h ILE 11 CO 0.97 0.00 0.00 0.00 -1.08 0.00 0.00 178.15 178.04 3gqo n ALA 12 N -1.91 1.79 -0.59 0.18 0.00 -1.26 -2.08 120.51 116.64 3gqo n ALA 12 Ca 0.01 -0.06 0.07 0.00 0.00 0.00 0.00 53.44 53.46 3gqo n ALA 12 Cb 0.22 -1.26 0.23 0.00 0.00 0.00 0.00 19.45 18.64 3gqo n ALA 12 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3gqo n THR 13 N -1.42 1.69 -2.10 0.00 -2.24 0.07 -5.01 114.28 105.27 3gqo n THR 13 Ca 0.05 -1.40 -0.40 0.00 -2.27 0.00 0.00 64.05 60.03 3gqo n THR 13 Cb 0.16 0.12 -0.01 0.00 -2.10 0.00 0.00 70.33 68.50 3gqo n THR 13 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gqo s ALA 14 N -1.91 3.40 -0.46 6.98 0.00 -0.88 -4.93 121.76 123.95 3gqo s ALA 14 Ca 0.36 1.24 0.23 0.00 0.00 0.00 0.00 51.96 53.79 3gqo s ALA 14 Cb 0.25 -3.48 0.37 0.00 0.00 0.00 0.00 23.12 20.26 3gqo s ALA 14 CO 0.14 -0.70 1.61 1.79 0.00 0.00 0.00 175.76 178.60 3gqo h THR 15 N 2.80 0.00 -2.87 0.00 1.35 -1.95 -3.46 112.91 108.77 3gqo h THR 15 Ca -0.49 -0.96 -0.58 0.00 -0.55 0.00 0.00 66.41 63.82 3gqo h THR 15 Cb 1.23 1.95 0.10 0.00 -1.73 0.00 0.00 68.15 69.71 3gqo h THR 15 CO 0.64 0.00 0.45 -0.62 -0.25 0.00 0.00 175.52 175.74 3gqo n GLU 16 N -3.03 1.89 0.26 4.72 4.71 -1.26 -4.87 120.64 123.05 3gqo n GLU 16 Ca 0.04 0.67 0.12 0.00 -0.01 0.00 0.00 57.16 57.97 3gqo n GLU 16 Cb 0.52 -2.22 0.68 0.00 -1.01 0.00 0.00 31.44 29.41 3gqo n GLU 16 CO 0.00 0.00 0.00 0.78 0.09 0.00 0.00 177.13 178.00 3gqo h GLY 17 N 3.00 0.00 -5.99 0.62 0.00 -1.90 -3.42 103.07 95.38 3gqo h GLY 17 Ca -0.44 0.00 -0.65 0.00 0.00 0.00 0.00 47.33 46.24 3gqo h GLY 17 CO 0.67 0.00 -0.86 0.14 0.00 0.00 0.00 176.54 176.49 3gqo s VAL 18 N -4.20 1.91 -0.06 4.60 1.01 -1.25 -1.74 120.40 120.68 3gqo s VAL 18 Ca -0.03 -0.87 0.06 0.00 0.00 0.00 0.00 61.98 61.15 3gqo s VAL 18 Cb 0.13 -1.73 -0.01 0.00 0.00 0.00 0.00 36.38 34.77 3gqo s VAL 18 CO 0.60 0.52 -0.24 -0.63 0.00 0.00 0.00 175.10 175.35 3gqo s ILE 19 N 1.14 2.12 -0.02 2.22 1.01 -0.49 -0.94 121.20 126.25 3gqo s ILE 19 Ca -0.00 -1.05 -0.23 0.00 0.00 0.00 0.00 60.65 59.38 3gqo s ILE 19 Cb -0.14 -1.77 -0.05 0.00 0.01 0.00 0.00 42.46 40.52 3gqo s ILE 19 CO -0.08 0.57 0.68 -0.63 0.00 0.00 0.00 174.94 175.48 3gqo s ILE 20 N -0.21 4.92 -0.15 2.92 1.09 0.10 -0.67 121.20 129.21 3gqo s ILE 20 Ca -0.02 1.42 -0.11 0.00 -1.10 0.00 0.00 60.65 60.84 3gqo s ILE 20 Cb -0.13 -4.02 -0.05 0.00 -1.06 0.00 0.00 42.46 37.20 3gqo s ILE 20 CO 0.03 0.34 0.21 0.21 -0.10 0.00 0.00 174.94 175.63 3gqo s ASN 21 N 0.25 6.39 -0.69 3.58 3.04 0.96 -4.41 114.94 124.04 3gqo s ASN 21 Ca 0.35 0.45 -0.26 0.00 0.04 0.00 0.00 52.86 53.45 3gqo s ASN 21 Cb -0.19 -2.13 0.04 0.00 -1.54 0.00 0.00 41.25 37.43 3gqo s ASN 21 CO 0.19 0.22 1.17 0.00 -3.04 0.00 0.00 177.10 175.64 3gqo s ALA 22 N -0.07 2.89 0.49 1.71 0.00 -1.26 -0.25 121.76 125.26 3gqo s ALA 22 Ca 0.14 -1.42 0.08 0.00 0.00 0.00 0.00 51.96 50.76 3gqo s ALA 22 Cb -0.12 -4.10 0.04 0.00 0.00 0.00 0.00 23.12 18.93 3gqo s ALA 22 CO 0.03 -3.04 0.67 0.00 0.00 0.00 0.00 175.76 173.42 3gqo s ALA 23 N 5.13 4.54 0.26 0.00 0.00 0.80 -4.31 121.76 128.18 3gqo s ALA 23 Ca 0.32 -1.83 0.06 0.00 0.00 0.00 0.00 51.96 50.52 3gqo s ALA 23 Cb -0.10 -1.60 -0.03 0.00 0.00 0.00 0.00 23.12 21.38 3gqo s ALA 23 CO 0.15 -0.55 0.26 0.54 0.00 0.00 0.00 175.76 176.16 3gqo s ASN 24 N -4.48 5.76 0.57 0.00 6.03 -1.26 -4.39 114.94 117.17 3gqo s ASN 24 Ca 0.58 -0.17 0.31 0.00 -1.03 0.00 0.00 52.86 52.55 3gqo s ASN 24 Cb -0.08 -1.51 1.44 0.00 -3.03 0.00 0.00 41.25 38.06 3gqo s ASN 24 CO 0.36 -0.08 1.80 0.28 -2.03 0.00 0.00 177.10 177.43 3gqo h SER 25 N 1.36 0.00 1.00 3.54 0.02 -1.94 -1.25 113.55 116.27 3gqo h SER 25 Ca -0.49 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.46 3gqo h SER 25 Cb 1.24 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.78 3gqo h SER 25 CO 0.60 0.00 -0.69 0.11 -1.14 0.00 0.00 176.83 175.71 3gqo h LYS 26 N 0.00 0.00 -0.41 3.45 1.79 -1.88 0.82 116.57 120.33 3gqo h LYS 26 Ca 0.38 0.00 -0.14 0.00 -2.18 0.00 0.00 60.65 58.70 3gqo h LYS 26 Cb 1.77 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 32.37 3gqo h LYS 26 CO -0.00 0.00 -0.14 0.41 -1.08 0.00 0.00 179.45 178.64 3gqo n GLY 27 N 1.27 0.83 3.65 3.86 0.00 -0.47 -3.35 105.19 110.99 3gqo n GLY 27 Ca 0.02 -0.71 -0.31 0.00 0.00 0.00 0.00 46.02 45.02 3gqo n GLY 27 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gqo s GLN 28 N -2.80 2.50 0.45 1.61 1.11 -1.26 -3.92 119.66 117.36 3gqo s GLN 28 Ca 0.00 -0.83 -0.24 0.00 0.01 0.00 0.00 55.36 54.31 3gqo s GLN 28 Cb 0.00 -2.51 -0.07 0.00 -1.01 0.00 0.00 33.01 29.42 3gqo s GLN 28 CO 0.00 0.55 1.23 -1.25 0.01 0.00 0.00 175.29 175.83 3gqo s PRO 29 N -2.08 3.74 0.00 2.91 0.04 -1.26 -4.70 135.00 133.66 3gqo s PRO 29 Ca 0.23 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.22 3gqo s PRO 29 Cb -0.11 -2.50 0.00 0.00 0.04 0.00 0.00 34.50 31.92 3gqo s PRO 29 CO 0.15 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 176.99 3gqo n GLY 30 N 0.57 2.53 0.00 0.56 0.00 -1.26 -5.03 105.19 102.57 3gqo n GLY 30 Ca 0.07 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3gqo n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gqo n GLY 31 N 0.00 1.12 7.00 -0.02 0.00 -1.26 -3.03 105.19 108.99 3gqo n GLY 31 Ca 0.00 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.08 3gqo n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gqo n GLY 32 N 5.00 1.02 0.24 -0.02 0.00 -1.26 -1.72 105.19 108.44 3gqo n GLY 32 Ca 0.00 -0.61 -0.02 0.00 0.00 0.00 0.00 46.02 45.39 3gqo n GLY 32 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3gqo h VAL 33 N 0.00 1.25 -0.42 1.61 -1.51 -1.95 -2.87 116.25 112.36 3gqo h VAL 33 Ca 0.00 -1.16 0.06 0.00 -1.23 0.00 0.00 66.70 64.37 3gqo h VAL 33 Cb 0.00 1.32 -0.05 0.00 -2.13 0.00 0.00 31.29 30.43 3gqo h VAL 33 CO 0.00 0.37 0.10 0.00 -1.23 0.00 0.00 177.57 176.80 3gqo h GLY 35 N 0.23 0.00 2.00 0.00 0.00 -1.14 -1.15 103.07 103.01 3gqo h GLY 35 Ca 0.20 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.36 3gqo h GLY 35 CO -0.25 0.00 -0.82 0.00 0.00 0.00 0.00 176.54 175.47 3gqo h ALA 36 N 1.70 0.59 0.00 3.60 0.00 -1.08 -2.35 119.26 121.73 3gqo h ALA 36 Ca -0.00 -0.75 -0.22 0.00 0.00 0.00 0.00 54.91 53.94 3gqo h ALA 36 Cb 0.57 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 3gqo h ALA 36 CO 0.04 1.03 -1.22 -0.07 0.00 0.00 0.00 179.25 179.02 3gqo h LEU 37 N 0.00 0.00 -0.23 0.00 3.38 -0.71 -3.15 115.31 114.59 3gqo h LEU 37 Ca -0.01 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 3gqo h LEU 37 Cb 1.50 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.23 3gqo h LEU 37 CO 0.11 0.88 -0.54 0.22 0.09 0.00 0.00 178.44 179.20 3gqo h TYR 38 N 0.00 0.00 -0.27 1.13 3.20 -1.25 0.48 116.97 120.26 3gqo h TYR 38 Ca -0.12 0.00 -0.08 0.00 3.14 0.00 0.00 58.73 61.67 3gqo h TYR 38 Cb 1.78 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 40.03 3gqo h TYR 38 CO 0.00 0.54 -0.17 -0.22 -1.64 0.00 0.00 178.16 176.67 3gqo h LYS 39 N 0.00 0.47 0.00 1.82 3.64 -1.41 -3.28 116.57 117.81 3gqo h LYS 39 Ca -0.01 -0.15 -0.29 0.00 -1.27 0.00 0.00 60.65 58.93 3gqo h LYS 39 Cb 1.32 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 33.04 3gqo h LYS 39 CO 0.07 0.63 -2.10 1.17 -2.27 0.00 0.00 179.45 176.95 3gqo n LYS 40 N -4.18 1.34 -3.07 1.90 4.81 -1.15 -4.79 118.16 113.03 3gqo n LYS 40 Ca 0.00 0.00 -0.22 0.00 -0.87 0.00 0.00 58.31 57.23 3gqo n LYS 40 Cb 0.35 -1.41 -0.03 0.00 0.02 0.00 0.00 35.03 33.96 3gqo n LYS 40 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 3gqo n PHE 41 N -2.62 1.81 0.29 5.64 3.72 0.15 -4.91 117.46 121.54 3gqo n PHE 41 Ca -0.27 -3.86 0.15 0.00 -0.05 0.00 0.00 57.45 53.42 3gqo n PHE 41 Cb 1.01 -0.44 0.91 0.00 -0.94 0.00 0.00 39.48 40.02 3gqo n PHE 41 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3gqo h PRO 42 N 2.99 0.00 -0.43 -1.08 0.13 -1.73 -1.19 132.00 130.69 3gqo h PRO 42 Ca 0.11 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.23 3gqo h PRO 42 Cb 0.78 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.89 3gqo h PRO 42 CO 0.63 0.00 0.20 0.93 -0.23 0.00 0.00 178.00 179.54 3gqo h GLU 43 N 0.00 0.60 -0.72 0.86 3.07 -1.92 -2.38 114.58 114.08 3gqo h GLU 43 Ca 0.01 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 3gqo h GLU 43 Cb 0.03 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 27.82 3gqo h GLU 43 CO -0.00 0.47 0.00 0.43 -1.40 0.00 0.00 179.01 178.51 3gqo n SER 44 N -4.40 2.54 -4.44 1.42 7.64 -0.45 -4.63 113.62 111.31 3gqo n SER 44 Ca 0.03 -2.28 -0.33 0.00 1.01 0.00 0.00 58.87 57.30 3gqo n SER 44 Cb 0.12 -0.49 -0.14 0.00 -1.01 0.00 0.00 64.21 62.69 3gqo n SER 44 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3gqo s PHE 45 N -1.66 2.71 -0.33 1.43 0.08 -0.90 -4.58 117.98 114.73 3gqo s PHE 45 Ca 0.20 -0.30 0.15 0.00 0.12 0.00 0.00 56.93 57.11 3gqo s PHE 45 Cb 0.15 -1.68 -0.20 0.00 -0.57 0.00 0.00 43.02 40.72 3gqo s PHE 45 CO 0.08 0.07 0.46 -0.40 -0.10 0.00 0.00 175.22 175.33 3gqo n ASP 46 N 2.62 1.15 -1.93 1.36 5.68 -1.26 -5.00 116.55 119.17 3gqo n ASP 46 Ca -0.17 -0.39 -0.18 0.00 -0.50 0.00 0.00 54.79 53.55 3gqo n ASP 46 Cb 0.52 1.38 -0.02 0.00 -1.14 0.00 0.00 41.12 41.86 3gqo n ASP 46 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 3gqo n LEU 47 N -1.72 -1.73 -4.90 -2.12 4.77 -1.25 -5.01 117.00 105.04 3gqo n LEU 47 Ca -0.00 0.06 -0.32 0.00 -0.03 0.00 0.00 56.01 55.72 3gqo n LEU 47 Cb 0.32 -2.58 -0.05 0.00 -2.33 0.00 0.00 43.42 38.78 3gqo n LEU 47 CO 0.31 -0.32 -0.16 -1.10 -1.33 0.00 0.00 177.39 174.79 3gqo s GLN 48 N -4.66 3.40 0.61 3.23 -1.52 -1.26 -4.79 119.66 114.67 3gqo s GLN 48 Ca 0.00 -0.41 -0.18 0.00 -1.95 0.00 0.00 55.36 52.83 3gqo s GLN 48 Cb 0.00 -3.04 -0.07 0.00 -0.22 0.00 0.00 33.01 29.68 3gqo s GLN 48 CO 0.00 0.63 0.62 -2.30 -0.25 0.00 0.00 175.29 173.99 3gqo n PRO 49 N 0.58 0.54 -4.23 2.91 -0.02 -1.21 -3.94 135.00 129.63 3gqo n PRO 49 Ca -0.08 0.22 -0.19 0.00 -2.02 0.00 0.00 63.50 61.43 3gqo n PRO 49 Cb 0.52 -1.82 -0.16 0.00 -0.02 0.00 0.00 33.50 32.02 3gqo n PRO 49 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3gqo s ILE 50 N -1.71 0.57 0.40 4.25 1.01 0.28 -4.88 121.20 121.12 3gqo s ILE 50 Ca 0.70 -0.21 -0.27 0.00 0.00 0.00 0.00 60.65 60.88 3gqo s ILE 50 Cb -0.42 -0.54 -0.09 0.00 0.01 0.00 0.00 42.46 41.41 3gqo s ILE 50 CO 0.53 0.20 1.36 -1.61 0.00 0.00 0.00 174.94 175.43 3gqo s GLU 51 N 0.48 3.97 0.19 2.79 2.02 -1.26 -4.21 118.70 122.68 3gqo s GLU 51 Ca -0.06 2.29 -0.33 0.00 0.02 0.00 0.00 54.97 56.89 3gqo s GLU 51 Cb -0.10 -2.81 -0.14 0.00 0.10 0.00 0.00 34.13 31.18 3gqo s GLU 51 CO 0.00 -0.54 1.44 0.28 0.02 0.00 0.00 175.26 176.47 3gqo n VAL 52 N 0.19 0.47 -0.53 2.63 0.31 -1.26 -1.00 118.33 119.14 3gqo n VAL 52 Ca 0.03 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 3gqo n VAL 52 Cb 0.42 -1.36 0.00 0.00 -0.91 0.00 0.00 33.84 31.99 3gqo n VAL 52 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3gqo n GLY 53 N 2.66 1.10 3.97 2.92 0.00 0.16 -4.97 105.19 111.03 3gqo n GLY 53 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 3gqo n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3gqo s LYS 54 N -0.32 2.27 0.09 1.61 -0.14 -0.17 -2.74 119.74 120.33 3gqo s LYS 54 Ca 0.00 -1.86 -0.10 0.00 -1.36 0.00 0.00 55.97 52.64 3gqo s LYS 54 Cb 0.00 -2.35 0.01 0.00 -1.68 0.00 0.00 37.83 33.81 3gqo s LYS 54 CO 0.00 -0.75 0.24 0.00 -0.76 0.00 0.00 175.35 174.07 3gqo s ALA 55 N -2.74 -0.39 -0.10 5.17 0.00 -1.26 -1.28 121.76 121.16 3gqo s ALA 55 Ca 0.47 -0.45 -0.06 0.00 0.00 0.00 0.00 51.96 51.92 3gqo s ALA 55 Cb -0.04 0.50 0.04 0.00 0.00 0.00 0.00 23.12 23.62 3gqo s ALA 55 CO 0.29 -0.52 0.25 0.50 0.00 0.00 0.00 175.76 176.28 3gqo s ARG 56 N -3.67 0.21 -0.15 0.00 3.52 0.62 -4.96 118.95 114.53 3gqo s ARG 56 Ca 0.03 0.52 -0.29 0.00 -0.13 0.00 0.00 55.73 55.86 3gqo s ARG 56 Cb 0.04 -0.10 -0.02 0.00 -1.56 0.00 0.00 34.95 33.31 3gqo s ARG 56 CO -0.10 -0.15 1.27 -1.17 -0.81 0.00 0.00 175.30 174.34 3gqo s LEU 57 N 1.18 4.20 -0.13 -0.88 2.96 -1.26 -1.10 118.68 123.65 3gqo s LEU 57 Ca -0.09 1.74 0.02 0.00 -0.22 0.00 0.00 54.13 55.58 3gqo s LEU 57 Cb -0.10 -3.54 -0.00 0.00 0.50 0.00 0.00 46.19 43.05 3gqo s LEU 57 CO -0.08 -0.75 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.32 3gqo s VAL 58 N 3.36 2.39 -0.18 1.68 1.01 0.11 -5.00 120.40 123.77 3gqo s VAL 58 Ca 0.56 -0.88 -0.11 0.00 0.00 0.00 0.00 61.98 61.55 3gqo s VAL 58 Cb -0.23 -1.97 -0.05 0.00 0.00 0.00 0.00 36.38 34.14 3gqo s VAL 58 CO 0.16 0.54 0.18 -0.54 0.00 0.00 0.00 175.10 175.44 3gqo s LYS 59 N 0.60 4.13 0.36 2.72 3.01 -1.26 -0.98 119.74 128.32 3gqo s LYS 59 Ca -0.11 -0.12 0.04 0.00 -1.01 0.00 0.00 55.97 54.78 3gqo s LYS 59 Cb -0.16 -3.40 -0.06 0.00 -1.01 0.00 0.00 37.83 33.20 3gqo s LYS 59 CO 0.03 0.33 0.05 0.20 0.51 0.00 0.00 175.35 176.48 3gqo s GLY 60 N 0.24 2.27 0.32 -3.33 0.00 -0.74 -4.72 107.32 101.36 3gqo s GLY 60 Ca 0.11 -1.92 0.02 0.00 0.00 0.00 0.00 44.72 42.93 3gqo s GLY 60 CO 0.00 -1.90 1.93 0.00 0.00 0.00 0.00 173.10 173.14 3gqo h ALA 61 N 1.97 1.55 0.06 3.20 0.00 -1.99 -3.25 119.26 120.79 3gqo h ALA 61 Ca -0.41 -0.03 -0.36 0.00 0.00 0.00 0.00 54.91 54.11 3gqo h ALA 61 Cb 1.25 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 3gqo h ALA 61 CO 0.71 0.34 -2.05 0.00 0.00 0.00 0.00 179.25 178.25 3gqo n ALA 62 N -2.41 1.04 -3.07 0.00 0.00 -1.26 -5.00 120.51 109.81 3gqo n ALA 62 Ca 0.12 -0.76 -0.13 0.00 0.00 0.00 0.00 53.44 52.68 3gqo n ALA 62 Cb 0.18 -0.43 -0.14 0.00 0.00 0.00 0.00 19.45 19.07 3gqo n ALA 62 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3gqo s LYS 63 N -2.51 0.06 -0.35 0.00 3.01 -1.23 -4.93 119.74 113.79 3gqo s LYS 63 Ca -0.29 0.12 -0.19 0.00 -1.01 0.00 0.00 55.97 54.60 3gqo s LYS 63 Cb 0.08 -0.01 -0.00 0.00 -1.01 0.00 0.00 37.83 36.89 3gqo s LYS 63 CO 0.66 -0.03 0.56 -1.01 0.51 0.00 0.00 175.35 176.04 3gqo s HIS 64 N 0.21 3.17 -0.20 3.18 3.76 -0.71 -1.79 115.29 122.91 3gqo s HIS 64 Ca -0.01 0.24 -0.12 0.00 -0.15 0.00 0.00 55.06 55.02 3gqo s HIS 64 Cb -0.02 -3.01 -0.05 0.00 1.11 0.00 0.00 32.58 30.61 3gqo s HIS 64 CO -0.01 -0.57 0.21 0.42 -0.85 0.00 0.00 174.74 173.94 3gqo s ILE 65 N 2.52 5.35 -0.51 0.60 1.01 -0.15 -1.40 121.20 128.61 3gqo s ILE 65 Ca 0.21 0.34 -0.19 0.00 0.00 0.00 0.00 60.65 61.01 3gqo s ILE 65 Cb -0.15 -3.55 0.06 0.00 0.01 0.00 0.00 42.46 38.84 3gqo s ILE 65 CO 0.14 0.38 0.59 -0.63 0.00 0.00 0.00 174.94 175.43 3gqo s ILE 66 N 0.66 4.93 -0.26 2.92 1.01 0.16 -0.71 121.20 129.91 3gqo s ILE 66 Ca 0.11 -0.62 -0.27 0.00 0.00 0.00 0.00 60.65 59.87 3gqo s ILE 66 Cb -0.13 -4.29 0.00 0.00 0.01 0.00 0.00 42.46 38.06 3gqo s ILE 66 CO 0.02 -0.79 0.93 -1.00 0.00 0.00 0.00 174.94 174.10 3gqo s HIS 67 N 2.47 3.28 -0.04 3.97 3.76 -0.25 -0.03 115.29 128.45 3gqo s HIS 67 Ca 0.13 1.22 0.06 0.00 -0.15 0.00 0.00 55.06 56.31 3gqo s HIS 67 Cb -0.20 -3.24 -0.01 0.00 1.11 0.00 0.00 32.58 30.24 3gqo s HIS 67 CO 0.11 -0.50 -0.22 0.00 -0.85 0.00 0.00 174.74 173.28 3gqo s ALA 68 N 3.10 1.87 -0.55 -1.40 0.00 0.65 -0.28 121.76 125.14 3gqo s ALA 68 Ca 0.39 -0.91 -0.11 0.00 0.00 0.00 0.00 51.96 51.33 3gqo s ALA 68 Cb -0.15 -0.56 0.14 0.00 0.00 0.00 0.00 23.12 22.55 3gqo s ALA 68 CO 0.09 0.38 0.45 0.08 0.00 0.00 0.00 175.76 176.76 3gqo s VAL 69 N -0.21 4.60 0.80 0.00 1.01 -0.40 -0.14 120.40 126.07 3gqo s VAL 69 Ca -0.00 -1.94 -0.11 0.00 0.00 0.00 0.00 61.98 59.94 3gqo s VAL 69 Cb -0.12 -3.98 0.08 0.00 0.00 0.00 0.00 36.38 32.36 3gqo s VAL 69 CO 0.02 -0.85 1.11 -0.83 0.00 0.00 0.00 175.10 174.55 3gqo s GLY 70 N 2.63 1.71 0.75 4.51 0.00 -1.26 0.40 107.32 116.06 3gqo s GLY 70 Ca 0.08 0.37 -0.15 0.00 0.00 0.00 0.00 44.72 45.02 3gqo s GLY 70 CO -0.01 0.73 1.24 2.56 0.00 0.00 0.00 173.10 177.62 3gqo s PRO 71 N -4.80 1.96 -0.45 2.90 0.04 -1.26 -4.75 135.00 128.63 3gqo s PRO 71 Ca 0.63 1.87 -0.14 0.00 0.04 0.00 0.00 61.00 63.40 3gqo s PRO 71 Cb -0.19 -1.80 0.06 0.00 0.04 0.00 0.00 34.50 32.62 3gqo s PRO 71 CO 0.56 -2.00 0.35 1.21 0.04 0.00 0.00 177.00 177.16 3gqo s ASN 72 N -1.88 6.03 0.00 6.66 3.84 -1.26 -4.64 114.94 123.68 3gqo s ASN 72 Ca 0.77 -1.29 0.18 0.00 0.21 0.00 0.00 52.86 52.72 3gqo s ASN 72 Cb -0.32 -2.14 1.04 0.00 -0.55 0.00 0.00 41.25 39.29 3gqo s ASN 72 CO 0.47 -0.59 1.45 0.49 -2.79 0.00 0.00 177.10 176.12 3gqo n PHE 73 N 5.14 0.00 0.20 0.43 3.01 0.32 -0.87 117.46 125.69 3gqo n PHE 73 Ca -0.12 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.44 3gqo n PHE 73 Cb 0.44 0.00 0.14 0.00 -0.01 0.00 0.00 39.48 40.05 3gqo n PHE 73 CO 0.00 0.00 0.00 -0.91 1.01 0.00 0.00 176.76 176.86 3gqo h ASN 74 N 0.00 0.00 0.00 4.37 4.21 -1.88 -3.39 115.58 118.89 3gqo h ASN 74 Ca 0.00 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.39 3gqo h ASN 74 Cb 0.00 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.18 3gqo h ASN 74 CO 0.00 0.09 -1.49 0.29 -1.29 0.00 0.00 177.43 175.03 3gqo n LYS 75 N -3.12 2.55 -4.28 0.81 4.76 -0.05 -5.04 118.16 113.80 3gqo n LYS 75 Ca 0.04 -0.01 -0.26 0.00 -2.87 0.00 0.00 58.31 55.21 3gqo n LYS 75 Cb 0.57 -1.19 -0.09 0.00 -1.84 0.00 0.00 35.03 32.48 3gqo n LYS 75 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3gqo s VAL 76 N -2.21 3.33 1.06 -0.18 -7.23 -0.87 -5.08 120.40 109.22 3gqo s VAL 76 Ca -0.04 -1.67 -0.12 0.00 -1.81 0.00 0.00 61.98 58.34 3gqo s VAL 76 Cb 0.02 -2.68 0.23 0.00 0.56 0.00 0.00 36.38 34.51 3gqo s VAL 76 CO 0.31 -0.16 1.06 -0.94 -0.31 0.00 0.00 175.10 175.06 3gqo s SER 77 N -3.01 1.94 0.18 4.85 1.04 -1.26 -4.69 113.70 112.74 3gqo s SER 77 Ca 0.27 1.43 -0.10 0.00 0.48 0.00 0.00 55.95 58.02 3gqo s SER 77 Cb -0.08 -2.14 0.08 0.00 0.10 0.00 0.00 66.02 63.98 3gqo s SER 77 CO 0.17 -3.59 1.69 -0.33 0.98 0.00 0.00 173.24 172.16 3gqo h GLU 78 N -2.21 1.00 0.04 4.02 4.39 -1.98 -0.79 114.58 119.06 3gqo h GLU 78 Ca -0.57 -0.24 -0.00 0.00 0.34 0.00 0.00 59.36 58.89 3gqo h GLU 78 Cb 1.32 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 29.84 3gqo h GLU 78 CO 0.53 0.91 -0.02 0.28 -1.16 0.00 0.00 179.01 179.55 3gqo h VAL 79 N 0.92 1.31 0.00 3.13 2.07 -1.99 -1.08 116.25 120.62 3gqo h VAL 79 Ca 0.20 -1.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.42 3gqo h VAL 79 Cb 0.35 2.12 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 3gqo h VAL 79 CO 0.00 0.31 -0.21 -0.08 0.02 0.00 0.00 177.57 177.61 3gqo h GLU 80 N -0.62 0.00 -0.11 1.57 4.57 -1.94 -2.17 114.58 115.87 3gqo h GLU 80 Ca -0.01 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 57.97 3gqo h GLU 80 Cb 0.55 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 3gqo h GLU 80 CO 0.01 0.21 -0.77 0.78 -1.18 0.00 0.00 179.01 178.07 3gqo h GLY 81 N 1.01 0.67 2.00 1.92 0.00 -1.07 -2.41 103.07 105.18 3gqo h GLY 81 Ca -0.00 -0.95 -0.06 0.00 0.00 0.00 0.00 47.33 46.31 3gqo h GLY 81 CO 0.03 0.85 -0.29 -1.80 0.00 0.00 0.00 176.54 175.33 3gqo h ASP 82 N 0.41 0.00 0.00 0.19 3.58 -0.59 -0.40 116.42 119.61 3gqo h ASP 82 Ca -0.04 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.40 3gqo h ASP 82 Cb 1.37 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.42 3gqo h ASP 82 CO 0.15 0.29 -0.00 0.11 -2.88 0.00 0.00 179.24 176.90 3gqo h LYS 83 N 0.00 -0.01 0.00 0.28 1.57 -1.34 -2.29 116.57 114.78 3gqo h LYS 83 Ca -0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 3gqo h LYS 83 Cb 0.70 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.00 3gqo h LYS 83 CO 0.04 0.57 -0.23 1.96 -0.57 0.00 0.00 179.45 181.22 3gqo h GLN 84 N -0.59 0.00 -0.03 3.15 4.20 -1.17 0.17 115.11 120.85 3gqo h GLN 84 Ca -0.00 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.63 3gqo h GLN 84 Cb 0.58 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.37 3gqo h GLN 84 CO 0.00 0.23 -0.27 1.25 -0.67 0.00 0.00 178.83 179.36 3gqo h LEU 85 N 0.00 0.30 0.02 1.46 5.85 -1.04 0.22 115.31 122.11 3gqo h LEU 85 Ca -0.00 -0.70 0.03 0.00 0.84 0.00 0.00 57.88 58.05 3gqo h LEU 85 Cb 0.42 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 3gqo h LEU 85 CO 0.03 0.95 -0.28 0.00 -0.34 0.00 0.00 178.44 178.80 3gqo h ALA 86 N 0.36 -0.40 -0.73 1.25 0.00 -1.17 -1.85 119.26 116.71 3gqo h ALA 86 Ca -0.02 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.02 3gqo h ALA 86 Cb 0.96 0.49 -0.14 0.00 0.00 0.00 0.00 17.79 19.10 3gqo h ALA 86 CO 0.06 -0.79 -0.13 0.93 0.00 0.00 0.00 179.25 179.32 3gqo h GLU 87 N -0.43 0.02 -0.21 0.00 5.08 -0.60 0.14 114.58 118.58 3gqo h GLU 87 Ca 0.06 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 3gqo h GLU 87 Cb 0.51 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3gqo h GLU 87 CO -0.23 0.02 0.08 0.00 -1.00 0.00 0.00 179.01 177.88 3gqo h ALA 88 N 1.72 0.27 -0.62 3.43 0.00 -0.06 -0.94 119.26 123.06 3gqo h ALA 88 Ca 0.37 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 55.06 3gqo h ALA 88 Cb 0.59 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3gqo h ALA 88 CO -0.72 -0.13 0.02 1.88 0.00 0.00 0.00 179.25 180.31 3gqo h TYR 89 N 0.18 1.17 -0.60 0.00 0.05 -0.83 -2.43 116.97 114.52 3gqo h TYR 89 Ca 0.07 -0.19 0.01 0.00 0.05 0.00 0.00 58.73 58.66 3gqo h TYR 89 Cb 0.19 -0.31 -0.03 0.00 1.01 0.00 0.00 36.73 37.59 3gqo h TYR 89 CO -0.01 1.02 0.40 1.49 -1.05 0.00 0.00 178.16 180.01 3gqo h GLU 90 N 0.99 0.79 -0.38 4.88 4.57 -0.45 -1.03 114.58 123.96 3gqo h GLU 90 Ca 0.18 -0.05 -0.09 0.00 -1.18 0.00 0.00 59.36 58.22 3gqo h GLU 90 Cb 0.54 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.93 3gqo h GLU 90 CO 0.03 0.52 -0.13 0.77 -1.18 0.00 0.00 179.01 179.02 3gqo h SER 91 N 0.81 0.67 -0.07 1.04 0.02 -0.83 -1.34 113.55 113.86 3gqo h SER 91 Ca 0.22 -0.20 -0.00 0.00 -0.84 0.00 0.00 61.79 60.97 3gqo h SER 91 Cb -0.09 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 62.26 3gqo h SER 91 CO -0.05 0.82 0.02 0.40 -1.14 0.00 0.00 176.83 176.89 3gqo h ILE 92 N 0.62 1.15 -0.63 3.27 2.04 -0.77 -2.67 117.51 120.53 3gqo h ILE 92 Ca 0.11 -0.46 0.03 0.00 1.00 0.00 0.00 64.86 65.54 3gqo h ILE 92 Cb 0.57 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.96 3gqo h ILE 92 CO 0.04 0.13 0.42 0.00 0.00 0.00 0.00 178.15 178.73 3gqo h ALA 93 N 0.85 1.65 -0.36 1.87 0.00 -0.97 -0.03 119.26 122.26 3gqo h ALA 93 Ca 0.02 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.94 3gqo h ALA 93 Cb 0.18 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3gqo h ALA 93 CO -0.00 0.29 0.12 -0.22 0.00 0.00 0.00 179.25 179.43 3gqo h LYS 94 N 0.76 0.26 -0.03 0.00 3.11 -1.05 0.39 116.57 120.01 3gqo h LYS 94 Ca 0.25 -0.02 -0.17 0.00 -2.81 0.00 0.00 60.65 57.90 3gqo h LYS 94 Cb 0.06 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.22 3gqo h LYS 94 CO -0.07 0.17 -0.76 0.82 -2.81 0.00 0.00 179.45 176.80 3gqo h ILE 95 N 0.26 1.45 -0.50 2.00 2.04 -0.89 0.70 117.51 122.57 3gqo h ILE 95 Ca 0.17 -2.35 -0.05 0.00 1.00 0.00 0.00 64.86 63.63 3gqo h ILE 95 Cb 0.15 2.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.48 3gqo h ILE 95 CO -0.18 0.69 0.14 0.58 0.00 0.00 0.00 178.15 179.38 3gqo h VAL 96 N 0.14 1.24 -0.27 1.67 2.07 -0.74 -2.23 116.25 118.13 3gqo h VAL 96 Ca -0.03 -0.82 -0.19 0.00 0.82 0.00 0.00 66.70 66.48 3gqo h VAL 96 Cb 1.33 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 31.91 3gqo h VAL 96 CO 0.12 0.30 -0.59 0.78 0.02 0.00 0.00 177.57 178.19 3gqo h ASN 97 N 0.69 0.98 -0.16 0.57 2.35 -0.72 -1.42 115.58 117.87 3gqo h ASN 97 Ca 0.16 -0.55 -0.10 0.00 -0.55 0.00 0.00 56.30 55.26 3gqo h ASN 97 Cb 0.31 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 3gqo h ASN 97 CO -0.00 1.35 -0.22 0.44 -1.65 0.00 0.00 177.43 177.35 3gqo h ASP 98 N 0.65 0.60 -0.04 5.81 3.32 -0.84 -3.11 116.42 122.82 3gqo h ASP 98 Ca 0.00 -0.20 0.00 0.00 0.02 0.00 0.00 57.03 56.85 3gqo h ASP 98 Cb 1.21 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.60 3gqo h ASP 98 CO 0.13 0.82 0.00 0.59 -1.72 0.00 0.00 179.24 179.06 3gqo n ASN 99 N -4.13 2.31 -3.86 6.45 3.02 -0.84 -4.96 115.26 113.25 3gqo n ASN 99 Ca 0.00 -1.77 -0.29 0.00 -0.03 0.00 0.00 54.58 52.49 3gqo n ASN 99 Cb 0.40 -0.01 0.03 0.00 -0.61 0.00 0.00 39.78 39.59 3gqo n ASN 99 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3gqo n ASN 100 N 0.80 -4.60 -4.72 6.41 4.13 -0.77 -4.93 115.26 111.59 3gqo n ASN 100 Ca 0.16 -0.76 -0.42 0.00 1.68 0.00 0.00 54.58 55.25 3gqo n ASN 100 Cb 0.48 -4.03 -0.03 0.00 -1.54 0.00 0.00 39.78 34.66 3gqo n ASN 100 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 3gqo s TYR 101 N -3.34 3.30 -0.11 3.10 2.02 -0.61 -4.93 117.35 116.78 3gqo s TYR 101 Ca 0.59 1.06 0.20 0.00 -0.37 0.00 0.00 57.07 58.54 3gqo s TYR 101 Cb -0.29 -3.61 -0.27 0.00 -0.40 0.00 0.00 41.96 37.39 3gqo s TYR 101 CO 0.82 -2.07 0.38 1.63 -1.57 0.00 0.00 175.55 174.73 3gqo n LYS 102 N 3.87 0.67 -3.77 -0.62 4.76 -1.26 -4.40 118.16 117.40 3gqo n LYS 102 Ca 0.11 -0.06 -0.13 0.00 -2.87 0.00 0.00 58.31 55.35 3gqo n LYS 102 Cb 0.43 -1.56 -0.14 0.00 -1.84 0.00 0.00 35.03 31.92 3gqo n LYS 102 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 3gqo s SER 103 N -5.08 -0.14 -0.09 4.39 1.04 -1.26 0.36 113.70 112.92 3gqo s SER 103 Ca -0.08 0.33 -0.10 0.00 0.48 0.00 0.00 55.95 56.58 3gqo s SER 103 Cb 0.10 0.25 0.02 0.00 0.10 0.00 0.00 66.02 66.50 3gqo s SER 103 CO 0.86 -0.12 0.27 0.54 0.98 0.00 0.00 173.24 175.77 3gqo s VAL 104 N 0.82 0.01 -0.13 5.02 0.11 -0.54 -3.97 120.40 121.72 3gqo s VAL 104 Ca -0.06 -0.10 0.01 0.00 -2.93 0.00 0.00 61.98 58.90 3gqo s VAL 104 Cb -0.08 -0.41 -0.01 0.00 -1.53 0.00 0.00 36.38 34.35 3gqo s VAL 104 CO -0.04 -0.05 -0.16 0.00 -3.33 0.00 0.00 175.10 171.52 3gqo s ALA 105 N -0.11 2.49 -0.05 1.54 0.00 -0.11 -0.14 121.76 125.37 3gqo s ALA 105 Ca -0.02 -0.97 0.02 0.00 0.00 0.00 0.00 51.96 50.99 3gqo s ALA 105 Cb -0.03 -1.15 0.02 0.00 0.00 0.00 0.00 23.12 21.96 3gqo s ALA 105 CO 0.01 0.14 -0.08 0.42 0.00 0.00 0.00 175.76 176.25 3gqo s ILE 106 N 0.54 0.82 0.74 0.00 1.01 -0.24 0.03 121.20 124.09 3gqo s ILE 106 Ca -0.10 -0.29 -0.07 0.00 0.00 0.00 0.00 60.65 60.19 3gqo s ILE 106 Cb -0.16 -0.78 0.09 0.00 0.01 0.00 0.00 42.46 41.62 3gqo s ILE 106 CO 0.04 0.28 1.05 -2.16 0.00 0.00 0.00 174.94 174.15 3gqo s PRO 107 N 0.76 1.88 -0.69 2.79 0.04 -1.26 -0.99 135.00 137.54 3gqo s PRO 107 Ca -0.13 -0.45 -0.24 0.00 0.04 0.00 0.00 61.00 60.22 3gqo s PRO 107 Cb -0.15 -2.16 0.06 0.00 0.04 0.00 0.00 34.50 32.29 3gqo s PRO 107 CO 0.02 -1.44 1.07 -0.51 0.04 0.00 0.00 177.00 176.18 3gqo s LEU 108 N -5.31 3.99 0.58 -3.56 1.43 -1.25 -4.88 118.68 109.69 3gqo s LEU 108 Ca 0.63 -0.82 -0.20 0.00 -1.03 0.00 0.00 54.13 52.71 3gqo s LEU 108 Cb -0.09 -2.46 -0.04 0.00 0.03 0.00 0.00 46.19 43.63 3gqo s LEU 108 CO 0.46 -1.57 1.28 0.18 0.23 0.00 0.00 176.35 176.92 3gqo n LEU 109 N 8.25 5.37 -0.72 1.79 4.77 -1.26 -3.05 117.00 132.15 3gqo n LEU 109 Ca -0.02 0.91 -0.09 0.00 -0.03 0.00 0.00 56.01 56.79 3gqo n LEU 109 Cb 0.47 -1.54 -0.04 0.00 -2.33 0.00 0.00 43.42 39.97 3gqo n LEU 109 CO 0.66 -0.89 -0.09 -1.20 -1.33 0.00 0.00 177.39 174.54 3gqo n SER 110 N -1.19 -5.40 -0.38 -1.43 7.64 -1.26 -4.80 113.62 106.79 3gqo n SER 110 Ca 0.12 0.23 0.09 0.00 1.01 0.00 0.00 58.87 60.33 3gqo n SER 110 Cb 0.46 -3.73 -0.02 0.00 -1.01 0.00 0.00 64.21 59.91 3gqo n SER 110 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3gqo n THR 111 N -2.30 0.00 0.00 0.44 -2.24 -1.17 -3.11 114.28 105.90 3gqo n THR 111 Ca -0.09 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 3gqo n THR 111 Cb 0.52 1.20 0.00 0.00 -2.10 0.00 0.00 70.33 69.95 3gqo n THR 111 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gqo n GLY 112 N 1.30 0.99 0.38 3.38 0.00 -1.26 -4.67 105.19 105.31 3gqo n GLY 112 Ca 0.07 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.29 3gqo n GLY 112 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3gqo h ILE 113 N 0.00 0.56 -0.51 -0.61 2.04 -1.98 -1.55 117.51 115.45 3gqo h ILE 113 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 3gqo h ILE 113 Cb 0.00 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 3gqo h ILE 113 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 178.15 178.64 3gqo n PHE 114 N -4.04 0.67 0.19 1.37 3.01 -1.26 -4.58 117.46 112.82 3gqo n PHE 114 Ca 0.08 -0.37 0.06 0.00 1.01 0.00 0.00 57.45 58.23 3gqo n PHE 114 Cb 0.57 -0.00 0.33 0.00 -0.01 0.00 0.00 39.48 40.37 3gqo n PHE 114 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3gqo h SER 115 N 4.06 0.00 -0.19 4.37 4.64 -1.21 0.92 113.55 126.14 3gqo h SER 115 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 3gqo h SER 115 Cb 0.94 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.00 3gqo h SER 115 CO 0.00 0.36 -0.07 0.61 -0.87 0.00 0.00 176.83 176.86 3gqo n GLY 116 N 0.29 0.69 3.37 -0.77 0.00 -1.26 -3.43 105.19 104.07 3gqo n GLY 116 Ca -0.00 -0.88 -0.18 0.00 0.00 0.00 0.00 46.02 44.97 3gqo n GLY 116 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3gqo n ASN 117 N 1.32 -2.78 -4.12 1.61 4.13 -1.26 -4.96 115.26 109.19 3gqo n ASN 117 Ca -0.04 -0.58 -0.18 0.00 1.68 0.00 0.00 54.58 55.46 3gqo n ASN 117 Cb 0.13 -4.93 -0.13 0.00 -1.54 0.00 0.00 39.78 33.31 3gqo n ASN 117 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3gqo s LYS 118 N -5.48 0.78 -0.13 3.52 -0.14 -1.22 -5.11 119.74 111.96 3gqo s LYS 118 Ca 0.10 -0.78 -0.29 0.00 -1.36 0.00 0.00 55.97 53.64 3gqo s LYS 118 Cb -0.04 -0.74 -0.03 0.00 -1.68 0.00 0.00 37.83 35.34 3gqo s LYS 118 CO 0.70 0.17 1.47 0.34 -0.76 0.00 0.00 175.35 177.28 3gqo s ASP 119 N -1.35 6.75 -0.03 2.83 -1.08 -1.26 -4.87 116.67 117.65 3gqo s ASP 119 Ca -0.02 1.89 0.05 0.00 -0.52 0.00 0.00 52.55 53.95 3gqo s ASP 119 Cb -0.09 -2.54 0.07 0.00 -1.46 0.00 0.00 42.92 38.91 3gqo s ASP 119 CO 0.01 -0.90 0.99 0.54 0.52 0.00 0.00 175.17 176.33 3gqo n ARG 120 N 6.98 2.21 -0.10 4.34 1.74 -1.26 -4.83 116.66 125.74 3gqo n ARG 120 Ca 0.16 -1.66 -0.04 0.00 -0.77 0.00 0.00 57.85 55.53 3gqo n ARG 120 Cb 0.44 -1.06 -0.03 0.00 -1.02 0.00 0.00 32.46 30.78 3gqo n ARG 120 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3gqo h LEU 121 N 0.00 -0.68 -0.38 0.55 6.46 -1.92 0.38 115.31 119.73 3gqo h LEU 121 Ca 0.00 0.10 0.08 0.00 -0.12 0.00 0.00 57.88 57.93 3gqo h LEU 121 Cb 0.70 0.29 -0.07 0.00 -0.73 0.00 0.00 40.66 40.84 3gqo h LEU 121 CO 0.00 -0.10 -0.10 0.74 -0.62 0.00 0.00 178.44 178.36 3gqo h THR 122 N -0.06 0.60 -0.33 1.05 2.02 -1.99 0.21 112.91 114.42 3gqo h THR 122 Ca 0.04 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.24 3gqo h THR 122 Cb 0.16 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.15 3gqo h THR 122 CO -0.26 0.00 0.19 -0.61 0.37 0.00 0.00 175.52 175.20 3gqo h GLN 123 N -0.01 0.37 -0.14 6.66 4.15 -1.75 -0.06 115.11 124.32 3gqo h GLN 123 Ca 0.18 -0.02 -0.18 0.00 0.77 0.00 0.00 58.65 59.40 3gqo h GLN 123 Cb 0.29 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 27.89 3gqo h GLN 123 CO -0.40 0.25 -0.66 1.03 -1.93 0.00 0.00 178.83 177.12 3gqo h SER 124 N 0.38 0.65 -0.26 -0.69 0.87 0.52 -2.86 113.55 112.18 3gqo h SER 124 Ca 0.13 -0.39 -0.02 0.00 -1.23 0.00 0.00 61.79 60.28 3gqo h SER 124 Cb 0.01 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.77 3gqo h SER 124 CO -0.07 1.14 0.10 0.25 -0.53 0.00 0.00 176.83 177.72 3gqo h LEU 125 N 0.41 0.36 -0.50 2.23 5.85 -0.32 -2.05 115.31 121.28 3gqo h LEU 125 Ca -0.02 -0.17 0.05 0.00 0.84 0.00 0.00 57.88 58.58 3gqo h LEU 125 Cb 1.24 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.13 3gqo h LEU 125 CO 0.12 0.43 0.25 0.78 -0.34 0.00 0.00 178.44 179.69 3gqo h ASN 126 N 0.26 0.36 0.23 1.25 2.35 -0.96 0.16 115.58 119.22 3gqo h ASN 126 Ca 0.09 0.03 -0.08 0.00 -0.55 0.00 0.00 56.30 55.78 3gqo h ASN 126 Cb 0.19 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 3gqo h ASN 126 CO -0.01 0.25 -0.32 0.45 -1.65 0.00 0.00 177.43 176.15 3gqo h HIS 127 N 0.49 0.16 0.09 1.19 3.86 -1.42 -1.01 115.15 118.51 3gqo h HIS 127 Ca 0.22 -0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.39 3gqo h HIS 127 Cb 0.14 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 28.57 3gqo h HIS 127 CO -0.10 0.46 -0.04 1.25 0.86 0.00 0.00 177.93 180.35 3gqo h LEU 128 N 0.13 -0.10 -1.48 2.43 6.46 -0.50 -2.89 115.31 119.36 3gqo h LEU 128 Ca 0.02 -0.27 -0.06 0.00 -0.12 0.00 0.00 57.88 57.45 3gqo h LEU 128 Cb 0.63 0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.58 3gqo h LEU 128 CO 0.05 0.22 -0.27 -0.07 -0.62 0.00 0.00 178.44 177.75 3gqo h LEU 129 N -0.42 0.00 -0.18 2.25 3.38 -0.41 -1.35 115.31 118.57 3gqo h LEU 129 Ca -0.01 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 3gqo h LEU 129 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 3gqo h LEU 129 CO 0.02 0.27 -0.41 0.74 0.09 0.00 0.00 178.44 179.15 3gqo h THR 130 N 0.00 1.33 0.08 0.22 2.02 -1.16 -2.26 112.91 113.14 3gqo h THR 130 Ca -0.00 -1.65 -0.23 0.00 0.77 0.00 0.00 66.41 65.30 3gqo h THR 130 Cb 0.49 1.91 0.02 0.00 -1.74 0.00 0.00 68.15 68.83 3gqo h THR 130 CO 0.03 0.51 -0.93 0.00 0.37 0.00 0.00 175.52 175.50 3gqo h ALA 131 N 0.58 0.01 0.00 6.16 0.00 -1.35 -3.31 119.26 121.34 3gqo h ALA 131 Ca 0.00 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.23 3gqo h ALA 131 Cb 1.01 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3gqo h ALA 131 CO 0.09 0.51 0.00 -0.07 0.00 0.00 0.00 179.25 179.78 3gqo h LEU 132 N 0.02 0.00 -2.35 0.00 -0.00 -1.32 -0.59 115.31 111.07 3gqo h LEU 132 Ca -0.14 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.74 3gqo h LEU 132 Cb 1.65 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.31 3gqo h LEU 132 CO 0.18 0.00 0.00 0.44 -0.00 0.00 0.00 178.44 179.06 3gqo h ASP 133 N 0.00 0.00 -0.39 -0.43 5.19 -1.49 -0.12 116.42 119.17 3gqo h ASP 133 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3gqo h ASP 133 Cb 0.61 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.12 3gqo h ASP 133 CO 0.00 0.00 0.00 0.35 -3.12 0.00 0.00 179.24 176.47 3gqo n THR 134 N -2.87 0.86 -4.60 0.35 -2.24 -0.23 -4.77 114.28 100.77 3gqo n THR 134 Ca -0.02 -0.62 -0.31 0.00 -2.27 0.00 0.00 64.05 60.83 3gqo n THR 134 Cb 0.10 0.08 -0.07 0.00 -2.10 0.00 0.00 70.33 68.34 3gqo n THR 134 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3gqo s THR 135 N -1.61 1.39 -1.60 4.28 -4.23 -0.06 -4.95 115.64 108.87 3gqo s THR 135 Ca 0.29 -1.92 0.13 0.00 -1.18 0.00 0.00 61.69 59.01 3gqo s THR 135 Cb 0.17 -2.32 0.14 0.00 1.34 0.00 0.00 72.50 71.84 3gqo s THR 135 CO 0.16 0.00 0.98 -0.67 -0.54 0.00 0.00 174.62 174.55 3gqo n ASP 136 N -1.28 2.27 -4.80 3.99 2.03 -1.26 -3.33 116.55 114.16 3gqo n ASP 136 Ca -0.14 -1.62 -0.35 0.00 0.52 0.00 0.00 54.79 53.19 3gqo n ASP 136 Cb 0.67 -0.04 -0.07 0.00 -0.72 0.00 0.00 41.12 40.96 3gqo n ASP 136 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3gqo s ALA 137 N -1.10 3.13 -0.44 -1.67 0.00 -1.26 -4.56 121.76 115.86 3gqo s ALA 137 Ca 0.17 0.45 -0.24 0.00 0.00 0.00 0.00 51.96 52.35 3gqo s ALA 137 Cb 0.12 -3.16 0.02 0.00 0.00 0.00 0.00 23.12 20.10 3gqo s ALA 137 CO 0.17 0.16 0.84 -0.51 0.00 0.00 0.00 175.76 176.42 3gqo s ASP 138 N -1.89 6.47 -0.25 0.00 1.01 0.16 -1.63 116.67 120.54 3gqo s ASP 138 Ca 0.56 0.05 -0.11 0.00 0.71 0.00 0.00 52.55 53.76 3gqo s ASP 138 Cb -0.14 -2.41 -0.05 0.00 1.01 0.00 0.00 42.92 41.33 3gqo s ASP 138 CO 0.19 -0.94 0.16 -0.69 0.21 0.00 0.00 175.17 174.10 3gqo s VAL 139 N 3.44 5.34 -0.47 -1.27 1.01 0.13 -1.46 120.40 127.11 3gqo s VAL 139 Ca 0.33 0.17 -0.17 0.00 0.00 0.00 0.00 61.98 62.31 3gqo s VAL 139 Cb -0.11 -3.50 0.06 0.00 0.00 0.00 0.00 36.38 32.83 3gqo s VAL 139 CO 0.23 0.33 0.46 0.00 0.00 0.00 0.00 175.10 176.12 3gqo s ALA 140 N 1.19 3.49 -0.08 5.51 0.00 0.80 -1.26 121.76 131.42 3gqo s ALA 140 Ca 0.07 -1.92 -0.27 0.00 0.00 0.00 0.00 51.96 49.84 3gqo s ALA 140 Cb -0.14 -3.14 -0.02 0.00 0.00 0.00 0.00 23.12 19.81 3gqo s ALA 140 CO 0.06 -1.78 0.89 0.42 0.00 0.00 0.00 175.76 175.34 3gqo s ILE 141 N 1.99 4.90 -0.15 0.00 1.01 0.28 -1.08 121.20 128.14 3gqo s ILE 141 Ca 0.08 1.82 -0.02 0.00 0.00 0.00 0.00 60.65 62.53 3gqo s ILE 141 Cb -0.22 -4.21 -0.02 0.00 0.01 0.00 0.00 42.46 38.02 3gqo s ILE 141 CO 0.09 0.12 -0.08 -0.31 0.00 0.00 0.00 174.94 174.76 3gqo s TYR 142 N 1.43 2.93 0.36 3.97 1.51 -0.16 -0.51 117.35 126.89 3gqo s TYR 142 Ca 0.45 -0.48 0.06 0.00 -1.01 0.00 0.00 57.07 56.09 3gqo s TYR 142 Cb -0.19 -1.92 -0.02 0.00 -0.11 0.00 0.00 41.96 39.72 3gqo s TYR 142 CO 0.20 -0.14 0.23 0.00 -1.11 0.00 0.00 175.55 174.73 3gqo n ARG 144 N -0.75 0.34 -4.51 0.00 3.00 -1.26 -1.41 116.66 112.06 3gqo n ARG 144 Ca 0.02 -0.02 -0.34 0.00 -0.00 0.00 0.00 57.85 57.51 3gqo n ARG 144 Cb 0.61 -0.27 -0.11 0.00 0.00 0.00 0.00 32.46 32.69 3gqo n ARG 144 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 3gqo s ASP 145 N -0.06 4.82 0.55 6.15 3.68 -1.26 -4.86 116.67 125.69 3gqo s ASP 145 Ca 0.00 -0.01 0.26 0.00 2.13 0.00 0.00 52.55 54.93 3gqo s ASP 145 Cb 0.00 -1.40 1.56 0.00 -1.45 0.00 0.00 42.92 41.63 3gqo s ASP 145 CO 0.00 0.32 2.16 0.11 0.13 0.00 0.00 175.17 177.89 3gqo h LYS 146 N 5.61 0.00 0.10 4.34 6.56 -1.99 -0.30 116.57 130.88 3gqo h LYS 146 Ca -0.44 0.00 -0.26 0.00 -1.06 0.00 0.00 60.65 58.89 3gqo h LYS 146 Cb 1.18 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.84 3gqo h LYS 146 CO 0.55 0.06 -1.18 0.87 -2.06 0.00 0.00 179.45 177.69 3gqo h LYS 147 N 0.00 0.21 -0.15 3.15 1.57 -2.00 -2.75 116.57 116.60 3gqo h LYS 147 Ca -0.00 -0.35 -0.15 0.00 -1.87 0.00 0.00 60.65 58.27 3gqo h LYS 147 Cb 0.14 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 3gqo h LYS 147 CO 0.01 1.17 -0.55 -1.49 -0.57 0.00 0.00 179.45 178.01 3gqo h TRP 148 N 0.06 0.56 0.14 -1.35 4.06 -1.72 -2.10 115.95 115.61 3gqo h TRP 148 Ca -0.10 -0.20 0.02 0.00 2.06 0.00 0.00 58.89 60.66 3gqo h TRP 148 Cb 1.92 -0.11 -0.03 0.00 -1.00 0.00 0.00 29.16 29.94 3gqo h TRP 148 CO 0.05 0.90 -0.29 1.49 -3.56 0.00 0.00 178.44 177.03 3gqo h GLU 149 N 0.34 -0.50 -0.30 0.49 4.81 -1.04 0.29 114.58 118.66 3gqo h GLU 149 Ca 0.00 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.30 3gqo h GLU 149 Cb 1.08 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 3gqo h GLU 149 CO 0.10 -0.34 0.13 1.98 -0.73 0.00 0.00 179.01 180.15 3gqo h MET 150 N -0.52 0.27 -0.44 1.92 4.05 -1.35 0.30 114.93 119.15 3gqo h MET 150 Ca 0.03 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.40 3gqo h MET 150 Cb 0.54 -0.06 -0.02 0.00 -0.80 0.00 0.00 31.60 31.26 3gqo h MET 150 CO -0.16 0.18 0.18 1.15 0.23 0.00 0.00 176.91 178.49 3gqo h THR 151 N 0.27 1.20 0.41 -0.77 2.02 -1.24 -1.16 112.91 113.65 3gqo h THR 151 Ca 0.13 -0.62 -0.01 0.00 0.77 0.00 0.00 66.41 66.67 3gqo h THR 151 Cb 0.07 0.79 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 3gqo h THR 151 CO -0.11 0.23 -0.26 -0.07 0.37 0.00 0.00 175.52 175.67 3gqo h LEU 152 N 0.57 -0.67 -1.18 2.58 3.38 0.08 -2.04 115.31 118.03 3gqo h LEU 152 Ca 0.15 0.04 0.17 0.00 0.09 0.00 0.00 57.88 58.33 3gqo h LEU 152 Cb 0.19 0.20 -0.09 0.00 0.09 0.00 0.00 40.66 41.06 3gqo h LEU 152 CO -0.01 -0.41 0.61 0.11 0.09 0.00 0.00 178.44 178.82 3gqo h LYS 153 N -0.65 0.70 -0.12 1.13 1.57 -0.28 -1.67 116.57 117.25 3gqo h LYS 153 Ca -0.04 -0.04 -0.19 0.00 -1.87 0.00 0.00 60.65 58.51 3gqo h LYS 153 Cb 0.54 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 3gqo h LYS 153 CO 0.04 0.46 -0.70 1.49 -0.57 0.00 0.00 179.45 180.17 3gqo h GLU 154 N 0.72 0.52 -0.13 3.15 4.81 -0.94 -2.52 114.58 120.19 3gqo h GLU 154 Ca 0.51 -0.40 -0.13 0.00 -0.13 0.00 0.00 59.36 59.21 3gqo h GLU 154 Cb 0.83 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.29 3gqo h GLU 154 CO -0.27 1.02 -0.44 0.00 -0.73 0.00 0.00 179.01 178.59 3gqo h ALA 155 N 0.87 0.23 -0.94 2.92 0.00 -0.74 -2.58 119.26 119.02 3gqo h ALA 155 Ca -0.03 -0.48 0.11 0.00 0.00 0.00 0.00 54.91 54.51 3gqo h ALA 155 Cb 1.28 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.97 3gqo h ALA 155 CO 0.13 0.36 0.57 0.28 0.00 0.00 0.00 179.25 180.59 3gqo h VAL 156 N 0.14 0.93 -0.27 0.00 2.07 -1.35 -2.53 116.25 115.24 3gqo h VAL 156 Ca -0.02 -0.32 -0.12 0.00 0.82 0.00 0.00 66.70 67.07 3gqo h VAL 156 Cb 1.07 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.75 3gqo h VAL 156 CO 0.09 0.17 -0.29 0.00 0.02 0.00 0.00 177.57 177.57 3gqo h ALA 157 N 1.50 0.40 -0.37 1.67 0.00 -1.46 -3.12 119.26 117.87 3gqo h ALA 157 Ca 0.45 -0.40 0.07 0.00 0.00 0.00 0.00 54.91 55.04 3gqo h ALA 157 Cb 0.41 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.03 3gqo h ALA 157 CO -0.25 0.41 -0.37 -0.09 0.00 0.00 0.00 179.25 178.94 3gqo h ARG 158 N 0.39 -0.29 -5.66 0.00 9.65 -1.03 -3.31 114.38 114.13 3gqo h ARG 158 Ca 0.04 0.02 -0.49 0.00 -1.10 0.00 0.00 59.98 58.45 3gqo h ARG 158 Cb 0.85 0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.50 3gqo h ARG 158 CO 0.07 -0.20 1.62 -2.13 2.80 0.00 0.00 179.97 182.13 3gqo n ARG 159 N -5.42 1.16 0.00 0.20 0.63 -1.10 -5.12 116.66 107.00 3gqo n ARG 159 Ca -0.00 0.09 0.00 0.00 -0.92 0.00 0.00 57.85 57.02 3gqo n ARG 159 Cb 0.35 -3.31 0.00 0.00 0.45 0.00 0.00 32.46 29.94 3gqo n ARG 159 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51