#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d01 h GLU 3 N 0.00 0.54 -0.72 1.09 4.11 -2.05 -0.32 114.58 117.23 3d01 h GLU 3 Ca 0.00 -0.23 -0.06 0.00 0.07 0.00 0.00 59.36 59.13 3d01 h GLU 3 Cb 0.00 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 3d01 h GLU 3 CO 0.00 0.79 0.20 -0.97 0.07 0.00 0.00 179.01 179.10 3d01 h ASN 4 N 0.47 1.07 -0.48 3.06 -0.73 -2.05 -1.97 115.58 114.94 3d01 h ASN 4 Ca 0.06 -0.21 -0.06 0.00 1.87 0.00 0.00 56.30 57.95 3d01 h ASN 4 Cb 0.77 -0.28 -0.02 0.00 0.27 0.00 0.00 38.32 39.05 3d01 h ASN 4 CO 0.06 1.01 0.09 0.25 -0.37 0.00 0.00 177.43 178.47 3d01 h LEU 5 N 1.08 0.81 -0.35 0.34 5.85 -1.91 -0.22 115.31 120.92 3d01 h LEU 5 Ca 0.23 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 3d01 h LEU 5 Cb 0.34 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.14 3d01 h LEU 5 CO -0.00 0.82 0.15 0.22 -0.34 0.00 0.00 178.44 179.28 3d01 h TYR 6 N 0.81 0.52 -0.49 1.25 3.20 -0.76 0.16 116.97 121.66 3d01 h TYR 6 Ca 0.17 -0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.92 3d01 h TYR 6 Cb 0.36 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 3d01 h TYR 6 CO 0.02 0.48 -0.04 0.74 -1.64 0.00 0.00 178.16 177.72 3d01 h PHE 7 N 0.42 0.98 -0.99 -3.82 0.04 -1.23 -2.59 116.94 109.73 3d01 h PHE 7 Ca 0.12 -0.18 0.06 0.00 2.80 0.00 0.00 57.97 60.76 3d01 h PHE 7 Cb 0.17 -0.25 -0.06 0.00 2.20 0.00 0.00 35.95 38.01 3d01 h PHE 7 CO -0.01 0.93 0.65 0.37 -0.60 0.00 0.00 178.31 179.65 3d01 h GLN 8 N 0.74 1.16 -0.30 1.51 4.15 -0.90 -0.81 115.11 120.66 3d01 h GLN 8 Ca 0.13 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.48 3d01 h GLN 8 Cb 0.56 -0.26 0.00 0.00 0.21 0.00 0.00 27.48 27.99 3d01 h GLN 8 CO 0.03 0.77 0.00 0.41 -1.93 0.00 0.00 178.83 178.11 3d01 n GLY 9 N -1.37 0.22 1.32 2.39 0.00 0.53 -1.60 105.19 106.68 3d01 n GLY 9 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 3d01 n GLY 9 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d01 n SER 11 N 0.48 0.00 -0.34 1.61 7.64 -0.31 -1.54 113.62 121.16 3d01 n SER 11 Ca 0.00 0.00 -0.04 0.00 1.01 0.00 0.00 58.87 59.84 3d01 n SER 11 Cb 0.04 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.33 3d01 n SER 11 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 3d01 h ASP 12 N 0.00 1.10 -0.37 6.43 3.32 -1.56 -1.38 116.42 123.96 3d01 h ASP 12 Ca 0.00 -0.08 -0.06 0.00 0.02 0.00 0.00 57.03 56.92 3d01 h ASP 12 Cb 0.00 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 3d01 h ASP 12 CO 0.00 0.85 0.01 0.58 -1.72 0.00 0.00 179.24 178.97 3d01 h VAL 13 N 1.25 1.26 0.19 -1.35 2.07 -1.56 0.20 116.25 118.31 3d01 h VAL 13 Ca 0.32 -0.96 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 3d01 h VAL 13 Cb -0.03 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 3d01 h VAL 13 CO -0.06 0.32 -0.09 0.40 0.02 0.00 0.00 177.57 178.16 3d01 h ILE 14 N 0.47 0.83 -0.36 4.57 2.04 -1.75 -0.72 117.51 122.59 3d01 h ILE 14 Ca 0.11 -0.08 -0.06 0.00 1.00 0.00 0.00 64.86 65.83 3d01 h ILE 14 Cb 0.44 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 3d01 h ILE 14 CO 0.02 0.02 -0.03 -0.33 0.00 0.00 0.00 178.15 177.82 3d01 h GLU 15 N -0.30 0.59 -0.67 2.37 5.08 -1.21 -2.09 114.58 118.36 3d01 h GLU 15 Ca -0.03 -0.15 -0.04 0.00 -1.00 0.00 0.00 59.36 58.14 3d01 h GLU 15 Cb 0.23 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 3d01 h GLU 15 CO 0.04 0.64 0.24 0.78 -1.00 0.00 0.00 179.01 179.71 3d01 h GLY 16 N 0.90 1.09 1.06 -3.84 0.00 -0.44 -1.35 103.07 100.49 3d01 h GLY 16 Ca 0.11 -0.62 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 3d01 h GLY 16 CO 0.02 0.58 0.43 3.21 0.00 0.00 0.00 176.54 180.78 3d01 h ARG 17 N 0.96 1.22 -0.53 4.80 3.08 -0.75 -1.18 114.38 121.98 3d01 h ARG 17 Ca 0.22 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 3d01 h ARG 17 Cb 0.25 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 3d01 h ARG 17 CO -0.01 0.92 0.17 1.25 -1.07 0.00 0.00 179.97 181.23 3d01 h LEU 18 N 1.21 0.76 -1.28 3.04 5.85 -1.11 -1.97 115.31 121.81 3d01 h LEU 18 Ca 0.30 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.86 3d01 h LEU 18 Cb 0.09 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.87 3d01 h LEU 18 CO -0.04 0.76 0.51 0.11 -0.34 0.00 0.00 178.44 179.44 3d01 h LYS 19 N 0.73 0.89 0.00 1.25 1.57 -0.91 -1.27 116.57 118.83 3d01 h LYS 19 Ca 0.17 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.86 3d01 h LYS 19 Cb 0.26 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 3d01 h LYS 19 CO -0.01 0.59 -0.17 0.93 -0.57 0.00 0.00 179.45 180.23 3d01 h GLU 20 N 0.92 0.00 -0.00 3.15 5.08 -0.63 -0.93 114.58 122.16 3d01 h GLU 20 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 3d01 h GLU 20 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 3d01 h GLU 20 CO -0.10 0.17 -0.03 1.28 -1.00 0.00 0.00 179.01 179.34 3d01 n LEU 21 N -4.09 0.03 0.00 1.33 4.77 -0.54 -4.93 117.00 113.56 3d01 n LEU 21 Ca -0.02 0.47 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 3d01 n LEU 21 Cb 0.25 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 3d01 n LEU 21 CO 0.34 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 3d01 n GLY 22 N 1.49 1.01 3.43 -0.72 0.00 -0.35 -5.10 105.19 104.95 3d01 n GLY 22 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 3d01 n GLY 22 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3d01 s PHE 23 N -2.00 2.62 0.15 1.61 0.08 -0.86 -4.97 117.98 114.61 3d01 s PHE 23 Ca 0.00 -0.26 0.05 0.00 0.12 0.00 0.00 56.93 56.84 3d01 s PHE 23 Cb 0.00 -1.61 -0.04 0.00 -0.57 0.00 0.00 43.02 40.80 3d01 s PHE 23 CO 0.00 0.11 0.11 0.95 -0.10 0.00 0.00 175.22 176.29 3d01 s THR 24 N -0.63 4.42 0.03 0.64 -4.23 -1.26 -2.46 115.64 112.15 3d01 s THR 24 Ca 0.09 -1.05 -0.30 0.00 -1.18 0.00 0.00 61.69 59.25 3d01 s THR 24 Cb -0.11 -3.23 -0.04 0.00 1.34 0.00 0.00 72.50 70.46 3d01 s THR 24 CO 0.01 -0.06 1.03 -0.76 -0.54 0.00 0.00 174.62 174.29 3d01 s LEU 25 N -2.95 4.38 0.85 4.79 1.43 -1.26 -5.04 118.68 120.88 3d01 s LEU 25 Ca 0.30 1.76 -0.12 0.00 -1.03 0.00 0.00 54.13 55.05 3d01 s LEU 25 Cb -0.10 -3.57 0.10 0.00 0.03 0.00 0.00 46.19 42.64 3d01 s LEU 25 CO 0.23 -0.29 1.10 -2.16 0.23 0.00 0.00 176.35 175.45 3d01 s PRO 26 N 0.92 1.65 0.00 1.29 0.04 -1.26 -5.09 135.00 132.56 3d01 s PRO 26 Ca 0.53 0.67 0.00 0.00 0.04 0.00 0.00 61.00 62.24 3d01 s PRO 26 Cb -0.23 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.44 3d01 s PRO 26 CO 0.29 -1.93 0.00 1.33 0.04 0.00 0.00 177.00 176.73 3d01 n VAL 27 N -3.65 0.00 -3.77 -0.36 0.24 -1.26 -4.85 118.33 104.69 3d01 n VAL 27 Ca 0.07 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.08 3d01 n VAL 27 Cb 0.56 0.00 -0.16 0.00 -1.47 0.00 0.00 33.84 32.78 3d01 n VAL 27 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3d01 s ALA 32 N -2.87 1.46 0.25 2.33 0.00 -1.26 -4.93 121.76 116.75 3d01 s ALA 32 Ca 0.00 -1.34 -0.12 0.00 0.00 0.00 0.00 51.96 50.50 3d01 s ALA 32 Cb 0.00 -1.46 -0.00 0.00 0.00 0.00 0.00 23.12 21.65 3d01 s ALA 32 CO 0.00 -1.44 0.47 0.00 0.00 0.00 0.00 175.76 174.79 3d01 s ALA 33 N 1.65 -0.14 -0.85 0.00 0.00 -1.26 -5.04 121.76 116.12 3d01 s ALA 33 Ca 0.04 -0.94 0.24 0.00 0.00 0.00 0.00 51.96 51.30 3d01 s ALA 33 Cb -0.17 1.08 0.95 0.00 0.00 0.00 0.00 23.12 24.97 3d01 s ALA 33 CO -0.17 -0.85 1.75 0.09 0.00 0.00 0.00 175.76 176.58 3d01 n ASN 34 N -0.46 0.31 -4.57 0.00 5.03 -1.26 -4.60 115.26 109.72 3d01 n ASN 34 Ca -0.01 0.55 -0.30 0.00 0.87 0.00 0.00 54.58 55.69 3d01 n ASN 34 Cb 0.62 -0.62 -0.10 0.00 -1.02 0.00 0.00 39.78 38.65 3d01 n ASN 34 CO 0.00 0.00 0.00 -0.72 -1.83 0.00 0.00 177.26 174.71 3d01 s TYR 35 N -3.08 2.72 0.25 3.10 -0.85 -1.26 -5.15 117.35 113.08 3d01 s TYR 35 Ca 0.10 -0.17 0.10 0.00 -0.52 0.00 0.00 57.07 56.58 3d01 s TYR 35 Cb 0.13 -1.42 -0.04 0.00 0.38 0.00 0.00 41.96 41.01 3d01 s TYR 35 CO 0.46 0.42 -0.10 0.14 -1.52 0.00 0.00 175.55 174.95 3d01 s VAL 36 N -1.20 3.03 0.41 -3.49 -7.23 -1.26 -4.98 120.40 105.68 3d01 s VAL 36 Ca 0.21 -2.01 0.32 0.00 -1.81 0.00 0.00 61.98 58.70 3d01 s VAL 36 Cb -0.11 -2.58 0.35 0.00 0.56 0.00 0.00 36.38 34.60 3d01 s VAL 36 CO 0.13 -0.30 2.13 -0.65 -0.31 0.00 0.00 175.10 176.10 3d01 h PRO 37 N 2.32 0.00 -2.21 4.82 0.11 -1.97 -3.42 132.00 131.65 3d01 h PRO 37 Ca -0.44 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.67 3d01 h PRO 37 Cb 1.24 0.00 -0.17 0.00 0.11 0.00 0.00 31.00 32.17 3d01 h PRO 37 CO 0.58 0.07 0.30 -0.59 -0.21 0.00 0.00 178.00 178.14 3d01 s PHE 38 N -4.10 -0.54 0.14 0.65 -0.12 -1.26 -0.57 117.98 112.18 3d01 s PHE 38 Ca -0.03 0.73 0.04 0.00 -0.05 0.00 0.00 56.93 57.63 3d01 s PHE 38 Cb 0.12 0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 42.94 3d01 s PHE 38 CO 0.54 -0.61 -0.10 0.95 -0.05 0.00 0.00 175.22 175.94 3d01 s THR 39 N -2.06 1.16 -0.05 -4.49 -4.23 -0.47 -4.99 115.64 100.50 3d01 s THR 39 Ca -0.04 -1.98 0.04 0.00 -1.18 0.00 0.00 61.69 58.53 3d01 s THR 39 Cb -0.00 -1.76 -0.00 0.00 1.34 0.00 0.00 72.50 72.07 3d01 s THR 39 CO 0.00 -0.70 -0.19 -0.63 -0.54 0.00 0.00 174.62 172.57 3d01 s ILE 40 N -3.11 1.58 -0.14 2.99 1.01 -1.26 -0.67 121.20 121.60 3d01 s ILE 40 Ca 0.15 -0.78 -0.01 0.00 0.00 0.00 0.00 60.65 60.00 3d01 s ILE 40 Cb 0.01 -1.36 0.04 0.00 0.01 0.00 0.00 42.46 41.16 3d01 s ILE 40 CO 0.01 0.45 -0.02 -0.55 0.00 0.00 0.00 174.94 174.82 3d01 s SER 41 N 0.10 2.40 1.94 3.58 0.15 -0.46 -5.01 113.70 116.39 3d01 s SER 41 Ca -0.07 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.11 3d01 s SER 41 Cb -0.13 -0.70 0.00 0.00 -1.71 0.00 0.00 66.02 63.48 3d01 s SER 41 CO 0.03 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.88 3d01 n GLY 42 N 5.00 3.83 1.36 9.45 0.00 -1.26 -1.48 105.19 122.09 3d01 n GLY 42 Ca -0.10 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3d01 n GLY 42 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3d01 n ASN 43 N 7.00 3.90 -4.47 1.61 6.94 -1.26 -4.91 115.26 124.08 3d01 n ASN 43 Ca 0.00 -3.28 -0.34 0.00 -0.02 0.00 0.00 54.58 50.94 3d01 n ASN 43 Cb 0.00 -0.64 -0.12 0.00 -2.36 0.00 0.00 39.78 36.65 3d01 n ASN 43 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3d01 s LEU 44 N -2.99 3.21 -0.22 -4.53 1.43 -0.55 -1.04 118.68 113.99 3d01 s LEU 44 Ca 0.48 -0.17 -0.06 0.00 -1.03 0.00 0.00 54.13 53.35 3d01 s LEU 44 Cb 0.39 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.80 3d01 s LEU 44 CO 0.08 0.13 0.04 -0.22 0.23 0.00 0.00 176.35 176.62 3d01 s LEU 45 N 0.58 3.42 -0.34 1.79 2.96 0.73 -1.36 118.68 126.46 3d01 s LEU 45 Ca -0.02 -0.16 -0.11 0.00 -0.22 0.00 0.00 54.13 53.62 3d01 s LEU 45 Cb -0.14 -1.89 0.00 0.00 0.50 0.00 0.00 46.19 44.66 3d01 s LEU 45 CO 0.02 0.04 0.20 -0.31 -1.32 0.00 0.00 176.35 174.98 3d01 s TYR 46 N 1.15 3.21 -0.18 5.38 2.02 0.16 -0.44 117.35 128.65 3d01 s TYR 46 Ca 0.04 -0.58 -0.08 0.00 -0.37 0.00 0.00 57.07 56.08 3d01 s TYR 46 Cb -0.14 -2.42 -0.04 0.00 -0.40 0.00 0.00 41.96 38.95 3d01 s TYR 46 CO 0.02 -0.49 0.10 0.08 -1.57 0.00 0.00 175.55 173.70 3d01 s VAL 47 N 1.63 5.14 0.70 0.71 1.01 0.03 -1.37 120.40 128.25 3d01 s VAL 47 Ca 0.04 0.09 -0.16 0.00 0.00 0.00 0.00 61.98 61.96 3d01 s VAL 47 Cb -0.18 -3.31 0.02 0.00 0.00 0.00 0.00 36.38 32.91 3d01 s VAL 47 CO 0.08 0.48 1.19 -0.44 0.00 0.00 0.00 175.10 176.41 3d01 s SER 48 N 0.15 4.49 -0.04 3.32 0.01 0.26 -2.61 113.70 119.26 3d01 s SER 48 Ca 0.07 2.31 -0.36 0.00 1.31 0.00 0.00 55.95 59.28 3d01 s SER 48 Cb -0.12 -2.58 -0.14 0.00 0.21 0.00 0.00 66.02 63.39 3d01 s SER 48 CO -0.00 -2.06 1.67 0.61 0.41 0.00 0.00 173.24 173.86 3d01 n GLY 49 N 0.27 1.03 3.81 3.44 0.00 -1.26 -4.62 105.19 107.86 3d01 n GLY 49 Ca 0.13 0.80 -0.33 0.00 0.00 0.00 0.00 46.02 46.62 3d01 n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d01 s GLN 50 N 2.47 3.15 0.32 1.61 -1.52 0.72 -4.84 119.66 121.57 3d01 s GLN 50 Ca 0.89 -0.44 0.06 0.00 -1.95 0.00 0.00 55.36 53.93 3d01 s GLN 50 Cb -0.84 -2.92 -0.02 0.00 -0.22 0.00 0.00 33.01 29.02 3d01 s GLN 50 CO 0.51 0.66 0.42 -0.51 -0.25 0.00 0.00 175.29 176.12 3d01 s LEU 51 N -1.72 3.97 0.21 2.90 1.43 -1.26 -1.00 118.68 123.21 3d01 s LEU 51 Ca 0.23 -0.19 -0.30 0.00 -1.03 0.00 0.00 54.13 52.84 3d01 s LEU 51 Cb -0.12 -2.69 -0.08 0.00 0.03 0.00 0.00 46.19 43.33 3d01 s LEU 51 CO 0.14 -0.35 0.95 -2.16 0.23 0.00 0.00 176.35 175.16 3d01 s PRO 52 N -4.11 4.82 0.00 1.29 0.04 -1.26 -4.15 135.00 131.64 3d01 s PRO 52 Ca 0.42 1.48 0.00 0.00 0.04 0.00 0.00 61.00 62.95 3d01 s PRO 52 Cb -0.09 -3.30 0.00 0.00 0.04 0.00 0.00 34.50 31.15 3d01 s PRO 52 CO 0.30 0.45 0.00 -1.91 0.04 0.00 0.00 177.00 175.88 3d01 n GLU 54 N 1.77 0.00 -3.96 4.56 2.13 -0.11 -1.01 120.64 124.02 3d01 n GLU 54 Ca -0.01 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.49 3d01 n GLU 54 Cb 0.47 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 32.18 3d01 n GLU 54 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 3d01 n SER 55 N 0.00 -3.92 0.00 4.31 7.64 -1.26 -1.50 113.62 118.90 3d01 n SER 55 Ca 0.00 -0.82 0.00 0.00 1.01 0.00 0.00 58.87 59.06 3d01 n SER 55 Cb 0.00 -3.18 0.00 0.00 -1.01 0.00 0.00 64.21 60.02 3d01 n SER 55 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3d01 n GLY 56 N -1.44 0.61 3.35 0.23 0.00 -1.26 -5.01 105.19 101.66 3d01 n GLY 56 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 3d01 n GLY 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d01 s LYS 57 N -0.25 1.30 -0.32 1.61 1.02 -0.56 -5.09 119.74 117.46 3d01 s LYS 57 Ca 0.00 -1.35 -0.29 0.00 0.02 0.00 0.00 55.97 54.35 3d01 s LYS 57 Cb 0.00 -1.55 -0.01 0.00 -0.52 0.00 0.00 37.83 35.75 3d01 s LYS 57 CO 0.00 0.34 1.49 0.42 -0.92 0.00 0.00 175.35 176.68 3d01 s ILE 58 N -1.53 3.85 -0.25 2.17 -1.09 -1.26 -0.93 121.20 122.16 3d01 s ILE 58 Ca 0.14 0.92 0.18 0.00 -2.23 0.00 0.00 60.65 59.65 3d01 s ILE 58 Cb -0.08 -3.99 0.14 0.00 -1.58 0.00 0.00 42.46 36.95 3d01 s ILE 58 CO 0.06 -0.52 1.46 0.00 -1.23 0.00 0.00 174.94 174.71 3d01 h ALA 59 N 10.64 0.77 -3.23 9.38 0.00 -1.37 -3.44 119.26 132.01 3d01 h ALA 59 Ca -0.30 -0.32 -0.42 0.00 0.00 0.00 0.00 54.91 53.87 3d01 h ALA 59 Cb 1.12 -0.04 -0.39 0.00 0.00 0.00 0.00 17.79 18.48 3d01 h ALA 59 CO 1.04 0.43 -0.75 0.08 0.00 0.00 0.00 179.25 180.05 3d01 s VAL 60 N -3.05 0.06 0.12 0.00 1.01 -1.26 -5.07 120.40 112.21 3d01 s VAL 60 Ca 0.04 0.12 0.06 0.00 0.00 0.00 0.00 61.98 62.21 3d01 s VAL 60 Cb 0.07 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.99 3d01 s VAL 60 CO 0.73 0.05 -0.14 0.42 0.00 0.00 0.00 175.10 176.15 3d01 s THR 61 N 2.09 1.32 0.00 3.92 -4.23 -1.26 -1.79 115.64 115.70 3d01 s THR 61 Ca 0.04 -1.68 0.00 0.00 -1.18 0.00 0.00 61.69 58.86 3d01 s THR 61 Cb -0.14 -1.50 0.00 0.00 1.34 0.00 0.00 72.50 72.20 3d01 s THR 61 CO -0.05 -0.39 0.00 0.61 -0.54 0.00 0.00 174.62 174.24 3d01 n GLY 62 N 0.60 0.42 3.73 3.99 0.00 0.15 -4.69 105.19 109.38 3d01 n GLY 62 Ca -0.16 -2.08 -0.40 0.00 0.00 0.00 0.00 46.02 43.38 3d01 n GLY 62 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d01 s LEU 63 N -0.11 4.39 0.11 0.99 1.43 -1.26 -4.08 118.68 120.15 3d01 s LEU 63 Ca 0.00 1.45 -0.31 0.00 -1.03 0.00 0.00 54.13 54.24 3d01 s LEU 63 Cb 0.00 -3.30 -0.07 0.00 0.03 0.00 0.00 46.19 42.85 3d01 s LEU 63 CO 0.00 -0.10 1.33 -0.69 0.23 0.00 0.00 176.35 177.12 3d01 s VAL 64 N 0.46 3.50 0.00 -1.59 1.01 0.36 -0.11 120.40 124.03 3d01 s VAL 64 Ca 0.42 1.09 0.00 0.00 0.00 0.00 0.00 61.98 63.50 3d01 s VAL 64 Cb -0.20 -3.70 0.00 0.00 0.00 0.00 0.00 36.38 32.48 3d01 s VAL 64 CO 0.23 0.09 0.00 0.61 0.00 0.00 0.00 175.10 176.04 3d01 n GLY 65 N 3.29 0.60 1.79 4.51 0.00 -0.43 -1.99 105.19 112.96 3d01 n GLY 65 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3d01 n GLY 65 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3d01 n ARG 66 N -2.00 0.00 -0.06 1.61 0.63 -0.75 -4.91 116.66 111.18 3d01 n ARG 66 Ca 0.00 0.00 -0.07 0.00 -0.92 0.00 0.00 57.85 56.86 3d01 n ARG 66 Cb 0.00 -0.11 -0.15 0.00 0.45 0.00 0.00 32.46 32.65 3d01 n ARG 66 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3d01 n ASP 67 N -3.44 0.32 -4.02 6.15 8.00 0.84 -4.97 116.55 119.43 3d01 n ASP 67 Ca 0.00 0.15 -0.14 0.00 0.71 0.00 0.00 54.79 55.52 3d01 n ASP 67 Cb 0.01 0.69 -0.12 0.00 -0.02 0.00 0.00 41.12 41.67 3d01 n ASP 67 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3d01 s VAL 68 N -2.62 0.47 0.74 2.53 -7.23 -0.91 -4.93 120.40 108.45 3d01 s VAL 68 Ca -0.08 -0.81 -0.02 0.00 -1.81 0.00 0.00 61.98 59.27 3d01 s VAL 68 Cb 0.07 -0.50 0.13 0.00 0.56 0.00 0.00 36.38 36.65 3d01 s VAL 68 CO 0.83 -0.24 1.02 1.51 -0.31 0.00 0.00 175.10 177.91 3d01 s ASP 69 N -1.13 4.25 0.14 4.85 1.47 -1.26 -1.32 116.67 123.67 3d01 s ASP 69 Ca -0.07 -0.33 -0.16 0.00 1.18 0.00 0.00 52.55 53.17 3d01 s ASP 69 Cb -0.08 -0.02 0.00 0.00 -0.34 0.00 0.00 42.92 42.49 3d01 s ASP 69 CO 0.00 -1.94 1.72 0.58 0.68 0.00 0.00 175.17 176.22 3d01 h VAL 70 N -0.61 1.17 -0.30 2.11 2.07 -1.99 -1.41 116.25 117.29 3d01 h VAL 70 Ca -0.37 -0.48 0.03 0.00 0.82 0.00 0.00 66.70 66.70 3d01 h VAL 70 Cb 1.26 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 3d01 h VAL 70 CO 0.40 0.18 0.13 0.00 0.02 0.00 0.00 177.57 178.31 3d01 h ALA 71 N 1.05 0.36 -0.66 1.67 0.00 -1.98 0.17 119.26 119.88 3d01 h ALA 71 Ca 0.14 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3d01 h ALA 71 Cb 0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3d01 h ALA 71 CO -0.02 -0.26 0.28 0.77 0.00 0.00 0.00 179.25 180.03 3d01 h SER 72 N 0.29 0.89 -0.41 0.00 0.02 -1.92 -2.22 113.55 110.19 3d01 h SER 72 Ca 0.13 -0.16 -0.04 0.00 -0.84 0.00 0.00 61.79 60.88 3d01 h SER 72 Cb 0.07 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.35 3d01 h SER 72 CO -0.11 0.80 0.13 0.00 -1.14 0.00 0.00 176.83 176.51 3d01 h ALA 73 N 1.12 1.33 -0.57 3.77 0.00 -0.74 -1.55 119.26 122.62 3d01 h ALA 73 Ca 0.22 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3d01 h ALA 73 Cb 0.17 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 3d01 h ALA 73 CO -0.02 0.48 0.37 1.96 0.00 0.00 0.00 179.25 182.03 3d01 h GLN 74 N 0.69 0.76 -0.80 0.00 4.20 -0.30 0.35 115.11 120.01 3d01 h GLN 74 Ca 0.16 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.79 3d01 h GLN 74 Cb 0.24 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 27.82 3d01 h GLN 74 CO -0.00 0.52 0.41 -0.09 -0.67 0.00 0.00 178.83 179.00 3d01 h ARG 75 N 0.77 1.13 -0.71 1.46 9.65 -1.01 0.13 114.38 125.81 3d01 h ARG 75 Ca 0.21 -0.15 0.06 0.00 -1.10 0.00 0.00 59.98 59.00 3d01 h ARG 75 Cb -0.06 -0.22 -0.06 0.00 -1.39 0.00 0.00 29.97 28.25 3d01 h ARG 75 CO -0.04 0.85 0.41 0.00 2.80 0.00 0.00 179.97 183.99 3d01 h ALA 76 N 1.32 0.96 -0.43 2.80 0.00 -0.71 -0.87 119.26 122.33 3d01 h ALA 76 Ca 0.28 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 3d01 h ALA 76 Cb 0.07 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3d01 h ALA 76 CO -0.04 0.10 0.02 0.00 0.00 0.00 0.00 179.25 179.33 3d01 h ALA 77 N 1.36 0.58 -0.47 0.00 0.00 -0.10 0.03 119.26 120.66 3d01 h ALA 77 Ca 0.32 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 55.03 3d01 h ALA 77 Cb 0.18 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 3d01 h ALA 77 CO -0.18 0.35 0.15 0.93 0.00 0.00 0.00 179.25 180.51 3d01 h GLU 78 N 0.60 0.31 -0.76 0.00 5.08 -0.45 -1.10 114.58 118.26 3d01 h GLU 78 Ca 0.12 -0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.42 3d01 h GLU 78 Cb 0.46 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 3d01 h GLU 78 CO 0.02 0.20 0.29 -0.07 -1.00 0.00 0.00 179.01 178.46 3d01 h LEU 79 N 0.32 1.04 -0.72 1.33 3.38 -0.68 0.46 115.31 120.44 3d01 h LEU 79 Ca 0.23 -0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.07 3d01 h LEU 79 Cb 0.25 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 3d01 h LEU 79 CO -0.25 0.93 0.45 0.00 0.09 0.00 0.00 178.44 179.66 3d01 h ALA 81 N 1.31 0.89 -0.73 0.00 0.00 -0.49 0.09 119.26 120.33 3d01 h ALA 81 Ca 0.29 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3d01 h ALA 81 Cb 0.03 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3d01 h ALA 81 CO -0.12 0.59 0.36 0.28 0.00 0.00 0.00 179.25 180.37 3d01 h VAL 82 N 1.00 1.24 -0.59 0.00 2.07 -0.53 -1.31 116.25 118.13 3d01 h VAL 82 Ca 0.21 -0.65 -0.09 0.00 0.82 0.00 0.00 66.70 66.99 3d01 h VAL 82 Cb 0.34 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 3d01 h VAL 82 CO -0.00 0.28 -0.00 0.78 0.02 0.00 0.00 177.57 178.64 3d01 h ASN 83 N 1.02 1.00 -0.20 0.57 4.21 -0.95 -0.58 115.58 120.67 3d01 h ASN 83 Ca 0.25 -0.28 0.01 0.00 1.21 0.00 0.00 56.30 57.49 3d01 h ASN 83 Cb 0.11 -0.27 -0.01 0.00 -1.12 0.00 0.00 38.32 37.02 3d01 h ASN 83 CO -0.03 1.06 0.10 0.40 -1.29 0.00 0.00 177.43 177.67 3d01 h ILE 84 N 0.94 1.01 -0.82 2.81 2.04 -0.69 -1.85 117.51 120.95 3d01 h ILE 84 Ca 0.17 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.93 3d01 h ILE 84 Cb 0.55 0.77 -0.04 0.00 -0.74 0.00 0.00 36.82 37.36 3d01 h ILE 84 CO 0.03 0.04 0.44 -0.07 0.00 0.00 0.00 178.15 178.59 3d01 h LEU 85 N 0.22 1.04 -0.58 1.44 3.38 -0.90 0.11 115.31 120.01 3d01 h LEU 85 Ca 0.08 -0.10 0.04 0.00 0.09 0.00 0.00 57.88 57.99 3d01 h LEU 85 Cb 0.01 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 3d01 h LEU 85 CO -0.05 0.84 0.34 0.00 0.09 0.00 0.00 178.44 179.67 3d01 h ALA 86 N 1.32 0.76 -0.49 1.53 0.00 -0.89 0.19 119.26 121.69 3d01 h ALA 86 Ca 0.29 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.14 3d01 h ALA 86 Cb 0.05 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3d01 h ALA 86 CO -0.04 0.04 0.08 1.96 0.00 0.00 0.00 179.25 181.29 3d01 h GLN 87 N 0.66 0.81 -0.72 0.00 1.08 -0.44 -1.44 115.11 115.07 3d01 h GLN 87 Ca 0.25 -0.22 -0.01 0.00 -1.45 0.00 0.00 58.65 57.22 3d01 h GLN 87 Cb 0.08 -0.09 -0.03 0.00 -0.05 0.00 0.00 27.48 27.38 3d01 h GLN 87 CO -0.13 0.81 0.41 0.28 -0.95 0.00 0.00 178.83 179.26 3d01 h VAL 88 N 0.69 1.21 -0.52 -0.54 2.07 -0.65 0.42 116.25 118.93 3d01 h VAL 88 Ca 0.15 -0.50 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 3d01 h VAL 88 Cb 0.40 0.24 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 3d01 h VAL 88 CO 0.01 0.23 0.29 0.50 0.02 0.00 0.00 177.57 178.61 3d01 h LYS 89 N 0.98 0.73 -0.17 1.57 3.64 -0.77 0.33 116.57 122.88 3d01 h LYS 89 Ca 0.26 -0.09 0.01 0.00 -1.27 0.00 0.00 60.65 59.56 3d01 h LYS 89 Cb 0.00 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 3d01 h LYS 89 CO -0.04 0.57 0.09 0.00 -2.27 0.00 0.00 179.45 177.79 3d01 h ALA 90 N 1.12 0.21 -0.48 5.00 0.00 -0.90 0.16 119.26 124.37 3d01 h ALA 90 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.19 3d01 h ALA 90 Cb 0.05 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3d01 h ALA 90 CO -0.03 -0.34 0.33 0.00 0.00 0.00 0.00 179.25 179.21 3d01 h ALA 91 N 1.09 2.14 -0.56 0.00 0.00 -0.55 -2.63 119.26 118.74 3d01 h ALA 91 Ca 0.07 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3d01 h ALA 91 Cb 0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 3d01 h ALA 91 CO -0.05 -0.25 0.07 1.28 0.00 0.00 0.00 179.25 180.30 3d01 n LEU 92 N -4.46 5.50 -3.72 0.00 4.77 0.07 -4.93 117.00 114.23 3d01 n LEU 92 Ca 0.08 -3.05 -0.28 0.00 -0.03 0.00 0.00 56.01 52.72 3d01 n LEU 92 Cb 0.38 -0.68 0.02 0.00 -2.33 0.00 0.00 43.42 40.81 3d01 n LEU 92 CO 0.35 0.70 0.06 0.59 -1.33 0.00 0.00 177.39 177.76 3d01 n ASN 93 N 0.18 -4.69 0.00 -1.43 5.03 -0.96 -1.83 115.26 111.56 3d01 n ASN 93 Ca 0.30 -0.65 0.00 0.00 0.87 0.00 0.00 54.58 55.10 3d01 n ASN 93 Cb 1.20 -3.78 0.00 0.00 -1.02 0.00 0.00 39.78 36.18 3d01 n ASN 93 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3d01 n GLY 94 N -1.56 0.72 2.86 7.41 0.00 0.51 -5.04 105.19 110.10 3d01 n GLY 94 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 3d01 n GLY 94 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3d01 n ASP 95 N 0.00 3.66 0.10 1.61 2.03 -0.76 -4.90 116.55 118.29 3d01 n ASP 95 Ca 0.00 -3.25 0.06 0.00 0.52 0.00 0.00 54.79 52.12 3d01 n ASP 95 Cb 0.00 -0.84 0.34 0.00 -0.72 0.00 0.00 41.12 39.90 3d01 n ASP 95 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3d01 n LEU 96 N 1.78 0.32 0.04 -2.67 4.77 -1.26 -1.48 117.00 118.51 3d01 n LEU 96 Ca 0.23 0.63 0.14 0.00 -0.03 0.00 0.00 56.01 56.97 3d01 n LEU 96 Cb 0.37 -0.66 0.52 0.00 -2.33 0.00 0.00 43.42 41.31 3d01 n LEU 96 CO 0.34 -0.74 0.91 -1.54 -1.33 0.00 0.00 177.39 175.04 3d01 n SER 97 N -1.93 0.36 -0.21 -1.43 3.41 -1.26 -2.96 113.62 109.60 3d01 n SER 97 Ca -0.01 0.51 0.11 0.00 -0.26 0.00 0.00 58.87 59.23 3d01 n SER 97 Cb 0.06 -0.60 0.55 0.00 -0.26 0.00 0.00 64.21 63.96 3d01 n SER 97 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3d01 n LYS 98 N -1.83 1.28 -2.15 4.33 5.02 -0.55 -4.78 118.16 119.48 3d01 n LYS 98 Ca 0.06 -0.41 -0.42 0.00 -2.02 0.00 0.00 58.31 55.52 3d01 n LYS 98 Cb 0.38 -1.37 -0.03 0.00 -0.02 0.00 0.00 35.03 33.99 3d01 n LYS 98 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3d01 s ILE 99 N -1.94 3.60 -0.11 -0.18 1.01 -1.15 -0.45 121.20 121.97 3d01 s ILE 99 Ca 0.33 0.96 -0.08 0.00 0.00 0.00 0.00 60.65 61.86 3d01 s ILE 99 Cb 0.16 -3.62 -0.26 0.00 0.01 0.00 0.00 42.46 38.75 3d01 s ILE 99 CO 0.26 -0.02 0.40 0.03 0.00 0.00 0.00 174.94 175.61 3d01 h ARG 100 N 8.15 0.27 -1.75 2.79 3.08 -0.49 -3.47 114.38 122.97 3d01 h ARG 100 Ca -0.38 -0.46 0.05 0.00 0.07 0.00 0.00 59.98 59.25 3d01 h ARG 100 Cb 1.18 0.17 -0.24 0.00 0.08 0.00 0.00 29.97 31.16 3d01 h ARG 100 CO 0.92 1.22 0.27 0.50 -1.07 0.00 0.00 179.97 181.81 3d01 s ARG 101 N -2.55 0.58 -0.44 0.04 3.52 -0.83 -4.72 118.95 114.55 3d01 s ARG 101 Ca -0.22 0.85 -0.29 0.00 -0.13 0.00 0.00 55.73 55.94 3d01 s ARG 101 Cb 0.06 0.20 0.03 0.00 -1.56 0.00 0.00 34.95 33.68 3d01 s ARG 101 CO 0.77 -0.10 1.12 0.08 -0.81 0.00 0.00 175.30 176.37 3d01 s VAL 102 N 0.93 4.29 -0.02 7.11 1.01 -0.24 0.65 120.40 134.13 3d01 s VAL 102 Ca -0.04 1.36 -0.20 0.00 0.00 0.00 0.00 61.98 63.09 3d01 s VAL 102 Cb -0.05 -4.55 -0.30 0.00 0.00 0.00 0.00 36.38 31.48 3d01 s VAL 102 CO -0.11 -0.87 0.97 0.40 0.00 0.00 0.00 175.10 175.49 3d01 h ILE 103 N 6.10 1.45 -2.10 2.22 1.08 -1.33 -3.35 117.51 121.58 3d01 h ILE 103 Ca -0.22 -2.46 -0.04 0.00 -0.39 0.00 0.00 64.86 61.75 3d01 h ILE 103 Cb 1.06 3.02 -0.21 0.00 -3.07 0.00 0.00 36.82 37.62 3d01 h ILE 103 CO 1.10 0.71 0.06 -0.75 -0.69 0.00 0.00 178.15 178.58 3d01 s LYS 104 N -2.65 0.76 -0.06 2.37 2.47 -1.04 -1.55 119.74 120.04 3d01 s LYS 104 Ca -0.13 0.99 0.06 0.00 -1.56 0.00 0.00 55.97 55.34 3d01 s LYS 104 Cb 0.02 0.32 -0.01 0.00 -1.46 0.00 0.00 37.83 36.71 3d01 s LYS 104 CO 0.85 -0.11 -0.25 -0.51 0.16 0.00 0.00 175.35 175.50 3d01 s LEU 105 N 0.65 2.07 -0.29 5.43 1.43 -0.78 -1.02 118.68 126.17 3d01 s LEU 105 Ca -0.02 -0.52 -0.08 0.00 -1.03 0.00 0.00 54.13 52.48 3d01 s LEU 105 Cb -0.05 -1.38 -0.00 0.00 0.03 0.00 0.00 46.19 44.79 3d01 s LEU 105 CO -0.04 0.23 0.11 0.20 0.23 0.00 0.00 176.35 177.08 3d01 s ASN 106 N -0.08 5.31 -0.35 2.29 -0.87 -0.67 -1.98 114.94 118.58 3d01 s ASN 106 Ca -0.06 -0.53 -0.11 0.00 -1.57 0.00 0.00 52.86 50.59 3d01 s ASN 106 Cb -0.14 -1.94 0.01 0.00 -0.02 0.00 0.00 41.25 39.16 3d01 s ASN 106 CO 0.05 -0.16 0.20 -0.83 -2.57 0.00 0.00 177.10 173.78 3d01 s GLY 107 N 1.57 1.92 -0.25 0.66 0.00 -0.20 -1.70 107.32 109.31 3d01 s GLY 107 Ca 0.04 -1.56 -0.09 0.00 0.00 0.00 0.00 44.72 43.11 3d01 s GLY 107 CO 0.04 0.79 0.11 -1.36 0.00 0.00 0.00 173.10 172.68 3d01 s PHE 108 N 1.60 3.15 -0.23 1.90 0.08 0.62 -1.63 117.98 123.47 3d01 s PHE 108 Ca 0.04 -0.18 -0.00 0.00 0.12 0.00 0.00 56.93 56.90 3d01 s PHE 108 Cb -0.18 -2.27 0.03 0.00 -0.57 0.00 0.00 43.02 40.02 3d01 s PHE 108 CO 0.07 -0.24 -0.11 0.08 -0.10 0.00 0.00 175.22 174.93 3d01 s VAL 109 N 1.55 2.57 -0.02 -0.44 1.01 -0.33 -1.02 120.40 123.71 3d01 s VAL 109 Ca 0.06 -1.06 -0.30 0.00 0.00 0.00 0.00 61.98 60.68 3d01 s VAL 109 Cb -0.15 -2.27 -0.07 0.00 0.00 0.00 0.00 36.38 33.89 3d01 s VAL 109 CO 0.06 0.27 1.74 0.00 0.00 0.00 0.00 175.10 177.17 3d01 s ALA 110 N 1.29 3.61 0.01 5.51 0.00 0.21 -4.26 121.76 128.13 3d01 s ALA 110 Ca 0.00 1.07 0.01 0.00 0.00 0.00 0.00 51.96 53.05 3d01 s ALA 110 Cb -0.16 -3.77 -0.01 0.00 0.00 0.00 0.00 23.12 19.18 3d01 s ALA 110 CO -0.07 -1.42 -0.04 -1.12 0.00 0.00 0.00 175.76 173.11 3d01 s SER 111 N 3.55 0.49 0.59 0.00 0.01 -1.26 -0.49 113.70 116.59 3d01 s SER 111 Ca 0.78 -0.21 -0.15 0.00 1.31 0.00 0.00 55.95 57.68 3d01 s SER 111 Cb -0.36 -0.01 -0.04 0.00 0.21 0.00 0.00 66.02 65.81 3d01 s SER 111 CO 0.33 -0.04 1.03 0.68 0.41 0.00 0.00 173.24 175.65 3d01 s VAL 112 N -0.49 4.17 0.52 3.43 -7.23 -0.84 -4.66 120.40 115.30 3d01 s VAL 112 Ca -0.03 0.95 0.42 0.00 -1.81 0.00 0.00 61.98 61.50 3d01 s VAL 112 Cb -0.04 -3.54 0.42 0.00 0.56 0.00 0.00 36.38 33.78 3d01 s VAL 112 CO -0.00 -0.68 2.27 -0.65 -0.31 0.00 0.00 175.10 175.73 3d01 h PRO 113 N 0.34 0.00 0.00 4.82 0.11 -1.99 -0.50 132.00 134.77 3d01 h PRO 113 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3d01 h PRO 113 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 3d01 h PRO 113 CO 0.59 0.00 -0.29 0.39 -0.21 0.00 0.00 178.00 178.48 3d01 n GLU 114 N -3.02 0.05 -2.84 1.05 4.71 -1.26 -4.82 120.64 114.51 3d01 n GLU 114 Ca -0.02 0.02 -0.42 0.00 -0.01 0.00 0.00 57.16 56.73 3d01 n GLU 114 Cb 0.10 -1.54 -0.04 0.00 -1.01 0.00 0.00 31.44 28.95 3d01 n GLU 114 CO 0.00 0.00 0.00 0.12 0.09 0.00 0.00 177.13 177.34 3d01 s PHE 115 N -3.02 3.39 -0.06 -0.32 5.36 -0.20 -4.93 117.98 118.19 3d01 s PHE 115 Ca 0.12 1.28 0.19 0.00 -0.96 0.00 0.00 56.93 57.55 3d01 s PHE 115 Cb 0.17 -3.07 0.37 0.00 -0.34 0.00 0.00 43.02 40.15 3d01 s PHE 115 CO 0.63 -0.31 1.16 1.33 -1.46 0.00 0.00 175.22 176.57 3d01 n VAL 116 N 4.94 0.66 -1.97 3.12 0.24 -1.26 -4.82 118.33 119.25 3d01 n VAL 116 Ca 0.06 -1.52 -0.20 0.00 -2.04 0.00 0.00 64.34 60.65 3d01 n VAL 116 Cb 0.48 0.56 0.05 0.00 -1.47 0.00 0.00 33.84 33.45 3d01 n VAL 116 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3d01 n GLU 117 N -0.08 3.34 0.25 7.34 1.02 -1.26 -4.76 120.64 126.49 3d01 n GLU 117 Ca 0.09 -4.05 0.07 0.00 -0.02 0.00 0.00 57.16 53.25 3d01 n GLU 117 Cb 0.95 -2.19 0.60 0.00 -0.02 0.00 0.00 31.44 30.78 3d01 n GLU 117 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 3d01 h GLN 118 N 2.02 0.00 -0.66 3.49 7.50 -1.92 -1.31 115.11 124.23 3d01 h GLN 118 Ca 0.32 0.00 -0.01 0.00 0.50 0.00 0.00 58.65 59.46 3d01 h GLN 118 Cb 1.47 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.96 3d01 h GLN 118 CO 0.65 0.07 0.38 1.12 -1.50 0.00 0.00 178.83 179.55 3d01 h HIS 119 N 0.00 0.90 -0.80 2.96 2.07 -1.86 -1.50 115.15 116.91 3d01 h HIS 119 Ca -0.00 -0.01 -0.02 0.00 -2.85 0.00 0.00 60.37 57.48 3d01 h HIS 119 Cb 0.12 -0.29 -0.04 0.00 2.57 0.00 0.00 27.41 29.77 3d01 h HIS 119 CO 0.00 0.63 0.40 -0.07 -3.07 0.00 0.00 177.93 175.82 3d01 h LEU 120 N 0.90 1.03 -0.19 6.12 3.38 -1.65 -1.18 115.31 123.74 3d01 h LEU 120 Ca 0.24 -0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 3d01 h LEU 120 Cb 0.01 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 3d01 h LEU 120 CO -0.04 0.86 0.08 0.58 0.09 0.00 0.00 178.44 180.02 3d01 h VAL 121 N 1.13 1.15 0.00 1.22 2.07 -1.07 -2.87 116.25 117.88 3d01 h VAL 121 Ca 0.28 -0.45 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 3d01 h VAL 121 Cb 0.09 1.10 -0.00 0.00 -1.52 0.00 0.00 31.29 30.95 3d01 h VAL 121 CO -0.04 0.14 -0.15 0.40 0.02 0.00 0.00 177.57 177.94 3d01 h ILE 122 N 0.16 0.35 -0.69 4.57 1.08 -1.12 -1.82 117.51 120.05 3d01 h ILE 122 Ca 0.06 -1.01 0.20 0.00 -0.39 0.00 0.00 64.86 63.72 3d01 h ILE 122 Cb 0.15 1.77 -0.03 0.00 -3.07 0.00 0.00 36.82 35.65 3d01 h ILE 122 CO -0.01 0.15 0.49 0.78 -0.69 0.00 0.00 178.15 178.88 3d01 h ASN 123 N 0.00 0.01 -0.24 1.72 2.35 -0.98 0.97 115.58 119.41 3d01 h ASN 123 Ca -0.00 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.81 3d01 h ASN 123 Cb 0.76 -0.00 -0.08 0.00 0.05 0.00 0.00 38.32 39.05 3d01 h ASN 123 CO 0.02 0.01 -0.34 1.23 -1.65 0.00 0.00 177.43 176.69 3d01 h GLY 124 N 0.01 -0.41 0.75 2.83 0.00 -1.37 0.43 103.07 105.32 3d01 h GLY 124 Ca 0.33 0.43 -0.00 0.00 0.00 0.00 0.00 47.33 48.08 3d01 h GLY 124 CO -0.01 -0.21 0.01 0.00 0.00 0.00 0.00 176.54 176.33 3d01 h ALA 125 N 0.50 0.05 -0.62 3.60 0.00 -1.03 -2.96 119.26 118.81 3d01 h ALA 125 Ca 0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3d01 h ALA 125 Cb 0.55 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 3d01 h ALA 125 CO -0.44 -0.31 0.33 0.77 0.00 0.00 0.00 179.25 179.61 3d01 h SER 126 N -0.19 0.77 -0.60 0.00 0.02 -0.84 -1.03 113.55 111.69 3d01 h SER 126 Ca 0.01 -0.10 -0.07 0.00 -0.84 0.00 0.00 61.79 60.79 3d01 h SER 126 Cb 0.28 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 3d01 h SER 126 CO 0.00 0.65 0.09 0.78 -1.14 0.00 0.00 176.83 177.21 3d01 h ASN 127 N 0.84 0.97 0.01 3.07 2.35 -1.00 -0.97 115.58 120.84 3d01 h ASN 127 Ca 0.22 -0.26 -0.00 0.00 -0.55 0.00 0.00 56.30 55.70 3d01 h ASN 127 Cb 0.05 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.16 3d01 h ASN 127 CO -0.03 0.99 -0.01 0.25 -1.65 0.00 0.00 177.43 176.98 3d01 h LEU 128 N 0.91 -0.02 -0.48 1.61 6.46 -1.29 -0.70 115.31 121.80 3d01 h LEU 128 Ca 0.18 -0.20 -0.01 0.00 -0.12 0.00 0.00 57.88 57.74 3d01 h LEU 128 Cb 0.44 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.35 3d01 h LEU 128 CO 0.01 0.19 0.28 0.40 -0.62 0.00 0.00 178.44 178.70 3d01 h ILE 129 N -0.22 1.16 -0.61 4.05 2.04 -1.11 -1.22 117.51 121.60 3d01 h ILE 129 Ca -0.00 -0.38 -0.08 0.00 1.00 0.00 0.00 64.86 65.40 3d01 h ILE 129 Cb 0.21 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 3d01 h ILE 129 CO 0.00 0.16 0.08 0.00 0.00 0.00 0.00 178.15 178.39 3d01 h ALA 130 N 1.12 0.98 -0.18 1.87 0.00 -1.17 -1.81 119.26 120.08 3d01 h ALA 130 Ca 0.17 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 3d01 h ALA 130 Cb 0.02 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3d01 h ALA 130 CO -0.03 0.64 0.07 1.15 0.00 0.00 0.00 179.25 181.08 3d01 h THR 131 N 0.95 1.16 0.00 0.00 2.02 -0.76 0.26 112.91 116.54 3d01 h THR 131 Ca 0.19 -0.47 -0.18 0.00 0.77 0.00 0.00 66.41 66.72 3d01 h THR 131 Cb 0.44 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.97 3d01 h THR 131 CO 0.01 0.15 -0.84 -0.37 0.37 0.00 0.00 175.52 174.85 3d01 h VAL 132 N 0.14 1.50 0.00 3.16 -1.51 -1.17 -3.33 116.25 115.04 3d01 h VAL 132 Ca 0.06 -2.98 0.00 0.00 -1.23 0.00 0.00 66.70 62.55 3d01 h VAL 132 Cb 0.17 2.65 0.00 0.00 -2.13 0.00 0.00 31.29 31.98 3d01 h VAL 132 CO -0.01 0.82 -1.52 0.18 -1.23 0.00 0.00 177.57 175.82 3d01 n LEU 133 N -3.39 0.39 0.00 4.19 4.77 -0.69 -4.55 117.00 117.73 3d01 n LEU 133 Ca 0.00 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 3d01 n LEU 133 Cb 0.85 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.94 3d01 n LEU 133 CO 0.45 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.22 3d01 n GLY 134 N 1.39 0.41 0.30 -0.72 0.00 0.92 -4.01 105.19 103.48 3d01 n GLY 134 Ca -0.01 -0.84 0.05 0.00 0.00 0.00 0.00 46.02 45.22 3d01 n GLY 134 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3d01 h GLU 135 N 0.00 0.60 -0.01 1.61 4.57 -1.96 0.16 114.58 119.54 3d01 h GLU 135 Ca 0.00 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.15 3d01 h GLU 135 Cb 0.00 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.45 3d01 h GLU 135 CO 0.00 0.40 0.05 -1.35 -1.18 0.00 0.00 179.01 176.92 3d01 h PRO 136 N 0.62 0.00 0.00 0.92 0.11 -1.85 -1.69 132.00 130.11 3d01 h PRO 136 Ca 0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.53 3d01 h PRO 136 Cb 0.55 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.66 3d01 h PRO 136 CO -0.33 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 177.87 3d01 n GLY 137 N -1.15 -1.40 3.72 -0.55 0.00 0.55 -1.08 105.19 105.29 3d01 n GLY 137 Ca -0.03 0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 3d01 n GLY 137 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d01 s ARG 138 N -3.18 4.55 0.03 1.61 0.52 -0.64 -4.27 118.95 117.58 3d01 s ARG 138 Ca 0.08 1.63 -0.01 0.00 -0.52 0.00 0.00 55.73 56.91 3d01 s ARG 138 Cb 0.11 -3.35 -0.03 0.00 0.52 0.00 0.00 34.95 32.20 3d01 s ARG 138 CO 0.45 -0.04 -0.02 -3.38 0.02 0.00 0.00 175.30 172.33 3d01 s HIS 139 N 0.48 0.35 0.91 -0.53 -3.43 -1.26 -4.55 115.29 107.25 3d01 s HIS 139 Ca 0.53 -0.72 -0.11 0.00 -0.80 0.00 0.00 55.06 53.96 3d01 s HIS 139 Cb -0.27 -0.26 0.14 0.00 -1.43 0.00 0.00 32.58 30.76 3d01 s HIS 139 CO 0.31 -0.26 1.10 0.00 -2.00 0.00 0.00 174.74 173.89 3d01 s ALA 140 N -2.37 1.44 0.05 -1.38 0.00 -0.59 -4.92 121.76 113.99 3d01 s ALA 140 Ca -0.07 0.26 -0.27 0.00 0.00 0.00 0.00 51.96 51.87 3d01 s ALA 140 Cb -0.03 -3.32 0.07 0.00 0.00 0.00 0.00 23.12 19.84 3d01 s ALA 140 CO -0.04 -2.55 0.65 0.50 0.00 0.00 0.00 175.76 174.32 3d01 s ARG 141 N -4.76 1.16 0.02 0.00 3.52 -1.26 -1.87 118.95 115.76 3d01 s ARG 141 Ca 0.65 -0.11 0.04 0.00 -0.13 0.00 0.00 55.73 56.18 3d01 s ARG 141 Cb -0.20 0.54 -0.02 0.00 -1.56 0.00 0.00 34.95 33.71 3d01 s ARG 141 CO 0.58 -0.44 -0.13 0.00 -0.81 0.00 0.00 175.30 174.50 3d01 s ALA 142 N -2.47 1.09 -0.08 6.12 0.00 -0.84 -4.97 121.76 120.61 3d01 s ALA 142 Ca -0.05 -0.72 -0.01 0.00 0.00 0.00 0.00 51.96 51.18 3d01 s ALA 142 Cb -0.01 -0.20 0.03 0.00 0.00 0.00 0.00 23.12 22.95 3d01 s ALA 142 CO -0.02 0.22 -0.00 0.00 0.00 0.00 0.00 175.76 175.96 3d01 s ALA 143 N -0.68 0.76 0.04 0.00 0.00 -1.26 -1.04 121.76 119.58 3d01 s ALA 143 Ca 0.02 -0.18 -0.00 0.00 0.00 0.00 0.00 51.96 51.80 3d01 s ALA 143 Cb -0.07 -0.78 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 3d01 s ALA 143 CO 0.01 -0.49 -0.04 0.14 0.00 0.00 0.00 175.76 175.38 3d01 s VAL 144 N 1.95 0.21 0.39 0.00 -7.23 -0.65 -4.78 120.40 110.29 3d01 s VAL 144 Ca 0.05 -1.33 0.05 0.00 -1.81 0.00 0.00 61.98 58.94 3d01 s VAL 144 Cb -0.12 -0.86 -0.00 0.00 0.56 0.00 0.00 36.38 35.95 3d01 s VAL 144 CO -0.06 -0.71 0.55 -0.83 -0.31 0.00 0.00 175.10 173.74 3d01 s GLY 145 N -2.13 1.68 -0.18 2.32 0.00 -1.26 -1.19 107.32 106.56 3d01 s GLY 145 Ca -0.05 -1.42 0.06 0.00 0.00 0.00 0.00 44.72 43.31 3d01 s GLY 145 CO -0.05 -1.29 -0.10 0.00 0.00 0.00 0.00 173.10 171.67 3d01 n ALA 147 N -1.82 1.59 -3.63 3.20 0.00 -1.26 -4.89 120.51 113.71 3d01 n ALA 147 Ca 0.02 -0.90 0.03 0.00 0.00 0.00 0.00 53.44 52.60 3d01 n ALA 147 Cb 0.58 0.01 -0.00 0.00 0.00 0.00 0.00 19.45 20.04 3d01 n ALA 147 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3d01 s SER 148 N -5.56 -0.02 0.04 0.00 1.04 -1.26 -4.62 113.70 103.32 3d01 s SER 148 Ca -0.20 -0.07 -0.01 0.00 0.48 0.00 0.00 55.95 56.15 3d01 s SER 148 Cb 0.06 0.08 -0.04 0.00 0.10 0.00 0.00 66.02 66.22 3d01 s SER 148 CO 0.51 -0.14 -0.03 -0.76 0.98 0.00 0.00 173.24 173.80 3d01 s LEU 149 N -3.09 2.44 0.21 2.42 1.43 -1.26 -4.92 118.68 115.90 3d01 s LEU 149 Ca 0.16 -0.90 -0.31 0.00 -1.03 0.00 0.00 54.13 52.06 3d01 s LEU 149 Cb 0.06 0.19 -0.15 0.00 0.03 0.00 0.00 46.19 46.31 3d01 s LEU 149 CO -0.05 -0.54 1.01 -2.65 0.23 0.00 0.00 176.35 174.35 3d01 n PRO 150 N 0.40 1.01 -1.44 1.29 -0.02 -1.26 -1.40 135.00 133.58 3d01 n PRO 150 Ca -0.16 0.36 -0.15 0.00 -2.02 0.00 0.00 63.50 61.53 3d01 n PRO 150 Cb 0.60 -1.74 -0.06 0.00 -0.02 0.00 0.00 33.50 32.28 3d01 n PRO 150 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3d01 n PHE 151 N 0.83 0.00 -2.24 6.00 3.72 -1.26 -1.88 117.46 122.64 3d01 n PHE 151 Ca 0.14 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.33 3d01 n PHE 151 Cb 0.27 -2.91 -0.03 0.00 -0.94 0.00 0.00 39.48 35.87 3d01 n PHE 151 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 3d01 n ASN 152 N -1.01 -5.79 -4.71 4.37 5.15 -0.50 -4.93 115.26 107.85 3d01 n ASN 152 Ca -0.15 0.10 -0.42 0.00 -0.60 0.00 0.00 54.58 53.50 3d01 n ASN 152 Cb 0.58 -4.88 -0.01 0.00 -0.53 0.00 0.00 39.78 34.95 3d01 n ASN 152 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3d01 n ALA 153 N -1.33 1.41 0.11 5.20 0.00 -0.79 -0.67 120.51 124.43 3d01 n ALA 153 Ca -0.24 0.36 -0.04 0.00 0.00 0.00 0.00 53.44 53.52 3d01 n ALA 153 Cb 0.69 -2.27 0.08 0.00 0.00 0.00 0.00 19.45 17.94 3d01 n ALA 153 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3d01 h SER 154 N 2.64 0.07 -4.25 0.00 0.02 -1.50 -3.38 113.55 107.15 3d01 h SER 154 Ca -0.46 -0.05 -0.19 0.00 -0.84 0.00 0.00 61.79 60.25 3d01 h SER 154 Cb 1.28 -0.02 -0.25 0.00 0.14 0.00 0.00 62.40 63.55 3d01 h SER 154 CO 0.63 0.78 -0.60 -0.69 -1.14 0.00 0.00 176.83 175.81 3d01 s VAL 155 N -3.38 0.04 -0.02 2.27 1.01 -1.26 -0.62 120.40 118.44 3d01 s VAL 155 Ca -0.01 -0.31 0.02 0.00 0.00 0.00 0.00 61.98 61.68 3d01 s VAL 155 Cb 0.12 -0.23 0.00 0.00 0.00 0.00 0.00 36.38 36.27 3d01 s VAL 155 CO 0.79 -0.17 -0.08 -0.70 0.00 0.00 0.00 175.10 174.93 3d01 s GLU 156 N -0.53 0.85 -0.04 2.72 2.12 -0.19 -4.01 118.70 119.61 3d01 s GLU 156 Ca -0.06 -0.28 0.00 0.00 0.36 0.00 0.00 54.97 54.99 3d01 s GLU 156 Cb -0.04 -0.81 0.03 0.00 0.26 0.00 0.00 34.13 33.57 3d01 s GLU 156 CO 0.00 0.12 0.00 0.42 -0.54 0.00 0.00 175.26 175.26 3d01 s ILE 157 N 0.13 0.19 0.46 -3.70 1.01 -0.17 -0.28 121.20 118.85 3d01 s ILE 157 Ca -0.02 0.11 0.06 0.00 0.00 0.00 0.00 60.65 60.80 3d01 s ILE 157 Cb -0.07 -0.30 -0.02 0.00 0.01 0.00 0.00 42.46 42.08 3d01 s ILE 157 CO 0.00 0.16 0.27 1.51 0.00 0.00 0.00 174.94 176.88 3d01 s ASP 158 N 1.21 4.57 0.00 3.58 1.47 -0.69 -0.20 116.67 126.60 3d01 s ASP 158 Ca -0.07 -1.12 -0.21 0.00 1.18 0.00 0.00 52.55 52.33 3d01 s ASP 158 Cb -0.13 -0.13 0.04 0.00 -0.34 0.00 0.00 42.92 42.36 3d01 s ASP 158 CO -0.02 -0.76 0.46 0.00 0.68 0.00 0.00 175.17 175.53 3d01 s ALA 159 N -2.66 -1.17 -0.07 2.11 0.00 -1.07 -1.67 121.76 117.23 3d01 s ALA 159 Ca 0.37 0.60 0.04 0.00 0.00 0.00 0.00 51.96 52.97 3d01 s ALA 159 Cb 0.01 0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.31 3d01 s ALA 159 CO 0.21 -0.38 -0.19 0.42 0.00 0.00 0.00 175.76 175.82 3d01 s ILE 160 N -1.80 1.63 -0.07 0.00 1.01 -0.19 -0.79 121.20 120.99 3d01 s ILE 160 Ca -0.09 -0.78 0.00 0.00 0.00 0.00 0.00 60.65 59.78 3d01 s ILE 160 Cb -0.02 -1.42 0.02 0.00 0.01 0.00 0.00 42.46 41.05 3d01 s ILE 160 CO 0.03 0.46 -0.05 -0.69 0.00 0.00 0.00 174.94 174.69 3d01 s VAL 161 N 0.35 0.68 -0.06 2.92 1.01 0.42 -0.91 120.40 124.82 3d01 s VAL 161 Ca -0.13 -0.15 -0.28 0.00 0.00 0.00 0.00 61.98 61.41 3d01 s VAL 161 Cb -0.16 -0.71 -0.02 0.00 0.00 0.00 0.00 36.38 35.49 3d01 s VAL 161 CO 0.06 0.28 0.93 -0.70 0.00 0.00 0.00 175.10 175.66 3d01 s GLU 162 N 1.25 4.48 0.20 2.72 2.12 0.21 -0.19 118.70 129.48 3d01 s GLU 162 Ca -0.05 1.29 0.08 0.00 0.36 0.00 0.00 54.97 56.65 3d01 s GLU 162 Cb -0.14 -3.49 -0.04 0.00 0.26 0.00 0.00 34.13 30.72 3d01 s GLU 162 CO -0.02 -0.13 -0.16 0.96 -0.54 0.00 0.00 175.26 175.36 3d01 s ILE 163 N 1.37 1.84 -0.38 -3.70 -4.36 -0.21 0.27 121.20 116.03 3d01 s ILE 163 Ca 0.47 -2.12 -0.29 0.00 -0.26 0.00 0.00 60.65 58.46 3d01 s ILE 163 Cb -0.19 -1.99 0.00 0.00 1.25 0.00 0.00 42.46 41.53 3d01 s ILE 163 CO 0.22 -0.47 1.53 -1.81 0.24 0.00 0.00 174.94 174.65 3d01 s ASP 164 N -3.08 6.21 0.00 4.36 1.01 0.40 -4.77 116.67 120.80 3d01 s ASP 164 Ca 0.21 0.99 0.08 0.00 0.71 0.00 0.00 52.55 54.53 3d01 s ASP 164 Cb -0.03 -2.54 0.06 0.00 1.01 0.00 0.00 42.92 41.43 3d01 s ASP 164 CO 0.08 -1.51 0.76 0.52 0.21 0.00 0.00 175.17 175.22