#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3how n THR 3 N 0.00 0.00 -4.22 1.09 -1.04 -1.26 -4.94 114.28 103.90 3how n THR 3 Ca 0.00 0.00 -0.23 0.00 -2.04 0.00 0.00 64.05 61.78 3how n THR 3 Cb 0.00 -0.16 -0.06 0.00 -1.82 0.00 0.00 70.33 68.28 3how n THR 3 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 3how s PHE 4 N 0.98 2.85 0.16 -1.42 2.19 -1.26 -5.08 117.98 116.40 3how s PHE 4 Ca 0.89 -0.17 0.03 0.00 0.33 0.00 0.00 56.93 58.01 3how s PHE 4 Cb -1.25 -1.29 -0.05 0.00 -1.31 0.00 0.00 43.02 39.12 3how s PHE 4 CO 0.61 0.57 -0.05 -0.98 1.83 0.00 0.00 175.22 177.20 3how s ARG 5 N -3.59 1.09 0.43 10.12 1.70 -1.26 -5.17 118.95 122.27 3how s ARG 5 Ca 0.31 -1.49 0.07 0.00 -0.47 0.00 0.00 55.73 54.15 3how s ARG 5 Cb -0.07 -0.47 -0.02 0.00 -0.57 0.00 0.00 34.95 33.81 3how s ARG 5 CO 0.21 -0.02 0.32 -0.06 -1.08 0.00 0.00 175.30 174.68 3how s PHE 6 N -3.47 2.57 0.43 5.89 2.99 -1.26 -4.15 117.98 120.98 3how s PHE 6 Ca 0.20 -0.56 -0.02 0.00 0.00 0.00 0.00 56.93 56.55 3how s PHE 6 Cb 0.04 -2.09 -0.03 0.00 0.00 0.00 0.00 43.02 40.95 3how s PHE 6 CO 0.02 -0.07 0.68 0.00 -0.00 0.00 0.00 175.22 175.85 3how n ARG 8 N -2.05 2.55 0.00 0.00 1.85 -1.26 -2.89 116.66 114.85 3how n ARG 8 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.84 3how n ARG 8 Cb 0.56 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.97 3how n ARG 8 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 3how n ASP 9 N 0.00 0.00 -1.72 2.89 9.92 -1.26 -2.65 116.55 123.74 3how n ASP 9 Ca 0.00 0.00 -0.18 0.00 -0.53 0.00 0.00 54.79 54.08 3how n ASP 9 Cb 0.00 0.00 0.11 0.00 -0.64 0.00 0.00 41.12 40.59 3how n ASP 9 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3how n ASN 11 N -0.93 0.00 -0.84 0.00 2.85 -1.08 -4.86 115.26 110.39 3how n ASN 11 Ca 0.43 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.90 3how n ASN 11 Cb 0.94 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.96 3how n ASN 11 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 3how n ASN 12 N 0.21 1.98 -4.93 1.20 5.03 -1.26 -4.91 115.26 112.59 3how n ASN 12 Ca 0.00 -0.42 -0.27 0.00 0.87 0.00 0.00 54.58 54.75 3how n ASN 12 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 38.73 3how n ASN 12 CO 0.00 0.00 0.00 -0.32 -1.83 0.00 0.00 177.26 175.11 3how s MET 13 N -0.27 3.52 -0.25 3.52 -2.45 -1.26 -3.12 119.30 118.99 3how s MET 13 Ca 0.00 -0.34 -0.05 0.00 -1.25 0.00 0.00 55.69 54.05 3how s MET 13 Cb 0.00 -2.84 -0.00 0.00 1.25 0.00 0.00 34.83 33.23 3how s MET 13 CO 0.00 0.40 0.01 -0.51 1.05 0.00 0.00 175.02 175.98 3how s LEU 14 N -3.31 3.30 -0.22 4.11 1.43 -1.26 -4.61 118.68 118.13 3how s LEU 14 Ca 0.38 -0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 52.87 3how s LEU 14 Cb -0.11 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 44.25 3how s LEU 14 CO 0.29 -0.08 0.20 -0.31 0.23 0.00 0.00 176.35 176.68 3how s TYR 15 N 1.50 3.36 0.08 0.29 1.51 -0.61 -4.63 117.35 118.85 3how s TYR 15 Ca 0.04 0.35 -0.31 0.00 -1.01 0.00 0.00 57.07 56.14 3how s TYR 15 Cb -0.15 -2.29 -0.09 0.00 -0.11 0.00 0.00 41.96 39.32 3how s TYR 15 CO -0.00 0.13 1.76 -1.25 -1.11 0.00 0.00 175.55 175.08 3how s PRO 16 N 0.86 4.16 0.31 -1.71 0.04 -1.26 -2.54 135.00 134.87 3how s PRO 16 Ca 0.10 2.46 0.09 0.00 0.04 0.00 0.00 61.00 63.69 3how s PRO 16 Cb -0.13 -3.71 -0.06 0.00 0.04 0.00 0.00 34.50 30.64 3how s PRO 16 CO 0.03 -0.82 -0.09 1.03 0.04 0.00 0.00 177.00 177.19 3how s ARG 17 N 3.04 1.71 -0.05 4.56 1.81 0.26 -4.98 118.95 125.30 3how s ARG 17 Ca 0.79 -1.86 0.04 0.00 -1.72 0.00 0.00 55.73 52.97 3how s ARG 17 Cb -0.42 -1.51 -0.03 0.00 -0.45 0.00 0.00 34.95 32.54 3how s ARG 17 CO 0.35 0.12 -0.15 -2.00 -0.68 0.00 0.00 175.30 172.95 3how s GLU 18 N -3.64 2.52 -1.18 3.54 2.12 -1.26 -1.98 118.70 118.82 3how s GLU 18 Ca 0.31 -0.70 -0.14 0.00 0.36 0.00 0.00 54.97 54.79 3how s GLU 18 Cb 0.02 -2.37 0.16 0.00 0.26 0.00 0.00 34.13 32.20 3how s GLU 18 CO 0.15 0.61 1.42 0.34 -0.54 0.00 0.00 175.26 177.23 3how s ASP 19 N -0.69 7.01 0.14 -1.70 -1.08 -1.01 -4.85 116.67 114.50 3how s ASP 19 Ca 0.11 -2.87 -0.30 0.00 -0.52 0.00 0.00 52.55 48.97 3how s ASP 19 Cb -0.11 -2.41 -0.05 0.00 -1.46 0.00 0.00 42.92 38.89 3how s ASP 19 CO 0.01 -0.80 1.56 0.11 0.52 0.00 0.00 175.17 176.57 3how h LYS 20 N 7.36 -0.38 -0.20 4.34 1.57 -1.96 0.28 116.57 127.58 3how h LYS 20 Ca 0.31 0.03 0.03 0.00 -1.87 0.00 0.00 60.65 59.14 3how h LYS 20 Cb 0.89 0.09 -0.05 0.00 0.08 0.00 0.00 32.23 33.24 3how h LYS 20 CO 1.24 -0.25 -0.32 1.49 -0.57 0.00 0.00 179.45 181.04 3how h GLU 21 N -0.39 -0.25 0.00 3.15 4.81 -1.99 -3.17 114.58 116.74 3how h GLU 21 Ca 0.10 0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3how h GLU 21 Cb 0.60 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.04 3how h GLU 21 CO -0.56 -0.17 -0.55 -0.91 -0.73 0.00 0.00 179.01 176.10 3how h ASN 22 N -0.26 0.00 -3.79 1.04 2.35 -1.96 -3.49 115.58 109.47 3how h ASN 22 Ca 0.04 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.61 3how h ASN 22 Cb 0.36 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.73 3how h ASN 22 CO -0.33 0.09 -0.15 0.59 -1.65 0.00 0.00 177.43 175.99 3how n ASN 23 N -2.16 -4.05 -3.51 5.81 3.02 0.99 -5.10 115.26 110.26 3how n ASN 23 Ca 0.03 0.16 -0.11 0.00 -0.03 0.00 0.00 54.58 54.63 3how n ASN 23 Cb 0.44 -2.51 -0.03 0.00 -0.61 0.00 0.00 39.78 37.07 3how n ASN 23 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3how s ARG 24 N -1.77 0.86 0.19 3.52 1.70 -1.23 -5.02 118.95 117.20 3how s ARG 24 Ca 0.07 -0.14 -0.19 0.00 -0.47 0.00 0.00 55.73 55.00 3how s ARG 24 Cb -0.02 0.40 -0.08 0.00 -0.57 0.00 0.00 34.95 34.68 3how s ARG 24 CO 0.26 -0.34 0.68 -1.17 -1.08 0.00 0.00 175.30 173.65 3how s LEU 25 N -2.01 4.38 -0.03 -1.89 2.96 -1.26 -2.39 118.68 118.44 3how s LEU 25 Ca 0.01 1.36 0.01 0.00 -0.22 0.00 0.00 54.13 55.28 3how s LEU 25 Cb -0.01 -3.43 0.02 0.00 0.50 0.00 0.00 46.19 43.28 3how s LEU 25 CO -0.04 0.09 -0.00 -0.76 -1.32 0.00 0.00 176.35 174.31 3how s LEU 26 N -1.81 1.28 0.23 -0.68 1.43 -0.84 -0.85 118.68 117.45 3how s LEU 26 Ca 0.40 -0.03 0.05 0.00 -1.03 0.00 0.00 54.13 53.52 3how s LEU 26 Cb -0.17 -0.21 -0.03 0.00 0.03 0.00 0.00 46.19 45.80 3how s LEU 26 CO 0.21 -0.08 0.34 -0.36 0.23 0.00 0.00 176.35 176.69 3how s PHE 27 N 0.87 3.43 0.36 0.29 2.99 -0.11 0.91 117.98 126.72 3how s PHE 27 Ca -0.09 -0.02 -0.16 0.00 0.00 0.00 0.00 56.93 56.66 3how s PHE 27 Cb -0.12 -1.56 0.06 0.00 0.00 0.00 0.00 43.02 41.39 3how s PHE 27 CO -0.01 0.45 0.82 -1.83 -0.00 0.00 0.00 175.22 174.65 3how s GLU 28 N -3.92 2.12 -0.00 0.44 -1.05 -1.05 -1.62 118.70 113.62 3how s GLU 28 Ca 0.34 -1.37 0.04 0.00 -0.15 0.00 0.00 54.97 53.84 3how s GLU 28 Cb -0.09 0.59 -0.03 0.00 -0.44 0.00 0.00 34.13 34.16 3how s GLU 28 CO 0.29 -0.99 -0.12 0.00 0.95 0.00 0.00 175.26 175.39 3how n ARG 30 N 1.76 2.26 -0.14 0.00 1.74 -1.26 -4.47 116.66 116.55 3how n ARG 30 Ca -0.16 -1.70 -0.28 0.00 -0.77 0.00 0.00 57.85 54.94 3how n ARG 30 Cb 0.52 -1.19 -0.10 0.00 -1.02 0.00 0.00 32.46 30.67 3how n ARG 30 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 3how n THR 31 N 0.31 1.53 -2.95 0.55 -1.04 -1.26 -5.03 114.28 106.38 3how n THR 31 Ca 0.08 -0.41 0.00 0.00 -2.04 0.00 0.00 64.05 61.68 3how n THR 31 Cb 0.34 -1.82 0.00 0.00 -1.82 0.00 0.00 70.33 67.03 3how n THR 31 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3how n SER 33 N 0.00 2.81 -4.46 0.00 7.64 -1.26 -4.64 113.62 113.71 3how n SER 33 Ca 0.00 -1.85 -0.36 0.00 1.01 0.00 0.00 58.87 57.67 3how n SER 33 Cb 0.00 -0.19 0.07 0.00 -1.01 0.00 0.00 64.21 63.08 3how n SER 33 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3how n TYR 34 N 0.79 -0.88 -3.64 1.43 -0.00 -1.26 -4.85 117.16 108.74 3how n TYR 34 Ca 0.12 0.35 -0.05 0.00 -0.00 0.00 0.00 57.90 58.32 3how n TYR 34 Cb 0.43 -1.91 -0.06 0.00 -0.00 0.00 0.00 39.34 37.80 3how n TYR 34 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.86 176.94 3how s VAL 35 N -1.91 -0.26 0.06 2.97 1.01 -1.26 -2.68 120.40 118.33 3how s VAL 35 Ca 0.65 0.00 0.03 0.00 0.00 0.00 0.00 61.98 62.66 3how s VAL 35 Cb -0.35 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.00 3how s VAL 35 CO 0.58 0.00 -0.09 -1.83 0.00 0.00 0.00 175.10 173.76 3how s GLU 36 N 1.97 0.66 0.51 2.72 -1.05 -0.64 -5.00 118.70 117.87 3how s GLU 36 Ca -0.09 -0.92 -0.21 0.00 -0.15 0.00 0.00 54.97 53.61 3how s GLU 36 Cb -0.07 -0.43 -0.07 0.00 -0.44 0.00 0.00 34.13 33.13 3how s GLU 36 CO -0.20 0.07 1.13 -1.83 0.95 0.00 0.00 175.26 175.39 3how s GLU 37 N -2.02 3.54 0.52 -4.83 -1.05 -1.26 -0.94 118.70 112.66 3how s GLU 37 Ca -0.04 1.63 -0.22 0.00 -0.15 0.00 0.00 54.97 56.19 3how s GLU 37 Cb -0.07 -2.14 -0.06 0.00 -0.44 0.00 0.00 34.13 31.42 3how s GLU 37 CO 0.00 -0.70 1.32 0.00 0.95 0.00 0.00 175.26 176.83 3how s ALA 38 N -1.72 2.88 -0.04 -0.84 0.00 -0.03 -4.77 121.76 117.25 3how s ALA 38 Ca 0.69 1.25 -0.14 0.00 0.00 0.00 0.00 51.96 53.76 3how s ALA 38 Cb -0.24 -3.53 -0.31 0.00 0.00 0.00 0.00 23.12 19.04 3how s ALA 38 CO 0.28 -1.19 0.74 0.78 0.00 0.00 0.00 175.76 176.37 3how h GLY 39 N 1.66 0.46 -3.90 0.00 0.00 -1.93 -3.48 103.07 95.88 3how h GLY 39 Ca -0.51 -1.18 -0.13 0.00 0.00 0.00 0.00 47.33 45.52 3how h GLY 39 CO 0.58 1.03 -0.60 -0.45 0.00 0.00 0.00 176.54 177.10 3how s SER 40 N -7.30 0.29 0.00 0.19 0.15 -1.26 -5.04 113.70 100.73 3how s SER 40 Ca -0.15 -0.69 0.26 0.00 0.70 0.00 0.00 55.95 56.07 3how s SER 40 Cb 0.05 0.20 1.53 0.00 -1.71 0.00 0.00 66.02 66.09 3how s SER 40 CO 0.86 -0.51 1.90 -0.81 1.20 0.00 0.00 173.24 175.88 3how n PRO 41 N 0.66 0.78 -3.00 5.44 -0.04 -1.26 -4.68 135.00 132.90 3how n PRO 41 Ca -0.18 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.85 3how n PRO 41 Cb 0.59 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.49 3how n PRO 41 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3how s LEU 42 N -2.04 4.36 -0.16 1.53 2.96 -1.26 -4.90 118.68 119.17 3how s LEU 42 Ca 0.38 -0.28 0.06 0.00 -0.22 0.00 0.00 54.13 54.08 3how s LEU 42 Cb 0.18 -2.84 -0.23 0.00 0.50 0.00 0.00 46.19 43.80 3how s LEU 42 CO 0.31 -0.92 0.20 0.52 -1.32 0.00 0.00 176.35 175.13 3how n VAL 43 N 6.03 1.56 -3.82 1.68 0.31 -1.26 -4.92 118.33 117.92 3how n VAL 43 Ca 0.00 -0.72 -0.12 0.00 -0.01 0.00 0.00 64.34 63.49 3how n VAL 43 Cb 0.48 -1.16 -0.10 0.00 -0.91 0.00 0.00 33.84 32.15 3how n VAL 43 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 3how s TYR 44 N -2.54 -0.09 -0.07 3.52 5.04 -1.26 -5.06 117.35 116.88 3how s TYR 44 Ca -0.18 0.15 -0.04 0.00 -2.44 0.00 0.00 57.07 54.56 3how s TYR 44 Cb 0.07 0.03 0.03 0.00 0.35 0.00 0.00 41.96 42.45 3how s TYR 44 CO 0.75 -0.29 0.17 0.50 -1.34 0.00 0.00 175.55 175.34 3how s ARG 45 N -1.07 0.14 -0.12 4.97 6.06 -1.26 -5.08 118.95 122.60 3how s ARG 45 Ca -0.11 0.37 -0.09 0.00 -2.50 0.00 0.00 55.73 53.39 3how s ARG 45 Cb -0.06 -0.10 -0.03 0.00 0.06 0.00 0.00 34.95 34.82 3how s ARG 45 CO 0.02 -0.13 -0.18 1.58 -2.50 0.00 0.00 175.30 174.09 3how n HIS 46 N 3.93 0.47 -2.52 5.12 -0.00 -1.26 -5.09 115.22 115.88 3how n HIS 46 Ca -0.23 0.21 -0.02 0.00 -0.00 0.00 0.00 57.72 57.68 3how n HIS 46 Cb 0.54 -0.56 0.00 0.00 -0.00 0.00 0.00 29.99 29.97 3how n HIS 46 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.34 174.43 3how n GLU 47 N -4.03 -2.63 -0.02 1.57 2.13 -1.26 -5.00 120.64 111.40 3how n GLU 47 Ca -0.07 2.24 -0.03 0.00 0.66 0.00 0.00 57.16 59.95 3how n GLU 47 Cb 0.27 -4.67 -0.02 0.00 0.27 0.00 0.00 31.44 27.29 3how n GLU 47 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 3how h LEU 48 N 2.26 -0.06 -7.39 4.31 3.38 -2.08 -3.38 115.31 112.36 3how h LEU 48 Ca 0.00 -0.14 -0.74 0.00 0.09 0.00 0.00 57.88 57.09 3how h LEU 48 Cb 0.21 0.02 -0.17 0.00 0.09 0.00 0.00 40.66 40.81 3how h LEU 48 CO 0.10 0.50 1.54 -0.38 0.09 0.00 0.00 178.44 180.29 3how n ILE 49 N -4.81 4.28 -0.82 1.22 5.41 -1.26 -4.99 119.36 118.39 3how n ILE 49 Ca -0.02 -4.64 -0.29 0.00 1.00 0.00 0.00 62.75 58.79 3how n ILE 49 Cb 0.10 -2.44 0.23 0.00 -0.71 0.00 0.00 39.64 36.82 3how n ILE 49 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 3how s THR 50 N 1.26 1.81 0.00 1.39 2.01 -1.26 -5.01 115.64 115.84 3how s THR 50 Ca 0.42 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.42 3how s THR 50 Cb 0.00 -2.28 0.00 0.00 0.01 0.00 0.00 72.50 70.23 3how s THR 50 CO 0.00 0.00 0.00 0.59 -0.69 0.00 0.00 174.62 174.52 3how n ASN 51 N -4.78 0.00 -4.58 3.53 4.13 -1.26 -5.08 115.26 107.21 3how n ASN 51 Ca 0.07 0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.91 3how n ASN 51 Cb 0.57 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.79 3how n ASN 51 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 3how s ILE 52 N 0.00 3.82 0.00 2.41 -4.36 -1.26 -2.05 121.20 119.76 3how s ILE 52 Ca 0.00 0.75 0.00 0.00 -0.26 0.00 0.00 60.65 61.14 3how s ILE 52 Cb 0.00 -4.34 0.00 0.00 1.25 0.00 0.00 42.46 39.37 3how s ILE 52 CO 0.00 -1.01 0.00 0.61 0.24 0.00 0.00 174.94 174.78 3how n GLY 53 N 5.21 0.73 0.45 6.27 0.00 -1.26 -4.99 105.19 111.60 3how n GLY 53 Ca 0.14 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.40 3how n GLY 53 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3how h GLU 54 N 0.00 0.00 -0.63 1.61 5.08 -1.72 -2.23 114.58 116.68 3how h GLU 54 Ca 0.00 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.05 3how h GLU 54 Cb 0.00 0.00 -0.27 0.00 0.50 0.00 0.00 28.75 28.98 3how h GLU 54 CO 0.00 0.00 -0.78 2.41 -1.00 0.00 0.00 179.01 179.64 3how n THR 55 N -3.47 0.30 -0.56 1.13 -1.04 -1.26 -3.08 114.28 106.30 3how n THR 55 Ca 0.15 -2.48 -0.28 0.00 -2.04 0.00 0.00 64.05 59.40 3how n THR 55 Cb 1.04 0.78 0.26 0.00 -1.82 0.00 0.00 70.33 70.59 3how n THR 55 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3how s ALA 56 N -1.29 -0.57 0.00 2.41 0.00 -0.84 -4.55 121.76 116.93 3how s ALA 56 Ca 0.26 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.02 3how s ALA 56 Cb 0.39 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 20.30 3how s ALA 56 CO -0.04 -3.92 0.00 0.41 0.00 0.00 0.00 175.76 172.21 3how n GLY 57 N 0.75 0.00 2.51 0.00 0.00 -1.26 -4.94 105.19 102.26 3how n GLY 57 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 3how n GLY 57 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3how n VAL 58 N 1.43 0.69 -1.07 1.61 0.31 -1.26 -5.08 118.33 114.97 3how n VAL 58 Ca 0.00 -3.59 -0.36 0.00 -0.01 0.00 0.00 64.34 60.38 3how n VAL 58 Cb 0.00 0.32 0.06 0.00 -0.91 0.00 0.00 33.84 33.31 3how n VAL 58 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3how n VAL 59 N 0.03 0.44 0.91 2.52 0.31 -1.26 -4.74 118.33 116.54 3how n VAL 59 Ca 0.15 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 3how n VAL 59 Cb 0.76 -0.31 0.00 0.00 -0.91 0.00 0.00 33.84 33.38 3how n VAL 59 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 3how n GLN 60 N 0.67 0.81 0.00 5.55 -0.06 -1.26 -1.04 117.38 122.05 3how n GLN 60 Ca 0.04 0.00 0.05 0.00 -2.00 0.00 0.00 57.00 55.10 3how n GLN 60 Cb 0.52 -1.36 0.00 0.00 -4.06 0.00 0.00 30.24 25.35 3how n GLN 60 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 3how n ASP 61 N 0.02 1.26 -0.08 1.69 8.00 -1.26 -4.55 116.55 121.63 3how n ASP 61 Ca 0.00 -1.13 0.00 0.00 0.71 0.00 0.00 54.79 54.37 3how n ASP 61 Cb 0.18 0.45 0.00 0.00 -0.02 0.00 0.00 41.12 41.73 3how n ASP 61 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3how n ILE 62 N -0.21 0.00 -0.02 0.53 3.06 -0.20 0.21 119.36 122.73 3how n ILE 62 Ca 0.04 0.00 0.02 0.00 -2.50 0.00 0.00 62.75 60.31 3how n ILE 62 Cb 0.22 -0.42 -0.07 0.00 0.54 0.00 0.00 39.64 39.91 3how n ILE 62 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3how n GLY 63 N -0.32 -0.41 0.19 4.50 0.00 -1.26 -4.54 105.19 103.35 3how n GLY 63 Ca 0.00 -0.19 0.14 0.00 0.00 0.00 0.00 46.02 45.97 3how n GLY 63 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3how n SER 64 N -1.96 0.68 -4.53 1.61 3.41 0.58 -4.73 113.62 108.67 3how n SER 64 Ca -0.05 -0.86 -0.42 0.00 -0.26 0.00 0.00 58.87 57.28 3how n SER 64 Cb 0.40 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 3how n SER 64 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3how s ASP 65 N -2.31 6.25 0.46 4.04 -1.08 -1.21 -4.88 116.67 117.95 3how s ASP 65 Ca 0.33 -0.43 0.21 0.00 -0.52 0.00 0.00 52.55 52.13 3how s ASP 65 Cb 0.20 -2.51 1.20 0.00 -1.46 0.00 0.00 42.92 40.36 3how s ASP 65 CO 0.44 -1.58 1.92 1.55 0.52 0.00 0.00 175.17 178.01 3how h PRO 66 N 9.71 0.25 -0.69 4.34 0.13 -1.95 -2.48 132.00 141.31 3how h PRO 66 Ca -0.27 -0.02 0.14 0.00 -0.87 0.00 0.00 66.00 64.98 3how h PRO 66 Cb 1.06 -0.06 -0.04 0.00 0.13 0.00 0.00 31.00 32.09 3how h PRO 66 CO 1.21 0.17 0.47 1.79 -0.23 0.00 0.00 178.00 181.40 3how h THR 67 N 0.26 0.80 -4.07 1.56 1.35 -1.98 -3.43 112.91 107.40 3how h THR 67 Ca 0.37 -0.12 -0.47 0.00 -0.55 0.00 0.00 66.41 65.65 3how h THR 67 Cb 1.08 0.43 0.02 0.00 -1.73 0.00 0.00 68.15 67.95 3how h THR 67 CO -0.09 0.06 0.38 -0.76 -0.25 0.00 0.00 175.52 174.87 3how s LEU 68 N -9.24 3.86 0.50 3.87 1.43 -0.94 -5.05 118.68 113.12 3how s LEU 68 Ca -0.07 1.92 -0.19 0.00 -1.03 0.00 0.00 54.13 54.76 3how s LEU 68 Cb 0.21 -4.55 -0.08 0.00 0.03 0.00 0.00 46.19 41.80 3how s LEU 68 CO 0.76 -0.75 1.01 -2.16 0.23 0.00 0.00 176.35 175.44 3how s PRO 69 N -3.21 3.82 -0.26 1.29 0.04 -1.26 -4.98 135.00 130.43 3how s PRO 69 Ca 0.67 1.19 -0.03 0.00 0.04 0.00 0.00 61.00 62.87 3how s PRO 69 Cb -0.16 -2.11 0.03 0.00 0.04 0.00 0.00 34.50 32.30 3how s PRO 69 CO 0.20 -0.39 -0.02 1.03 0.04 0.00 0.00 177.00 177.85 3how s ARG 70 N -3.58 2.84 0.02 4.56 1.81 -1.26 -3.26 118.95 120.08 3how s ARG 70 Ca 0.64 -0.99 -0.01 0.00 -1.72 0.00 0.00 55.73 53.65 3how s ARG 70 Cb -0.13 -3.09 -0.04 0.00 -0.45 0.00 0.00 34.95 31.24 3how s ARG 70 CO 0.24 -0.43 0.13 -1.54 -0.68 0.00 0.00 175.30 173.02 3how s SER 71 N 1.35 5.97 -0.23 0.23 1.04 -1.10 -4.96 113.70 116.01 3how s SER 71 Ca 0.00 0.20 0.11 0.00 0.48 0.00 0.00 55.95 56.75 3how s SER 71 Cb -0.17 -1.77 0.72 0.00 0.10 0.00 0.00 66.02 64.89 3how s SER 71 CO -0.03 0.24 1.63 -0.90 0.98 0.00 0.00 173.24 175.16 3how n ASP 72 N 0.87 5.07 -4.77 7.02 5.75 -1.26 -2.64 116.55 126.58 3how n ASP 72 Ca -0.10 -2.88 -0.31 0.00 -0.01 0.00 0.00 54.79 51.48 3how n ASP 72 Cb 0.52 -0.68 0.09 0.00 -1.03 0.00 0.00 41.12 40.03 3how n ASP 72 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 3how s ARG 73 N -2.60 2.14 -0.06 0.11 0.52 -1.26 -4.73 118.95 113.08 3how s ARG 73 Ca 0.49 0.96 -0.00 0.00 -0.52 0.00 0.00 55.73 56.65 3how s ARG 73 Cb 0.37 -1.90 -0.03 0.00 0.52 0.00 0.00 34.95 33.91 3how s ARG 73 CO 0.14 -1.66 -0.01 -1.83 0.02 0.00 0.00 175.30 171.95 3how s GLU 74 N -4.98 2.87 0.93 3.54 -1.05 -1.26 -3.97 118.70 114.79 3how s GLU 74 Ca 0.61 -0.50 -0.12 0.00 -0.15 0.00 0.00 54.97 54.81 3how s GLU 74 Cb -0.16 -2.71 0.15 0.00 -0.44 0.00 0.00 34.13 30.96 3how s GLU 74 CO 0.56 0.67 1.09 0.00 0.95 0.00 0.00 175.26 178.53 3how h PRO 76 N -1.69 0.00 0.00 0.00 0.11 -1.96 -3.31 132.00 125.15 3how h PRO 76 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3how h PRO 76 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 3how h PRO 76 CO 0.55 0.22 0.00 1.63 -0.21 0.00 0.00 178.00 180.20 3how n LYS 77 N -4.27 0.00 0.00 1.05 5.02 -1.26 -4.77 118.16 113.93 3how n LYS 77 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 3how n LYS 77 Cb 0.28 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.29 3how n LYS 77 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3how n HIS 79 N -1.11 -0.33 -2.09 0.00 8.25 -1.25 -4.96 115.22 113.74 3how n HIS 79 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 3how n HIS 79 Cb 0.14 -3.58 -0.03 0.00 1.12 0.00 0.00 29.99 27.64 3how n HIS 79 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3how s SER 80 N -2.52 6.74 -0.04 0.41 0.01 -1.26 -4.53 113.70 112.51 3how s SER 80 Ca 0.00 2.42 0.07 0.00 1.31 0.00 0.00 55.95 59.75 3how s SER 80 Cb 0.00 -2.59 0.28 0.00 0.21 0.00 0.00 66.02 63.92 3how s SER 80 CO 0.00 -0.71 1.09 0.54 0.41 0.00 0.00 173.24 174.56 3how n ARG 81 N 3.97 2.05 -3.50 12.44 5.12 -1.25 -3.02 116.66 132.45 3how n ARG 81 Ca 0.12 -1.09 -0.42 0.00 -1.93 0.00 0.00 57.85 54.54 3how n ARG 81 Cb 0.41 -1.50 -0.10 0.00 -1.16 0.00 0.00 32.46 30.11 3how n ARG 81 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 3how s GLU 82 N -1.64 3.03 0.06 5.56 2.02 -1.26 -4.07 118.70 122.40 3how s GLU 82 Ca 0.19 -0.97 0.01 0.00 0.02 0.00 0.00 54.97 54.22 3how s GLU 82 Cb 0.13 -3.89 -0.04 0.00 0.10 0.00 0.00 34.13 30.43 3how s GLU 82 CO 0.09 -0.68 -0.05 -0.80 0.02 0.00 0.00 175.26 173.84 3how s ASN 83 N 1.66 0.76 -0.35 -0.19 0.01 -1.08 -2.45 114.94 113.29 3how s ASN 83 Ca 0.05 -0.88 0.00 0.00 -0.71 0.00 0.00 52.86 51.32 3how s ASN 83 Cb -0.19 0.13 0.14 0.00 0.41 0.00 0.00 41.25 41.74 3how s ASN 83 CO 0.09 -0.46 0.22 0.54 -1.51 0.00 0.00 177.10 175.98 3how s VAL 84 N -3.17 0.15 0.64 1.60 0.11 -1.13 -2.71 120.40 115.88 3how s VAL 84 Ca 0.04 -1.77 -0.02 0.00 -2.93 0.00 0.00 61.98 57.30 3how s VAL 84 Cb 0.02 -1.13 0.06 0.00 -1.53 0.00 0.00 36.38 33.81 3how s VAL 84 CO -0.06 -1.00 0.90 0.72 -3.33 0.00 0.00 175.10 172.33 3how s PHE 85 N 1.01 2.62 0.00 1.54 -0.00 -1.20 -3.89 117.98 118.06 3how s PHE 85 Ca 0.19 0.08 0.00 0.00 -0.00 0.00 0.00 56.93 57.20 3how s PHE 85 Cb -0.21 -2.96 0.00 0.00 -0.00 0.00 0.00 43.02 39.85 3how s PHE 85 CO -0.00 -1.22 0.00 1.97 -0.00 0.00 0.00 175.22 175.96 3how n PHE 86 N -2.63 -0.35 -4.54 3.49 1.16 -1.14 -4.35 117.46 109.09 3how n PHE 86 Ca 0.09 0.00 -0.26 0.00 -1.87 0.00 0.00 57.45 55.42 3how n PHE 86 Cb 0.60 0.00 -0.11 0.00 -1.61 0.00 0.00 39.48 38.36 3how n PHE 86 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 3how s GLN 87 N -0.09 1.81 -0.40 3.97 -0.21 -1.26 -2.93 119.66 120.54 3how s GLN 87 Ca 0.00 -1.97 -0.37 0.00 0.02 0.00 0.00 55.36 53.03 3how s GLN 87 Cb 0.00 -1.52 -0.14 0.00 1.00 0.00 0.00 33.01 32.35 3how s GLN 87 CO 0.00 0.03 2.19 0.45 -2.12 0.00 0.00 175.29 175.84 3how n SER 88 N -0.81 1.71 -0.52 5.90 2.88 -1.26 -4.68 113.62 116.84 3how n SER 88 Ca -0.05 0.47 0.00 0.00 -1.33 0.00 0.00 58.87 57.96 3how n SER 88 Cb 0.65 -1.16 0.00 0.00 -0.75 0.00 0.00 64.21 62.95 3how n SER 88 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3how n GLN 89 N 8.03 0.59 -3.21 -1.46 1.13 -1.18 -4.44 117.38 116.84 3how n GLN 89 Ca 0.46 0.00 -0.45 0.00 -1.94 0.00 0.00 57.00 55.06 3how n GLN 89 Cb 0.15 -1.29 -0.05 0.00 0.11 0.00 0.00 30.24 29.17 3how n GLN 89 CO 0.00 0.00 0.00 -1.14 -1.44 0.00 0.00 177.06 174.48 3how s GLN 90 N -0.94 3.04 -0.97 -1.09 0.74 -1.25 -4.80 119.66 114.40 3how s GLN 90 Ca 0.00 -1.55 -0.11 0.00 0.05 0.00 0.00 55.36 53.75 3how s GLN 90 Cb 0.00 -4.30 -0.08 0.00 1.10 0.00 0.00 33.01 29.74 3how s GLN 90 CO 0.00 -1.44 2.13 0.54 -0.55 0.00 0.00 175.29 175.98 3how n ARG 91 N 5.74 2.10 -4.38 1.67 5.12 -1.26 -4.86 116.66 120.79 3how n ARG 91 Ca -0.10 -1.69 -0.27 0.00 -1.93 0.00 0.00 57.85 53.85 3how n ARG 91 Cb 0.41 -2.66 -0.11 0.00 -1.16 0.00 0.00 32.46 28.95 3how n ARG 91 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 3how s ARG 92 N 3.74 1.67 0.09 5.56 3.52 -1.26 -5.06 118.95 127.21 3how s ARG 92 Ca 0.47 -1.45 -0.29 0.00 -0.13 0.00 0.00 55.73 54.33 3how s ARG 92 Cb 0.12 -1.94 -0.15 0.00 -1.56 0.00 0.00 34.95 31.42 3how s ARG 92 CO 0.00 0.41 1.65 0.87 -0.81 0.00 0.00 175.30 177.42 3how h LYS 93 N 3.14 -0.60 0.00 5.12 1.79 -2.04 -3.13 116.57 120.85 3how h LYS 93 Ca -0.47 0.04 -0.04 0.00 -2.18 0.00 0.00 60.65 58.01 3how h LYS 93 Cb 1.21 0.14 -0.01 0.00 -1.58 0.00 0.00 32.23 31.99 3how h LYS 93 CO 0.49 -0.40 -0.19 0.38 -1.08 0.00 0.00 179.45 178.66 3how h ASP 94 N -0.62 0.00 -0.99 0.86 2.03 -1.97 -3.46 116.42 112.26 3how h ASP 94 Ca -0.04 0.00 -0.28 0.00 -0.73 0.00 0.00 57.03 55.98 3how h ASP 94 Cb 0.52 0.00 0.11 0.00 -0.83 0.00 0.00 39.33 39.13 3how h ASP 94 CO 0.03 0.19 -0.79 0.41 -1.03 0.00 0.00 179.24 178.05 3how n THR 95 N -3.79 0.00 -4.18 1.15 -1.04 -1.18 -4.97 114.28 100.28 3how n THR 95 Ca -0.02 -0.25 -0.23 0.00 -2.04 0.00 0.00 64.05 61.52 3how n THR 95 Cb 0.29 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.75 3how n THR 95 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 3how s SER 96 N -0.50 5.17 -0.32 8.00 1.04 -1.26 -5.04 113.70 120.80 3how s SER 96 Ca 0.23 -0.38 -0.03 0.00 0.48 0.00 0.00 55.95 56.26 3how s SER 96 Cb -0.15 -1.21 0.09 0.00 0.10 0.00 0.00 66.02 64.85 3how s SER 96 CO 0.38 -0.01 2.47 0.23 0.98 0.00 0.00 173.24 177.29 3how n MET 97 N -0.99 2.00 -3.44 4.02 2.81 -1.26 -4.60 117.12 115.66 3how n MET 97 Ca -0.07 -1.71 -0.34 0.00 -1.81 0.00 0.00 57.70 53.76 3how n MET 97 Cb 0.58 -1.82 -0.06 0.00 -0.71 0.00 0.00 33.22 31.21 3how n MET 97 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 3how s VAL 98 N -1.80 4.94 0.28 2.03 0.11 -1.26 -5.07 120.40 119.64 3how s VAL 98 Ca 0.44 0.63 -0.07 0.00 -2.93 0.00 0.00 61.98 60.04 3how s VAL 98 Cb 0.29 -3.68 -0.06 0.00 -1.53 0.00 0.00 36.38 31.40 3how s VAL 98 CO -0.09 0.18 0.58 -0.76 -3.33 0.00 0.00 175.10 171.68 3how s LEU 99 N -2.16 4.08 -0.20 2.54 1.43 -1.26 -4.19 118.68 118.92 3how s LEU 99 Ca 0.39 0.85 -0.01 0.00 -1.03 0.00 0.00 54.13 54.33 3how s LEU 99 Cb -0.14 -3.65 0.05 0.00 0.03 0.00 0.00 46.19 42.49 3how s LEU 99 CO 0.19 -0.17 -0.03 -0.36 0.23 0.00 0.00 176.35 176.22 3how s PHE 100 N -2.01 1.73 0.55 0.29 0.40 -1.15 -3.07 117.98 114.72 3how s PHE 100 Ca 0.46 -1.23 0.01 0.00 -0.60 0.00 0.00 56.93 55.57 3how s PHE 100 Cb -0.11 -1.31 0.03 0.00 0.51 0.00 0.00 43.02 42.14 3how s PHE 100 CO 0.26 -0.66 0.78 -0.06 0.70 0.00 0.00 175.22 176.24 3how s PHE 101 N 1.62 2.89 -0.12 0.36 0.40 0.11 -2.88 117.98 120.37 3how s PHE 101 Ca -0.02 0.03 -0.05 0.00 -0.60 0.00 0.00 56.93 56.29 3how s PHE 101 Cb -0.17 -2.74 0.06 0.00 0.51 0.00 0.00 43.02 40.68 3how s PHE 101 CO -0.07 -0.85 0.26 0.08 0.70 0.00 0.00 175.22 175.33 3how s VAL 102 N -2.77 -0.31 0.10 -0.44 1.01 -1.25 -3.06 120.40 113.69 3how s VAL 102 Ca 0.57 0.25 -0.31 0.00 0.00 0.00 0.00 61.98 62.49 3how s VAL 102 Cb -0.10 -0.42 -0.08 0.00 0.00 0.00 0.00 36.38 35.78 3how s VAL 102 CO 0.39 0.10 1.37 0.00 0.00 0.00 0.00 175.10 176.96 3how h LEU 104 N 6.89 0.00 -7.51 0.00 3.38 -1.86 -2.83 115.31 113.38 3how h LEU 104 Ca -0.42 0.00 -0.76 0.00 0.09 0.00 0.00 57.88 56.79 3how h LEU 104 Cb 1.21 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.65 3how h LEU 104 CO 0.86 0.54 0.17 -0.44 0.09 0.00 0.00 178.44 179.65 3how s SER 105 N -6.56 6.66 0.00 -0.43 0.01 -1.26 -4.61 113.70 107.51 3how s SER 105 Ca 0.01 -3.48 0.00 0.00 1.31 0.00 0.00 55.95 53.78 3how s SER 105 Cb 0.10 -2.08 0.00 0.00 0.21 0.00 0.00 66.02 64.25 3how s SER 105 CO 0.73 -0.29 0.00 0.00 0.41 0.00 0.00 173.24 174.09 3how n SER 107 N 0.00 -1.55 -4.58 0.00 7.64 -1.07 -5.04 113.62 109.02 3how n SER 107 Ca 0.00 0.00 -0.40 0.00 1.01 0.00 0.00 58.87 59.48 3how n SER 107 Cb 0.00 -0.44 -0.09 0.00 -1.01 0.00 0.00 64.21 62.67 3how n SER 107 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 3how s HIS 108 N -2.66 3.22 -0.52 1.43 5.65 -1.26 -4.84 115.29 116.31 3how s HIS 108 Ca 0.00 0.28 -0.21 0.00 0.25 0.00 0.00 55.06 55.38 3how s HIS 108 Cb 0.00 -2.69 0.05 0.00 -1.18 0.00 0.00 32.58 28.76 3how s HIS 108 CO 0.00 -0.36 0.74 0.42 -0.65 0.00 0.00 174.74 174.89 3how s ILE 109 N 2.16 4.70 0.36 0.89 1.01 -1.26 -3.25 121.20 125.81 3how s ILE 109 Ca 0.16 -0.20 0.09 0.00 0.00 0.00 0.00 60.65 60.69 3how s ILE 109 Cb -0.16 -4.38 -0.06 0.00 0.01 0.00 0.00 42.46 37.87 3how s ILE 109 CO 0.11 -0.91 0.00 0.72 0.00 0.00 0.00 174.94 174.87 3how s PHE 110 N 3.10 2.51 0.36 3.97 -0.00 -1.17 -4.93 117.98 121.81 3how s PHE 110 Ca 0.21 -0.52 0.05 0.00 -0.00 0.00 0.00 56.93 56.67 3how s PHE 110 Cb -0.17 -1.57 0.05 0.00 -0.00 0.00 0.00 43.02 41.33 3how s PHE 110 CO 0.15 0.46 0.38 2.41 -0.00 0.00 0.00 175.22 178.63 3how n THR 111 N -0.95 0.00 -0.42 -4.49 -1.04 -1.26 -0.71 114.28 105.41 3how n THR 111 Ca -0.04 -1.30 0.01 0.00 -2.04 0.00 0.00 64.05 60.68 3how n THR 111 Cb 0.64 -0.45 0.02 0.00 -1.82 0.00 0.00 70.33 68.71 3how n THR 111 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 3how n SER 112 N -2.24 1.54 -4.56 8.00 3.41 -1.18 -4.88 113.62 113.72 3how n SER 112 Ca 0.05 -1.92 -0.33 0.00 -0.26 0.00 0.00 58.87 56.40 3how n SER 112 Cb 0.39 -0.06 0.13 0.00 -0.26 0.00 0.00 64.21 64.40 3how n SER 112 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3how n ASP 113 N -0.49 -0.51 -1.39 4.04 -0.08 -1.26 -4.94 116.55 111.93 3how n ASP 113 Ca 0.02 0.46 -0.05 0.00 -1.51 0.00 0.00 54.79 53.72 3how n ASP 113 Cb 0.37 -1.36 -0.02 0.00 2.34 0.00 0.00 41.12 42.45 3how n ASP 113 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3how n GLN 114 N -2.57 0.27 0.00 -0.67 6.02 -1.26 -5.17 117.38 114.00 3how n GLN 114 Ca 0.10 -1.22 0.00 0.00 -0.01 0.00 0.00 57.00 55.87 3how n GLN 114 Cb 0.52 0.37 0.00 0.00 1.02 0.00 0.00 30.24 32.15 3how n GLN 114 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68