#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dr4 s ILE 7 N 0.00 4.15 0.13 0.55 1.01 0.02 -5.04 121.20 122.02 3dr4 s ILE 7 Ca 0.00 -0.54 -0.16 0.00 0.00 0.00 0.00 60.65 59.96 3dr4 s ILE 7 Cb 0.00 -3.09 -0.07 0.00 0.01 0.00 0.00 42.46 39.31 3dr4 s ILE 7 CO 0.00 0.13 0.56 -0.44 0.00 0.00 0.00 174.94 175.20 3dr4 s SER 8 N 1.54 6.89 0.32 3.58 0.01 -1.26 -0.67 113.70 124.11 3dr4 s SER 8 Ca 0.04 1.14 0.01 0.00 1.31 0.00 0.00 55.95 58.44 3dr4 s SER 8 Cb -0.17 -2.31 0.55 0.00 0.21 0.00 0.00 66.02 64.30 3dr4 s SER 8 CO 0.03 0.14 1.98 1.62 0.41 0.00 0.00 173.24 177.42 3dr4 h VAL 9 N 2.96 1.16 -3.54 3.43 3.04 -1.96 -3.43 116.25 117.92 3dr4 h VAL 9 Ca -0.49 -0.34 -0.06 0.00 -1.01 0.00 0.00 66.70 64.80 3dr4 h VAL 9 Cb 1.20 0.10 -0.13 0.00 -2.01 0.00 0.00 31.29 30.45 3dr4 h VAL 9 CO 0.65 0.18 -0.16 0.00 -1.01 0.00 0.00 177.57 177.23 3dr4 s ALA 10 N -5.83 -0.67 -0.27 3.17 0.00 -1.26 -1.55 121.76 115.34 3dr4 s ALA 10 Ca -0.11 -0.27 -0.25 0.00 0.00 0.00 0.00 51.96 51.32 3dr4 s ALA 10 Cb 0.18 0.66 0.12 0.00 0.00 0.00 0.00 23.12 24.08 3dr4 s ALA 10 CO 0.78 -0.62 1.04 0.00 0.00 0.00 0.00 175.76 176.97 3dr4 s ALA 11 N -3.83 -1.98 0.87 0.00 0.00 -1.26 -4.93 121.76 110.62 3dr4 s ALA 11 Ca 0.05 1.85 -0.11 0.00 0.00 0.00 0.00 51.96 53.74 3dr4 s ALA 11 Cb 0.03 -1.39 0.11 0.00 0.00 0.00 0.00 23.12 21.87 3dr4 s ALA 11 CO -0.10 -0.24 1.09 -1.25 0.00 0.00 0.00 175.76 175.26 3dr4 s PRO 12 N 0.12 1.48 -0.35 0.00 0.04 -1.24 -4.66 135.00 130.39 3dr4 s PRO 12 Ca 0.03 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.04 3dr4 s PRO 12 Cb -0.05 -1.82 0.11 0.00 0.04 0.00 0.00 34.50 32.78 3dr4 s PRO 12 CO -0.06 -2.13 0.14 0.50 0.04 0.00 0.00 177.00 175.49 3dr4 s ARG 13 N -4.90 0.91 -1.15 4.56 3.52 -1.26 -4.94 118.95 115.70 3dr4 s ARG 13 Ca 0.63 -1.40 -0.09 0.00 -0.13 0.00 0.00 55.73 54.74 3dr4 s ARG 13 Cb -0.18 -2.12 0.25 0.00 -1.56 0.00 0.00 34.95 31.34 3dr4 s ARG 13 CO 0.57 -1.05 1.37 1.28 -0.81 0.00 0.00 175.30 176.66 3dr4 n LEU 14 N 4.39 5.81 -1.45 -0.88 4.77 -1.26 -4.68 117.00 123.70 3dr4 n LEU 14 Ca 0.02 -4.91 -0.11 0.00 -0.03 0.00 0.00 56.01 50.98 3dr4 n LEU 14 Cb 0.39 -1.46 0.10 0.00 -2.33 0.00 0.00 43.42 40.12 3dr4 n LEU 14 CO 0.16 1.30 0.25 -0.90 -1.33 0.00 0.00 177.39 176.86 3dr4 n ASP 15 N 3.16 3.54 0.00 -1.43 5.75 -1.26 -4.94 116.55 121.37 3dr4 n ASP 15 Ca 0.29 -3.77 0.00 0.00 -0.01 0.00 0.00 54.79 51.30 3dr4 n ASP 15 Cb 0.38 -0.42 0.00 0.00 -1.03 0.00 0.00 41.12 40.05 3dr4 n ASP 15 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dr4 n GLY 16 N -0.86 5.51 0.03 6.12 0.00 -1.26 -5.01 105.19 109.72 3dr4 n GLY 16 Ca 0.33 -1.17 0.05 0.00 0.00 0.00 0.00 46.02 45.23 3dr4 n GLY 16 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3dr4 n ASN 17 N 0.00 0.09 -0.00 1.61 3.02 -1.26 -4.46 115.26 114.26 3dr4 n ASN 17 Ca 0.00 -1.72 -0.13 0.00 -0.03 0.00 0.00 54.58 52.70 3dr4 n ASN 17 Cb 0.00 -0.01 -0.06 0.00 -0.61 0.00 0.00 39.78 39.10 3dr4 n ASN 17 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 3dr4 h GLU 18 N 0.11 -0.48 -0.36 3.52 3.07 -1.87 0.57 114.58 119.14 3dr4 h GLU 18 Ca 0.00 0.03 0.02 0.00 -0.50 0.00 0.00 59.36 58.92 3dr4 h GLU 18 Cb 0.03 0.11 -0.03 0.00 -0.84 0.00 0.00 28.75 28.02 3dr4 h GLU 18 CO 0.00 -0.32 0.19 -0.09 -1.40 0.00 0.00 179.01 177.39 3dr4 h ARG 19 N -0.50 0.38 -0.42 2.33 2.43 -1.94 0.42 114.38 117.09 3dr4 h ARG 19 Ca 0.07 -0.02 -0.12 0.00 -0.81 0.00 0.00 59.98 59.10 3dr4 h ARG 19 Cb 0.63 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 3dr4 h ARG 19 CO -0.41 0.25 -0.21 -0.44 -1.51 0.00 0.00 179.97 177.65 3dr4 h ASP 20 N 0.39 0.91 -0.84 -3.80 3.32 -1.72 -0.91 116.42 113.77 3dr4 h ASP 20 Ca 0.15 -0.41 -0.04 0.00 0.02 0.00 0.00 57.03 56.75 3dr4 h ASP 20 Cb 0.04 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.30 3dr4 h ASP 20 CO -0.09 1.12 0.39 1.88 -1.72 0.00 0.00 179.24 180.81 3dr4 h TYR 21 N 0.70 1.23 -0.71 4.55 0.05 0.46 -1.21 116.97 122.04 3dr4 h TYR 21 Ca 0.09 -0.07 -0.04 0.00 0.05 0.00 0.00 58.73 58.76 3dr4 h TYR 21 Cb 0.78 -0.38 -0.03 0.00 1.01 0.00 0.00 36.73 38.11 3dr4 h TYR 21 CO 0.06 0.90 0.27 0.28 -1.05 0.00 0.00 178.16 178.61 3dr4 h VAL 22 N 1.20 1.25 -0.33 -2.88 2.07 -0.76 -1.39 116.25 115.41 3dr4 h VAL 22 Ca 0.29 -0.81 -0.05 0.00 0.82 0.00 0.00 66.70 66.95 3dr4 h VAL 22 Cb 0.15 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 3dr4 h VAL 22 CO -0.03 0.32 0.00 -0.07 0.02 0.00 0.00 177.57 177.81 3dr4 h LEU 23 N 1.02 0.47 -0.79 2.57 3.38 -0.87 -0.71 115.31 120.39 3dr4 h LEU 23 Ca 0.23 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 3dr4 h LEU 23 Cb 0.23 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 3dr4 h LEU 23 CO -0.02 0.54 0.37 -0.08 0.09 0.00 0.00 178.44 179.34 3dr4 h GLU 24 N 0.49 1.15 0.01 1.13 4.81 -0.20 0.43 114.58 122.38 3dr4 h GLU 24 Ca 0.11 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.17 3dr4 h GLU 24 Cb 0.31 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.48 3dr4 h GLU 24 CO 0.01 0.89 -0.03 0.00 -0.73 0.00 0.00 179.01 179.15 3dr4 h MET 26 N -0.05 0.03 -0.84 0.00 2.86 -0.89 0.82 114.93 116.85 3dr4 h MET 26 Ca 0.01 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3dr4 h MET 26 Cb 0.07 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.68 3dr4 h MET 26 CO -0.03 0.07 0.51 -0.44 1.06 0.00 0.00 176.91 178.09 3dr4 h ASP 27 N -0.03 1.00 1.00 1.22 3.32 0.02 -1.75 116.42 121.20 3dr4 h ASP 27 Ca 0.01 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.00 3dr4 h ASP 27 Cb 0.05 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.35 3dr4 h ASP 27 CO -0.00 0.77 -0.26 0.35 -1.72 0.00 0.00 179.24 178.38 3dr4 n THR 28 N -4.37 0.25 -1.04 0.35 -2.24 -0.49 -4.95 114.28 101.80 3dr4 n THR 28 Ca 0.09 -0.15 -0.01 0.00 -2.27 0.00 0.00 64.05 61.71 3dr4 n THR 28 Cb 0.06 -0.28 -0.01 0.00 -2.10 0.00 0.00 70.33 68.00 3dr4 n THR 28 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3dr4 n THR 29 N -1.86 0.00 -2.85 4.28 -2.24 0.19 -4.99 114.28 106.81 3dr4 n THR 29 Ca 0.05 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.40 3dr4 n THR 29 Cb 0.39 -0.48 -0.02 0.00 -2.10 0.00 0.00 70.33 68.12 3dr4 n THR 29 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 3dr4 s TRP 30 N -1.74 3.05 -0.39 4.78 0.52 -0.68 -4.72 118.94 119.76 3dr4 s TRP 30 Ca 0.00 -1.39 0.06 0.00 0.02 0.00 0.00 56.10 54.79 3dr4 s TRP 30 Cb 0.00 -4.38 -0.03 0.00 -1.15 0.00 0.00 33.47 27.91 3dr4 s TRP 30 CO 0.00 -1.57 0.35 0.44 0.02 0.00 0.00 176.95 176.19 3dr4 n ILE 31 N 5.67 0.00 -1.64 2.03 -5.35 -1.26 -4.59 119.36 114.22 3dr4 n ILE 31 Ca 0.28 -0.40 0.00 0.00 -0.27 0.00 0.00 62.75 62.36 3dr4 n ILE 31 Cb 0.49 1.03 0.00 0.00 -1.74 0.00 0.00 39.64 39.42 3dr4 n ILE 31 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3dr4 n SER 32 N -0.77 0.00 -0.08 7.28 3.41 -1.26 -4.20 113.62 117.99 3dr4 n SER 32 Ca 0.02 -0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.40 3dr4 n SER 32 Cb 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 3dr4 n SER 32 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3dr4 n SER 33 N -0.67 0.15 -4.40 4.04 3.41 -1.26 -0.74 113.62 114.14 3dr4 n SER 33 Ca 0.00 -1.87 -0.35 0.00 -0.26 0.00 0.00 58.87 56.39 3dr4 n SER 33 Cb 0.00 -0.07 -0.13 0.00 -0.26 0.00 0.00 64.21 63.75 3dr4 n SER 33 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3dr4 s VAL 34 N -1.84 3.72 0.00 -3.33 1.01 -1.26 -4.82 120.40 113.87 3dr4 s VAL 34 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.59 3dr4 s VAL 34 Cb 0.00 -2.67 0.00 0.00 0.00 0.00 0.00 36.38 33.71 3dr4 s VAL 34 CO 0.00 0.43 0.00 0.61 0.00 0.00 0.00 175.10 176.14 3dr4 n GLY 35 N 4.33 2.73 0.29 4.51 0.00 -1.26 -4.46 105.19 111.33 3dr4 n GLY 35 Ca -0.17 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.14 3dr4 n GLY 35 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3dr4 h ARG 36 N 0.00 0.61 -0.12 1.61 0.11 -1.95 -3.11 114.38 111.53 3dr4 h ARG 36 Ca 0.00 -0.10 0.00 0.00 0.10 0.00 0.00 59.98 59.98 3dr4 h ARG 36 Cb 0.00 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 30.97 3dr4 h ARG 36 CO 0.00 0.56 0.08 0.74 0.10 0.00 0.00 179.97 181.45 3dr4 h PHE 37 N 0.60 0.15 0.78 4.08 0.04 -1.94 -2.33 116.94 118.32 3dr4 h PHE 37 Ca 0.14 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.87 3dr4 h PHE 37 Cb 0.23 -0.05 0.01 0.00 2.20 0.00 0.00 35.95 38.33 3dr4 h PHE 37 CO 0.01 0.09 -0.37 0.82 -0.60 0.00 0.00 178.31 178.26 3dr4 h ILE 38 N 0.16 0.20 0.00 -0.55 2.04 -1.83 0.77 117.51 118.30 3dr4 h ILE 38 Ca 0.04 -0.07 -0.08 0.00 1.00 0.00 0.00 64.86 65.75 3dr4 h ILE 38 Cb -0.02 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.27 3dr4 h ILE 38 CO -0.01 0.01 -0.37 -0.37 0.00 0.00 0.00 178.15 177.41 3dr4 h VAL 39 N -1.10 1.08 -0.12 1.67 -1.51 -1.73 0.19 116.25 114.73 3dr4 h VAL 39 Ca -0.11 -1.36 -0.07 0.00 -1.23 0.00 0.00 66.70 63.93 3dr4 h VAL 39 Cb 0.81 1.77 -0.00 0.00 -2.13 0.00 0.00 31.29 31.74 3dr4 h VAL 39 CO 0.18 0.36 -0.21 -0.08 -1.23 0.00 0.00 177.57 176.59 3dr4 h GLU 40 N 0.00 0.36 -0.76 5.19 4.81 -1.05 -1.16 114.58 121.98 3dr4 h GLU 40 Ca -0.00 -0.22 0.01 0.00 -0.13 0.00 0.00 59.36 59.01 3dr4 h GLU 40 Cb 0.74 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.11 3dr4 h GLU 40 CO 0.05 0.81 0.50 0.35 -0.73 0.00 0.00 179.01 179.99 3dr4 h PHE 41 N -0.05 0.95 0.25 0.92 3.57 0.89 -0.92 116.94 122.55 3dr4 h PHE 41 Ca 0.01 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.54 3dr4 h PHE 41 Cb 0.79 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 39.19 3dr4 h PHE 41 CO 0.10 0.59 -0.27 0.93 -2.23 0.00 0.00 178.31 177.43 3dr4 h GLU 42 N 1.02 -0.54 -0.24 1.11 5.08 -0.83 0.52 114.58 120.69 3dr4 h GLU 42 Ca 0.28 0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.72 3dr4 h GLU 42 Cb -0.11 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 3dr4 h GLU 42 CO -0.07 -0.36 -0.00 -0.22 -1.00 0.00 0.00 179.01 177.36 3dr4 h LYS 43 N -0.56 0.07 -0.28 2.33 3.64 -1.09 0.69 116.57 121.36 3dr4 h LYS 43 Ca -0.00 -0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.32 3dr4 h LYS 43 Cb 0.52 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 3dr4 h LYS 43 CO -0.07 0.05 -0.06 0.00 -2.27 0.00 0.00 179.45 177.09 3dr4 h ALA 44 N 1.21 1.37 -0.31 5.00 0.00 -0.95 0.06 119.26 125.64 3dr4 h ALA 44 Ca 0.12 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 3dr4 h ALA 44 Cb 0.15 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 3dr4 h ALA 44 CO -0.20 0.43 -0.41 0.35 0.00 0.00 0.00 179.25 179.42 3dr4 h PHE 45 N 0.43 1.02 -0.44 0.00 3.57 0.17 -1.31 116.94 120.38 3dr4 h PHE 45 Ca 0.09 -0.33 -0.02 0.00 3.53 0.00 0.00 57.97 61.24 3dr4 h PHE 45 Cb 0.38 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 3dr4 h PHE 45 CO 0.01 1.14 0.22 0.00 -2.23 0.00 0.00 178.31 177.44 3dr4 h ALA 46 N 0.71 0.57 -0.08 2.41 0.00 0.71 -1.41 119.26 122.16 3dr4 h ALA 46 Ca 0.04 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.86 3dr4 h ALA 46 Cb 1.01 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 3dr4 h ALA 46 CO 0.10 0.12 -0.04 -0.44 0.00 0.00 0.00 179.25 178.99 3dr4 h ASP 47 N 0.57 -0.14 -0.56 0.00 3.32 -0.87 -0.28 116.42 118.45 3dr4 h ASP 47 Ca 0.15 0.03 0.10 0.00 0.02 0.00 0.00 57.03 57.34 3dr4 h ASP 47 Cb 0.11 0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.71 3dr4 h ASP 47 CO -0.02 -0.06 0.38 0.22 -1.72 0.00 0.00 179.24 178.04 3dr4 h TYR 48 N -0.04 0.36 0.00 4.55 3.20 -0.74 0.69 116.97 124.98 3dr4 h TYR 48 Ca 0.05 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.93 3dr4 h TYR 48 Cb 0.11 -0.12 0.00 0.00 1.54 0.00 0.00 36.73 38.26 3dr4 h TYR 48 CO -0.16 0.17 -0.47 0.00 -1.64 0.00 0.00 178.16 176.07 3dr4 n GLY 50 N 1.37 0.44 3.49 0.00 0.00 0.23 -4.31 105.19 106.40 3dr4 n GLY 50 Ca 0.04 -0.37 -0.23 0.00 0.00 0.00 0.00 46.02 45.46 3dr4 n GLY 50 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dr4 s VAL 51 N -3.10 1.78 0.12 1.61 -7.23 -0.58 -4.99 120.40 108.02 3dr4 s VAL 51 Ca 0.17 -2.11 -0.07 0.00 -1.81 0.00 0.00 61.98 58.15 3dr4 s VAL 51 Cb -0.07 -2.62 -0.17 0.00 0.56 0.00 0.00 36.38 34.08 3dr4 s VAL 51 CO 0.24 -0.19 1.31 0.11 -0.31 0.00 0.00 175.10 176.25 3dr4 h LYS 52 N 2.12 0.55 -4.53 4.82 1.57 -1.85 -3.39 116.57 115.86 3dr4 h LYS 52 Ca -0.41 -0.53 -0.26 0.00 -1.87 0.00 0.00 60.65 57.58 3dr4 h LYS 52 Cb 1.24 0.13 -0.21 0.00 0.08 0.00 0.00 32.23 33.48 3dr4 h LYS 52 CO 0.70 1.15 -0.73 -1.01 -0.57 0.00 0.00 179.45 179.00 3dr4 s HIS 53 N -3.45 0.65 -0.02 -1.35 3.76 -0.38 -5.00 115.29 109.51 3dr4 s HIS 53 Ca -0.07 -0.53 -0.00 0.00 -0.15 0.00 0.00 55.06 54.31 3dr4 s HIS 53 Cb 0.09 -0.39 0.03 0.00 1.11 0.00 0.00 32.58 33.41 3dr4 s HIS 53 CO 0.88 -0.10 0.04 0.00 -0.85 0.00 0.00 174.74 174.71 3dr4 s ALA 54 N -1.51 0.04 -0.25 -1.40 0.00 -1.26 -1.86 121.76 115.52 3dr4 s ALA 54 Ca -0.09 0.32 0.02 0.00 0.00 0.00 0.00 51.96 52.20 3dr4 s ALA 54 Cb -0.09 -0.25 0.05 0.00 0.00 0.00 0.00 23.12 22.83 3dr4 s ALA 54 CO -0.00 -0.11 -0.11 0.42 0.00 0.00 0.00 175.76 175.97 3dr4 s ILE 55 N 1.00 2.31 0.14 0.00 1.09 0.80 -4.82 121.20 121.72 3dr4 s ILE 55 Ca -0.08 -1.45 -0.30 0.00 -1.10 0.00 0.00 60.65 57.72 3dr4 s ILE 55 Cb -0.12 -2.28 -0.07 0.00 -1.06 0.00 0.00 42.46 38.93 3dr4 s ILE 55 CO -0.03 0.07 1.05 0.00 -0.10 0.00 0.00 174.94 175.92 3dr4 s ALA 56 N 1.17 3.31 0.38 9.38 0.00 -1.26 -0.55 121.76 134.19 3dr4 s ALA 56 Ca -0.06 0.71 0.04 0.00 0.00 0.00 0.00 51.96 52.66 3dr4 s ALA 56 Cb -0.19 -3.33 -0.05 0.00 0.00 0.00 0.00 23.12 19.55 3dr4 s ALA 56 CO -0.06 -0.15 0.06 0.00 0.00 0.00 0.00 175.76 175.61 3dr4 h ASN 58 N 1.90 0.00 -5.44 0.00 -0.00 -1.41 0.05 115.58 110.68 3dr4 h ASN 58 Ca -0.41 0.00 0.21 0.00 -0.00 0.00 0.00 56.30 56.10 3dr4 h ASN 58 Cb 1.26 0.00 -0.08 0.00 -0.00 0.00 0.00 38.32 39.50 3dr4 h ASN 58 CO 0.70 0.17 0.57 0.54 -0.00 0.00 0.00 177.43 179.42 3dr4 s ASN 59 N -6.10 -0.12 0.28 6.14 2.20 -1.26 -2.47 114.94 113.61 3dr4 s ASN 59 Ca -0.00 -0.40 0.05 0.00 -0.94 0.00 0.00 52.86 51.56 3dr4 s ASN 59 Cb 0.11 0.42 0.40 0.00 -2.00 0.00 0.00 41.25 40.18 3dr4 s ASN 59 CO 0.61 -0.80 1.67 1.23 -2.94 0.00 0.00 177.10 176.88 3dr4 h GLY 60 N 2.00 0.34 0.80 0.45 0.00 -1.73 -1.88 103.07 103.05 3dr4 h GLY 60 Ca -0.26 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 3dr4 h GLY 60 CO 0.28 0.29 -0.01 -0.84 0.00 0.00 0.00 176.54 176.27 3dr4 h THR 61 N 0.26 1.26 -0.05 4.70 2.02 -1.92 -2.09 112.91 117.09 3dr4 h THR 61 Ca 0.02 -0.88 -0.09 0.00 0.77 0.00 0.00 66.41 66.23 3dr4 h THR 61 Cb 0.84 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.72 3dr4 h THR 61 CO 0.07 0.27 -0.37 0.71 0.37 0.00 0.00 175.52 176.56 3dr4 h THR 62 N 0.07 1.28 -0.21 3.16 1.35 -1.95 -1.43 112.91 115.19 3dr4 h THR 62 Ca 0.05 -1.36 -0.00 0.00 -0.55 0.00 0.00 66.41 64.55 3dr4 h THR 62 Cb 0.40 1.67 -0.01 0.00 -1.73 0.00 0.00 68.15 68.48 3dr4 h THR 62 CO 0.01 0.40 0.13 0.00 -0.25 0.00 0.00 175.52 175.81 3dr4 h ALA 63 N 1.53 0.26 -0.17 6.62 0.00 -1.22 0.39 119.26 126.68 3dr4 h ALA 63 Ca 0.01 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3dr4 h ALA 63 Cb 0.71 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3dr4 h ALA 63 CO 0.05 -0.24 0.09 -0.07 0.00 0.00 0.00 179.25 179.08 3dr4 h LEU 64 N 0.26 0.13 0.11 0.00 3.38 -0.94 -0.10 115.31 118.17 3dr4 h LEU 64 Ca 0.08 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 3dr4 h LEU 64 Cb 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3dr4 h LEU 64 CO -0.01 0.10 -0.05 -0.74 0.09 0.00 0.00 178.44 177.83 3dr4 h HIS 65 N 0.19 -0.14 -1.01 1.13 2.76 -0.95 -1.04 115.15 116.08 3dr4 h HIS 65 Ca 0.07 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.30 3dr4 h HIS 65 Cb 0.01 0.05 -0.07 0.00 1.55 0.00 0.00 27.41 28.94 3dr4 h HIS 65 CO -0.09 -0.04 0.65 1.25 -1.30 0.00 0.00 177.93 178.40 3dr4 h LEU 66 N -0.20 1.03 -0.02 0.26 5.85 -0.12 -1.05 115.31 121.06 3dr4 h LEU 66 Ca -0.02 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 3dr4 h LEU 66 Cb 0.16 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 3dr4 h LEU 66 CO 0.03 0.65 0.01 0.00 -0.34 0.00 0.00 178.44 178.78 3dr4 h ALA 67 N 1.46 0.03 -0.27 1.25 0.00 -0.70 -0.16 119.26 120.87 3dr4 h ALA 67 Ca 0.44 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.30 3dr4 h ALA 67 Cb 0.20 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3dr4 h ALA 67 CO -0.18 -0.40 0.11 -0.07 0.00 0.00 0.00 179.25 178.71 3dr4 h LEU 68 N -0.10 0.15 -0.46 0.00 3.38 -0.84 -0.02 115.31 117.42 3dr4 h LEU 68 Ca 0.01 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3dr4 h LEU 68 Cb 0.14 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 3dr4 h LEU 68 CO -0.00 0.12 0.24 0.58 0.09 0.00 0.00 178.44 179.47 3dr4 h VAL 69 N 0.25 1.17 -0.01 1.22 2.07 -1.13 -1.23 116.25 118.59 3dr4 h VAL 69 Ca 0.11 -0.46 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 3dr4 h VAL 69 Cb 0.06 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.46 3dr4 h VAL 69 CO -0.10 0.18 -0.01 0.00 0.02 0.00 0.00 177.57 177.67 3dr4 h ALA 70 N 1.09 1.97 0.00 1.67 0.00 -0.57 -0.61 119.26 122.80 3dr4 h ALA 70 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3dr4 h ALA 70 Cb 0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3dr4 h ALA 70 CO -0.02 0.03 0.00 -1.33 0.00 0.00 0.00 179.25 177.92 3dr4 n MET 71 N -4.52 0.11 -0.68 0.00 2.00 -0.06 -4.89 117.12 109.08 3dr4 n MET 71 Ca -0.03 0.09 0.00 0.00 0.00 0.00 0.00 57.70 57.76 3dr4 n MET 71 Cb 0.10 -1.50 0.00 0.00 0.00 0.00 0.00 33.22 31.82 3dr4 n MET 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3dr4 n GLY 72 N 0.86 0.59 3.73 3.03 0.00 -0.24 -5.04 105.19 108.12 3dr4 n GLY 72 Ca 0.07 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 3dr4 n GLY 72 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dr4 s ILE 73 N -2.00 3.56 0.00 -0.61 -1.09 -0.56 -4.97 121.20 115.53 3dr4 s ILE 73 Ca 0.00 1.22 0.00 0.00 -2.23 0.00 0.00 60.65 59.64 3dr4 s ILE 73 Cb 0.00 -3.78 0.00 0.00 -1.58 0.00 0.00 42.46 37.10 3dr4 s ILE 73 CO 0.00 0.15 0.00 0.61 -1.23 0.00 0.00 174.94 174.47 3dr4 n GLY 74 N 2.70 2.78 3.65 6.18 0.00 -1.26 -4.59 105.19 114.65 3dr4 n GLY 74 Ca 0.07 -0.89 -0.46 0.00 0.00 0.00 0.00 46.02 44.74 3dr4 n GLY 74 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dr4 n PRO 75 N 0.00 1.80 0.00 1.61 -0.02 -1.23 -0.87 135.00 136.29 3dr4 n PRO 75 Ca 0.00 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 3dr4 n PRO 75 Cb 0.00 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.23 3dr4 n PRO 75 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dr4 n GLY 76 N 2.08 3.32 3.86 -1.23 0.00 -1.25 -4.95 105.19 107.02 3dr4 n GLY 76 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 3dr4 n GLY 76 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3dr4 s ASP 77 N -0.87 6.55 -0.07 1.61 1.01 -0.04 -4.85 116.67 120.00 3dr4 s ASP 77 Ca 0.00 1.31 0.01 0.00 0.71 0.00 0.00 52.55 54.58 3dr4 s ASP 77 Cb 0.00 -2.40 -0.03 0.00 1.01 0.00 0.00 42.92 41.51 3dr4 s ASP 77 CO 0.00 -0.49 -0.10 -1.61 0.21 0.00 0.00 175.17 173.18 3dr4 s GLU 78 N -3.99 2.77 -0.09 8.23 2.02 -0.04 -0.93 118.70 126.66 3dr4 s GLU 78 Ca 0.54 -0.61 0.01 0.00 0.02 0.00 0.00 54.97 54.93 3dr4 s GLU 78 Cb -0.10 -2.53 0.02 0.00 0.10 0.00 0.00 34.13 31.61 3dr4 s GLU 78 CO 0.32 0.58 -0.10 0.08 0.02 0.00 0.00 175.26 176.17 3dr4 s VAL 79 N -0.61 1.09 -0.11 2.63 1.01 -0.61 -0.72 120.40 123.07 3dr4 s VAL 79 Ca 0.09 -0.39 -0.29 0.00 0.00 0.00 0.00 61.98 61.39 3dr4 s VAL 79 Cb -0.11 -1.05 -0.01 0.00 0.00 0.00 0.00 36.38 35.20 3dr4 s VAL 79 CO 0.02 0.36 0.97 -0.63 0.00 0.00 0.00 175.10 175.81 3dr4 s ILE 80 N 1.19 4.81 0.01 2.22 1.01 -0.11 -0.45 121.20 129.87 3dr4 s ILE 80 Ca -0.05 1.95 0.01 0.00 0.00 0.00 0.00 60.65 62.57 3dr4 s ILE 80 Cb -0.14 -4.28 -0.01 0.00 0.01 0.00 0.00 42.46 38.05 3dr4 s ILE 80 CO -0.03 0.02 -0.04 -0.69 0.00 0.00 0.00 174.94 174.20 3dr4 s VAL 81 N 1.97 0.30 0.40 2.92 1.01 0.03 -0.06 120.40 126.96 3dr4 s VAL 81 Ca 0.46 -0.37 -0.25 0.00 0.00 0.00 0.00 61.98 61.82 3dr4 s VAL 81 Cb -0.18 -0.29 -0.08 0.00 0.00 0.00 0.00 36.38 35.82 3dr4 s VAL 81 CO 0.17 -0.06 1.17 -2.16 0.00 0.00 0.00 175.10 174.23 3dr4 s PRO 82 N -0.46 4.06 0.30 2.72 0.04 -1.26 -1.35 135.00 139.04 3dr4 s PRO 82 Ca -0.02 1.85 0.09 0.00 0.04 0.00 0.00 61.00 62.96 3dr4 s PRO 82 Cb -0.04 -2.68 0.45 0.00 0.04 0.00 0.00 34.50 32.28 3dr4 s PRO 82 CO -0.00 -0.32 1.68 1.03 0.04 0.00 0.00 177.00 179.43 3dr4 h SER 83 N 2.65 0.09 -2.48 6.66 0.87 -1.76 -3.37 113.55 116.21 3dr4 h SER 83 Ca -0.49 -0.04 -0.62 0.00 -1.23 0.00 0.00 61.79 59.40 3dr4 h SER 83 Cb 1.23 -0.03 -0.14 0.00 -0.44 0.00 0.00 62.40 63.03 3dr4 h SER 83 CO 0.62 0.59 0.72 -0.22 -0.53 0.00 0.00 176.83 178.01 3dr4 s LEU 84 N -7.94 4.26 0.17 2.23 2.96 -1.26 -0.41 118.68 118.69 3dr4 s LEU 84 Ca -0.03 -1.10 -0.23 0.00 -0.22 0.00 0.00 54.13 52.55 3dr4 s LEU 84 Cb 0.13 -2.45 0.08 0.00 0.50 0.00 0.00 46.19 44.45 3dr4 s LEU 84 CO 0.76 -1.45 1.04 0.28 -1.32 0.00 0.00 176.35 175.66 3dr4 s THR 85 N 4.15 0.00 0.19 3.68 -1.32 -1.26 -4.98 115.64 116.10 3dr4 s THR 85 Ca 0.27 -0.58 -0.30 0.00 -1.21 0.00 0.00 61.69 59.87 3dr4 s THR 85 Cb -0.13 -2.68 -0.08 0.00 -1.51 0.00 0.00 72.50 68.10 3dr4 s THR 85 CO 0.07 0.00 0.96 -0.47 -2.21 0.00 0.00 174.62 172.97 3dr4 s TYR 86 N -2.39 3.88 0.56 9.09 5.04 -1.26 -4.80 117.35 127.48 3dr4 s TYR 86 Ca 0.20 1.85 0.36 0.00 -2.44 0.00 0.00 57.07 57.03 3dr4 s TYR 86 Cb -0.02 -3.04 1.50 0.00 0.35 0.00 0.00 41.96 40.75 3dr4 s TYR 86 CO 0.04 0.26 1.75 0.97 -1.34 0.00 0.00 175.55 177.24 3dr4 h ILE 87 N 3.51 0.32 -0.13 3.14 2.10 -1.96 -1.17 117.51 123.31 3dr4 h ILE 87 Ca -0.44 0.00 0.03 0.00 1.08 0.00 0.00 64.86 65.52 3dr4 h ILE 87 Cb 1.21 0.37 -0.01 0.00 -1.09 0.00 0.00 36.82 37.30 3dr4 h ILE 87 CO 0.70 0.00 0.09 0.00 -1.08 0.00 0.00 178.15 177.86 3dr4 h ALA 88 N 1.29 2.04 -0.40 0.18 0.00 -1.97 0.13 119.26 120.54 3dr4 h ALA 88 Ca 0.53 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.48 3dr4 h ALA 88 Cb 2.28 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 20.02 3dr4 h ALA 88 CO -0.01 -0.07 0.15 0.77 0.00 0.00 0.00 179.25 180.09 3dr4 h SER 89 N 0.07 0.16 0.06 0.00 0.02 -1.59 0.43 113.55 112.70 3dr4 h SER 89 Ca 0.06 0.04 -0.24 0.00 -0.84 0.00 0.00 61.79 60.81 3dr4 h SER 89 Cb 0.15 0.02 0.02 0.00 0.14 0.00 0.00 62.40 62.74 3dr4 h SER 89 CO -0.01 0.13 -0.99 0.00 -1.14 0.00 0.00 176.83 174.83 3dr4 h ALA 90 N 1.25 0.04 -0.73 3.77 0.00 -1.53 -3.29 119.26 118.78 3dr4 h ALA 90 Ca 0.18 -0.69 0.02 0.00 0.00 0.00 0.00 54.91 54.42 3dr4 h ALA 90 Cb 0.16 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 3dr4 h ALA 90 CO -0.18 0.57 0.48 -0.91 0.00 0.00 0.00 179.25 179.21 3dr4 h ASN 91 N 0.15 0.80 -0.54 0.00 2.35 -0.57 -0.95 115.58 116.83 3dr4 h ASN 91 Ca -0.14 -0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.59 3dr4 h ASN 91 Cb 1.68 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 39.83 3dr4 h ASN 91 CO 0.19 0.56 0.32 0.77 -1.65 0.00 0.00 177.43 177.62 3dr4 h SER 92 N 0.93 0.67 -0.43 5.81 4.64 -0.98 0.45 113.55 124.66 3dr4 h SER 92 Ca 0.28 -0.04 -0.08 0.00 -0.47 0.00 0.00 61.79 61.48 3dr4 h SER 92 Cb -0.02 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 61.88 3dr4 h SER 92 CO -0.07 0.53 -0.05 0.58 -0.87 0.00 0.00 176.83 176.95 3dr4 h VAL 93 N 0.77 1.27 -0.89 0.95 2.07 -1.29 -3.11 116.25 116.03 3dr4 h VAL 93 Ca 0.20 -1.13 -0.02 0.00 0.82 0.00 0.00 66.70 66.58 3dr4 h VAL 93 Cb -0.00 1.13 -0.04 0.00 -1.52 0.00 0.00 31.29 30.86 3dr4 h VAL 93 CO -0.04 0.38 0.49 0.74 0.02 0.00 0.00 177.57 179.17 3dr4 h THR 94 N 0.62 1.26 -0.75 2.57 2.02 -0.61 -2.07 112.91 115.95 3dr4 h THR 94 Ca 0.11 -0.63 0.05 0.00 0.77 0.00 0.00 66.41 66.71 3dr4 h THR 94 Cb 0.57 0.06 -0.04 0.00 -1.74 0.00 0.00 68.15 66.99 3dr4 h THR 94 CO 0.03 0.29 0.49 1.88 0.37 0.00 0.00 175.52 178.58 3dr4 h TYR 95 N 1.24 0.84 0.00 3.16 0.05 -0.87 -0.77 116.97 120.61 3dr4 h TYR 95 Ca 0.31 0.02 0.00 0.00 0.05 0.00 0.00 58.73 59.11 3dr4 h TYR 95 Cb 0.02 -0.28 0.00 0.00 1.01 0.00 0.00 36.73 37.49 3dr4 h TYR 95 CO 0.01 0.46 0.00 0.00 -1.05 0.00 0.00 178.16 177.58 3dr4 n GLY 97 N -0.02 0.70 3.96 0.00 0.00 -0.30 -3.55 105.19 105.97 3dr4 n GLY 97 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 3dr4 n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dr4 s ALA 98 N -2.42 3.39 -0.20 4.61 0.00 -1.01 -3.88 121.76 122.25 3dr4 s ALA 98 Ca 0.00 -1.25 -0.04 0.00 0.00 0.00 0.00 51.96 50.67 3dr4 s ALA 98 Cb 0.00 -2.34 -0.02 0.00 0.00 0.00 0.00 23.12 20.76 3dr4 s ALA 98 CO 0.00 -1.31 -0.03 0.99 0.00 0.00 0.00 175.76 175.41 3dr4 s THR 99 N -3.16 3.71 0.30 0.00 2.01 -0.11 -4.08 115.64 114.30 3dr4 s THR 99 Ca 0.62 -0.40 -0.29 0.00 0.31 0.00 0.00 61.69 61.94 3dr4 s THR 99 Cb -0.09 -2.66 -0.09 0.00 0.01 0.00 0.00 72.50 69.66 3dr4 s THR 99 CO 0.44 0.44 1.08 -2.84 -0.69 0.00 0.00 174.62 173.05 3dr4 s PRO 100 N 1.01 4.58 -0.29 4.92 0.02 -1.26 -1.58 135.00 142.39 3dr4 s PRO 100 Ca 0.01 1.73 0.03 0.00 0.02 0.00 0.00 61.00 62.79 3dr4 s PRO 100 Cb -0.14 -3.08 0.08 0.00 0.02 0.00 0.00 34.50 31.37 3dr4 s PRO 100 CO 0.01 0.18 -0.04 0.08 -0.33 0.00 0.00 177.00 176.90 3dr4 s VAL 101 N -1.25 2.28 0.29 3.83 1.01 0.40 -4.88 120.40 122.08 3dr4 s VAL 101 Ca 0.46 -1.90 -0.29 0.00 0.00 0.00 0.00 61.98 60.25 3dr4 s VAL 101 Cb -0.30 -2.48 -0.10 0.00 0.00 0.00 0.00 36.38 33.51 3dr4 s VAL 101 CO 0.38 -0.26 1.12 -0.76 0.00 0.00 0.00 175.10 175.59 3dr4 s LEU 102 N 1.04 4.54 0.04 3.92 1.43 -1.25 -0.79 118.68 127.60 3dr4 s LEU 102 Ca -0.01 2.32 0.06 0.00 -1.03 0.00 0.00 54.13 55.47 3dr4 s LEU 102 Cb -0.20 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.37 3dr4 s LEU 102 CO -0.06 -0.19 -0.16 0.54 0.23 0.00 0.00 176.35 176.71 3dr4 s VAL 103 N -1.16 1.28 0.89 -1.59 0.11 -0.45 -4.89 120.40 114.59 3dr4 s VAL 103 Ca 0.45 -1.03 -0.12 0.00 -2.93 0.00 0.00 61.98 58.35 3dr4 s VAL 103 Cb -0.33 -1.14 0.13 0.00 -1.53 0.00 0.00 36.38 33.51 3dr4 s VAL 103 CO 0.43 0.09 1.10 -0.62 -3.33 0.00 0.00 175.10 172.76 3dr4 s ASP 104 N -1.09 3.58 0.44 3.54 -1.08 -1.26 -2.05 116.67 118.75 3dr4 s ASP 104 Ca 0.04 1.32 0.03 0.00 -0.52 0.00 0.00 52.55 53.42 3dr4 s ASP 104 Cb -0.08 -2.00 -0.04 0.00 -1.46 0.00 0.00 42.92 39.34 3dr4 s ASP 104 CO 0.01 -2.55 0.04 0.54 0.52 0.00 0.00 175.17 173.73 3dr4 s ASN 105 N -3.62 3.56 0.16 -0.34 4.22 -1.26 -1.76 114.94 115.89 3dr4 s ASN 105 Ca 0.63 -1.55 -0.30 0.00 -2.14 0.00 0.00 52.86 49.50 3dr4 s ASN 105 Cb -0.17 0.22 -0.07 0.00 1.28 0.00 0.00 41.25 42.51 3dr4 s ASN 105 CO 0.56 -0.74 1.06 -0.62 -2.04 0.00 0.00 177.10 175.31 3dr4 s ASP 106 N -3.73 7.35 0.10 3.54 -1.08 0.12 -4.66 116.67 118.31 3dr4 s ASP 106 Ca 0.21 2.00 0.18 0.00 -0.52 0.00 0.00 52.55 54.41 3dr4 s ASP 106 Cb 0.05 -2.60 0.76 0.00 -1.46 0.00 0.00 42.92 39.67 3dr4 s ASP 106 CO 0.11 -0.17 1.56 -0.81 0.52 0.00 0.00 175.17 176.38 3dr4 n PRO 107 N 2.48 0.08 -0.08 4.34 -0.04 -1.26 -1.04 135.00 139.49 3dr4 n PRO 107 Ca 0.03 0.32 -0.10 0.00 -0.04 0.00 0.00 63.50 63.70 3dr4 n PRO 107 Cb 0.47 -1.65 -0.08 0.00 -0.04 0.00 0.00 33.50 32.20 3dr4 n PRO 107 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3dr4 n ARG 108 N -1.79 0.73 0.00 0.54 1.74 -1.26 -4.63 116.66 111.98 3dr4 n ARG 108 Ca 0.03 0.07 0.10 0.00 -0.77 0.00 0.00 57.85 57.28 3dr4 n ARG 108 Cb 0.19 -1.32 -0.06 0.00 -1.02 0.00 0.00 32.46 30.25 3dr4 n ARG 108 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3dr4 n THR 109 N -2.87 0.00 -0.87 0.55 -2.24 -1.22 -3.83 114.28 103.80 3dr4 n THR 109 Ca -0.27 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 3dr4 n THR 109 Cb 0.83 0.92 0.00 0.00 -2.10 0.00 0.00 70.33 69.97 3dr4 n THR 109 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3dr4 n PHE 110 N -1.40 0.00 -3.77 4.78 3.72 -0.20 -4.87 117.46 115.71 3dr4 n PHE 110 Ca 0.05 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.24 3dr4 n PHE 110 Cb 0.34 -0.57 -0.01 0.00 -0.94 0.00 0.00 39.48 38.30 3dr4 n PHE 110 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 3dr4 s ASN 111 N -2.50 6.19 0.02 4.37 0.01 -1.25 -4.67 114.94 117.11 3dr4 s ASN 111 Ca 0.00 -0.02 -0.37 0.00 -0.71 0.00 0.00 52.86 51.76 3dr4 s ASN 111 Cb 0.00 -1.63 -0.16 0.00 0.41 0.00 0.00 41.25 39.87 3dr4 s ASN 111 CO 0.00 -0.21 1.43 -0.11 -1.51 0.00 0.00 177.10 176.70 3dr4 n LEU 112 N -1.50 1.84 -4.48 0.60 0.00 -1.26 0.12 117.00 112.31 3dr4 n LEU 112 Ca -0.06 1.11 -0.43 0.00 0.00 0.00 0.00 56.01 56.63 3dr4 n LEU 112 Cb 0.57 -1.19 -0.05 0.00 0.00 0.00 0.00 43.42 42.75 3dr4 n LEU 112 CO 0.44 -0.90 0.51 -0.62 0.00 0.00 0.00 177.39 176.82 3dr4 s ASP 113 N 1.11 6.27 0.50 1.96 -1.08 -0.73 -4.68 116.67 120.03 3dr4 s ASP 113 Ca 0.87 -0.68 0.22 0.00 -0.52 0.00 0.00 52.55 52.44 3dr4 s ASP 113 Cb -0.97 -2.35 1.29 0.00 -1.46 0.00 0.00 42.92 39.43 3dr4 s ASP 113 CO 0.50 -1.04 1.98 0.00 0.52 0.00 0.00 175.17 177.13 3dr4 h ALA 114 N 9.14 2.37 0.00 3.66 0.00 -1.89 0.25 119.26 132.78 3dr4 h ALA 114 Ca -0.27 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3dr4 h ALA 114 Cb 1.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3dr4 h ALA 114 CO 1.02 -0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.75 3dr4 n ALA 115 N -2.60 1.32 0.91 0.00 0.00 -1.26 -1.81 120.51 117.07 3dr4 n ALA 115 Ca 0.10 0.13 0.11 0.00 0.00 0.00 0.00 53.44 53.78 3dr4 n ALA 115 Cb 0.56 -1.32 0.09 0.00 0.00 0.00 0.00 19.45 18.78 3dr4 n ALA 115 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3dr4 n LYS 116 N -2.16 1.99 0.08 0.00 5.02 0.08 -4.59 118.16 118.57 3dr4 n LYS 116 Ca 0.00 -1.76 -0.13 0.00 -2.02 0.00 0.00 58.31 54.41 3dr4 n LYS 116 Cb 0.12 -1.42 -0.08 0.00 -0.02 0.00 0.00 35.03 33.62 3dr4 n LYS 116 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 3dr4 h LEU 117 N 4.17 -0.18 -0.78 -0.35 3.38 -1.44 -3.35 115.31 116.76 3dr4 h LEU 117 Ca 0.00 -0.29 0.15 0.00 0.09 0.00 0.00 57.88 57.83 3dr4 h LEU 117 Cb 0.90 0.05 -0.15 0.00 0.09 0.00 0.00 40.66 41.55 3dr4 h LEU 117 CO 0.00 0.22 -0.24 -0.08 0.09 0.00 0.00 178.44 178.43 3dr4 h GLU 118 N -0.63 -0.03 0.00 1.13 4.57 -1.81 0.56 114.58 118.38 3dr4 h GLU 118 Ca -0.02 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.16 3dr4 h GLU 118 Cb 0.46 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 3dr4 h GLU 118 CO 0.04 -0.02 0.00 0.00 -1.18 0.00 0.00 179.01 177.85 3dr4 n ALA 119 N -3.31 1.17 0.78 2.92 0.00 -1.26 -1.75 120.51 119.07 3dr4 n ALA 119 Ca 0.10 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.70 3dr4 n ALA 119 Cb 0.40 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.67 3dr4 n ALA 119 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dr4 n LEU 120 N -1.75 0.71 -4.74 0.00 4.77 0.20 -4.95 117.00 111.24 3dr4 n LEU 120 Ca 0.00 -0.24 -0.41 0.00 -0.03 0.00 0.00 56.01 55.33 3dr4 n LEU 120 Cb 0.05 -0.07 -0.03 0.00 -2.33 0.00 0.00 43.42 41.05 3dr4 n LEU 120 CO 0.06 0.15 1.01 -0.63 -1.33 0.00 0.00 177.39 176.65 3dr4 s ILE 121 N -3.11 3.13 0.31 -0.08 1.01 -0.71 -4.97 121.20 116.78 3dr4 s ILE 121 Ca 0.06 0.92 0.05 0.00 0.00 0.00 0.00 60.65 61.67 3dr4 s ILE 121 Cb 0.16 -3.59 -0.03 0.00 0.01 0.00 0.00 42.46 39.01 3dr4 s ILE 121 CO 0.83 0.13 0.27 0.42 0.00 0.00 0.00 174.94 176.59 3dr4 s THR 122 N 0.21 0.00 0.60 2.92 -4.23 -1.26 -5.00 115.64 108.88 3dr4 s THR 122 Ca 0.58 -1.96 0.31 0.00 -1.18 0.00 0.00 61.69 59.44 3dr4 s THR 122 Cb -0.37 -2.51 0.37 0.00 1.34 0.00 0.00 72.50 71.32 3dr4 s THR 122 CO 0.38 0.00 2.17 -0.65 -0.54 0.00 0.00 174.62 175.98 3dr4 h PRO 123 N 2.22 0.00 -0.00 3.99 0.11 -2.02 -1.76 132.00 134.55 3dr4 h PRO 123 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 3dr4 h PRO 123 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3dr4 h PRO 123 CO 0.39 0.00 -0.47 0.54 -0.21 0.00 0.00 178.00 178.26 3dr4 n ARG 124 N -3.68 0.17 -1.87 1.05 1.74 -1.26 -4.93 116.66 107.88 3dr4 n ARG 124 Ca -0.01 -0.10 -0.42 0.00 -0.77 0.00 0.00 57.85 56.56 3dr4 n ARG 124 Cb 0.22 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.13 3dr4 n ARG 124 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 3dr4 s THR 125 N -2.90 2.46 -0.00 0.55 2.01 -0.66 -0.86 115.64 116.23 3dr4 s THR 125 Ca 0.14 0.32 0.01 0.00 0.31 0.00 0.00 61.69 62.46 3dr4 s THR 125 Cb 0.18 -3.21 -0.01 0.00 0.01 0.00 0.00 72.50 69.47 3dr4 s THR 125 CO 0.67 0.02 0.01 0.29 -0.69 0.00 0.00 174.62 174.92 3dr4 n LYS 126 N 4.02 1.61 -3.50 4.92 4.76 0.10 -4.86 118.16 125.21 3dr4 n LYS 126 Ca 0.14 -0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.47 3dr4 n LYS 126 Cb 0.38 -1.02 -0.03 0.00 -1.84 0.00 0.00 35.03 32.52 3dr4 n LYS 126 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3dr4 s ALA 127 N -2.03 -1.39 -0.05 7.82 0.00 -1.22 -1.27 121.76 123.63 3dr4 s ALA 127 Ca -0.00 0.30 0.06 0.00 0.00 0.00 0.00 51.96 52.32 3dr4 s ALA 127 Cb 0.00 0.84 -0.02 0.00 0.00 0.00 0.00 23.12 23.94 3dr4 s ALA 127 CO 0.03 -0.74 -0.23 0.42 0.00 0.00 0.00 175.76 175.23 3dr4 s ILE 128 N -3.77 2.27 -0.71 0.00 1.01 -0.05 -0.94 121.20 119.01 3dr4 s ILE 128 Ca 0.02 -1.01 0.03 0.00 0.00 0.00 0.00 60.65 59.69 3dr4 s ILE 128 Cb -0.00 -1.83 0.17 0.00 0.01 0.00 0.00 42.46 40.81 3dr4 s ILE 128 CO -0.12 0.58 0.51 -0.32 0.00 0.00 0.00 174.94 175.59 3dr4 s MET 129 N -0.40 2.57 0.34 2.79 1.75 0.91 -1.35 119.30 125.91 3dr4 s MET 129 Ca 0.04 -3.14 -0.29 0.00 -1.25 0.00 0.00 55.69 51.05 3dr4 s MET 129 Cb -0.12 -3.55 -0.11 0.00 2.84 0.00 0.00 34.83 33.89 3dr4 s MET 129 CO 0.01 -1.24 1.37 -1.25 -0.65 0.00 0.00 175.02 173.27 3dr4 s PRO 130 N -1.12 4.27 -0.17 4.11 0.04 -1.21 -4.34 135.00 136.57 3dr4 s PRO 130 Ca 0.23 2.34 0.01 0.00 0.04 0.00 0.00 61.00 63.63 3dr4 s PRO 130 Cb -0.10 -3.04 0.02 0.00 0.04 0.00 0.00 34.50 31.42 3dr4 s PRO 130 CO -0.12 -0.32 -0.19 0.08 0.04 0.00 0.00 177.00 176.49 3dr4 s VAL 131 N -1.10 2.16 -1.25 -0.36 1.01 -1.26 -0.65 120.40 118.94 3dr4 s VAL 131 Ca 0.51 -0.92 -0.15 0.00 0.00 0.00 0.00 61.98 61.42 3dr4 s VAL 131 Cb -0.42 -1.90 0.14 0.00 0.00 0.00 0.00 36.38 34.19 3dr4 s VAL 131 CO 0.56 0.53 1.60 1.41 0.00 0.00 0.00 175.10 179.20 3dr4 n HIS 132 N 4.50 4.66 -2.07 5.22 8.25 -0.81 -4.54 115.22 130.44 3dr4 n HIS 132 Ca -0.21 -3.14 -0.39 0.00 -0.26 0.00 0.00 57.72 53.73 3dr4 n HIS 132 Cb 0.50 -2.32 0.00 0.00 1.12 0.00 0.00 29.99 29.30 3dr4 n HIS 132 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3dr4 s LEU 133 N 2.25 4.09 0.00 2.41 1.43 -1.24 -3.51 118.68 124.11 3dr4 s LEU 133 Ca 0.46 2.57 0.00 0.00 -1.03 0.00 0.00 54.13 56.13 3dr4 s LEU 133 Cb 0.01 -4.07 0.00 0.00 0.03 0.00 0.00 46.19 42.16 3dr4 s LEU 133 CO 0.02 -1.00 0.00 -1.22 0.23 0.00 0.00 176.35 174.38 3dr4 n TYR 134 N -0.26 0.00 0.00 0.29 4.01 -1.26 -2.09 117.16 117.85 3dr4 n TYR 134 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 3dr4 n TYR 134 Cb 0.45 -1.84 0.00 0.00 -0.31 0.00 0.00 39.34 37.64 3dr4 n TYR 134 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dr4 n GLY 135 N 0.55 0.91 3.48 2.72 0.00 -0.92 0.22 105.19 112.14 3dr4 n GLY 135 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3dr4 n GLY 135 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dr4 s GLN 136 N -0.79 3.64 0.36 1.61 0.74 -0.89 -1.34 119.66 122.99 3dr4 s GLN 136 Ca 0.00 -0.53 -0.26 0.00 0.05 0.00 0.00 55.36 54.63 3dr4 s GLN 136 Cb 0.00 -2.94 -0.09 0.00 1.10 0.00 0.00 33.01 31.08 3dr4 s GLN 136 CO 0.00 0.18 1.07 0.42 -0.55 0.00 0.00 175.29 176.41 3dr4 s ILE 137 N 0.53 3.63 1.13 -2.34 1.01 -1.26 -3.60 121.20 120.30 3dr4 s ILE 137 Ca -0.03 1.36 -0.12 0.00 0.00 0.00 0.00 60.65 61.86 3dr4 s ILE 137 Cb -0.14 -3.76 0.26 0.00 0.01 0.00 0.00 42.46 38.83 3dr4 s ILE 137 CO 0.03 0.12 1.04 0.00 0.00 0.00 0.00 174.94 176.13 3dr4 s ASP 139 N -2.62 6.67 0.42 0.00 2.15 -1.26 -4.78 116.67 117.24 3dr4 s ASP 139 Ca 0.68 -1.97 0.13 0.00 0.43 0.00 0.00 52.55 51.82 3dr4 s ASP 139 Cb -0.24 -2.52 0.92 0.00 -0.30 0.00 0.00 42.92 40.78 3dr4 s ASP 139 CO 0.63 -1.25 1.95 0.24 -0.17 0.00 0.00 175.17 176.57 3dr4 h MET 140 N 8.80 0.04 0.68 4.34 2.86 -1.98 -3.13 114.93 126.54 3dr4 h MET 140 Ca 0.26 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.86 3dr4 h MET 140 Cb 0.97 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.62 3dr4 h MET 140 CO 1.34 0.25 -0.40 -0.44 1.06 0.00 0.00 176.91 178.72 3dr4 h ASP 141 N 0.03 -1.01 -0.30 1.22 3.32 -2.00 0.50 116.42 118.18 3dr4 h ASP 141 Ca 0.00 0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.07 3dr4 h ASP 141 Cb 0.39 0.29 -0.02 0.00 0.22 0.00 0.00 39.33 40.21 3dr4 h ASP 141 CO 0.03 -0.64 0.06 1.55 -1.72 0.00 0.00 179.24 178.53 3dr4 h PRO 142 N -1.02 0.58 -0.22 3.56 0.13 -1.99 -1.95 132.00 131.10 3dr4 h PRO 142 Ca -0.09 -0.11 -0.01 0.00 -0.87 0.00 0.00 66.00 64.92 3dr4 h PRO 142 Cb 0.82 -0.09 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 3dr4 h PRO 142 CO 0.10 0.56 0.10 0.82 -0.23 0.00 0.00 178.00 179.35 3dr4 h ILE 143 N 0.57 1.14 -0.10 -3.56 2.04 -1.44 -2.19 117.51 113.96 3dr4 h ILE 143 Ca 0.13 -0.42 -0.10 0.00 1.00 0.00 0.00 64.86 65.47 3dr4 h ILE 143 Cb 0.27 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.36 3dr4 h ILE 143 CO 0.00 0.14 -0.39 -0.07 0.00 0.00 0.00 178.15 177.84 3dr4 h LEU 144 N 0.21 0.22 -0.30 1.44 3.38 -0.55 -0.92 115.31 118.79 3dr4 h LEU 144 Ca 0.07 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3dr4 h LEU 144 Cb 0.13 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3dr4 h LEU 144 CO -0.01 0.59 0.19 -0.08 0.09 0.00 0.00 178.44 179.22 3dr4 h GLU 145 N 0.18 0.40 -0.39 1.13 4.22 -1.26 0.28 114.58 119.14 3dr4 h GLU 145 Ca 0.02 -0.03 -0.12 0.00 0.08 0.00 0.00 59.36 59.30 3dr4 h GLU 145 Cb 0.77 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.92 3dr4 h GLU 145 CO 0.06 0.30 -0.23 0.28 -2.18 0.00 0.00 179.01 177.23 3dr4 h VAL 146 N 0.39 1.28 -0.39 0.32 2.07 -1.15 -1.72 116.25 117.06 3dr4 h VAL 146 Ca 0.11 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 3dr4 h VAL 146 Cb -0.01 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.07 3dr4 h VAL 146 CO -0.02 0.46 0.21 0.00 0.02 0.00 0.00 177.57 178.24 3dr4 h ALA 147 N 0.80 0.50 -0.82 1.67 0.00 -0.70 -2.65 119.26 118.06 3dr4 h ALA 147 Ca 0.08 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.93 3dr4 h ALA 147 Cb 0.80 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 3dr4 h ALA 147 CO 0.07 0.03 0.54 0.00 0.00 0.00 0.00 179.25 179.88 3dr4 h ARG 148 N 0.50 1.04 0.00 0.00 3.08 -0.38 0.16 114.38 118.78 3dr4 h ARG 148 Ca 0.14 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.12 3dr4 h ARG 148 Cb 0.06 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 29.87 3dr4 h ARG 148 CO -0.02 0.69 -0.02 -0.09 -1.07 0.00 0.00 179.97 179.45 3dr4 h ARG 149 N 1.07 0.00 -0.18 0.04 2.43 -1.03 -2.20 114.38 114.51 3dr4 h ARG 149 Ca 0.31 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.48 3dr4 h ARG 149 Cb -0.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 3dr4 h ARG 149 CO -0.09 0.02 0.00 0.72 -1.51 0.00 0.00 179.97 179.12 3dr4 n HIS 150 N -3.63 0.28 -3.82 2.20 8.25 -0.73 -4.98 115.22 112.79 3dr4 n HIS 150 Ca -0.03 -0.55 -0.27 0.00 -0.26 0.00 0.00 57.72 56.61 3dr4 n HIS 150 Cb 0.11 -0.06 0.03 0.00 1.12 0.00 0.00 29.99 31.19 3dr4 n HIS 150 CO 0.00 0.00 0.00 -1.71 0.64 0.00 0.00 176.34 175.27 3dr4 n ASN 151 N -0.09 -3.54 -4.91 0.41 5.15 -0.12 -4.98 115.26 107.18 3dr4 n ASN 151 Ca 0.08 -0.78 -0.28 0.00 -0.60 0.00 0.00 54.58 52.99 3dr4 n ASN 151 Cb 0.40 -4.00 -0.04 0.00 -0.53 0.00 0.00 39.78 35.61 3dr4 n ASN 151 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3dr4 s LEU 152 N -7.07 4.24 0.46 1.20 1.43 0.38 -5.01 118.68 114.31 3dr4 s LEU 152 Ca 0.42 0.15 -0.08 0.00 -1.03 0.00 0.00 54.13 53.59 3dr4 s LEU 152 Cb -0.21 -2.83 -0.05 0.00 0.03 0.00 0.00 46.19 43.13 3dr4 s LEU 152 CO 0.82 0.10 0.80 -0.76 0.23 0.00 0.00 176.35 177.54 3dr4 s LEU 153 N -2.92 3.69 -0.10 1.79 1.43 -0.39 -4.61 118.68 117.56 3dr4 s LEU 153 Ca 0.34 1.08 0.01 0.00 -1.03 0.00 0.00 54.13 54.53 3dr4 s LEU 153 Cb -0.12 -4.00 0.02 0.00 0.03 0.00 0.00 46.19 42.12 3dr4 s LEU 153 CO 0.27 -0.52 -0.12 -0.69 0.23 0.00 0.00 176.35 175.52 3dr4 s VAL 154 N -2.60 1.30 -0.22 -1.59 1.01 -1.26 -0.87 120.40 116.17 3dr4 s VAL 154 Ca 0.50 -0.51 0.00 0.00 0.00 0.00 0.00 61.98 61.97 3dr4 s VAL 154 Cb -0.10 -1.22 0.03 0.00 0.00 0.00 0.00 36.38 35.09 3dr4 s VAL 154 CO 0.39 0.40 -0.13 -0.51 0.00 0.00 0.00 175.10 175.26 3dr4 s ILE 155 N 1.13 2.41 -0.00 2.22 2.07 -0.46 0.13 121.20 128.70 3dr4 s ILE 155 Ca -0.05 -1.11 -0.30 0.00 -1.41 0.00 0.00 60.65 57.79 3dr4 s ILE 155 Cb -0.14 -2.19 -0.03 0.00 0.13 0.00 0.00 42.46 40.23 3dr4 s ILE 155 CO -0.03 0.29 0.97 -1.61 -1.91 0.00 0.00 174.94 172.66 3dr4 s GLU 156 N 1.27 4.55 -0.86 3.50 2.02 -0.76 -3.35 118.70 125.07 3dr4 s GLU 156 Ca 0.00 1.40 -0.18 0.00 0.02 0.00 0.00 54.97 56.22 3dr4 s GLU 156 Cb -0.16 -3.46 0.14 0.00 0.10 0.00 0.00 34.13 30.75 3dr4 s GLU 156 CO -0.08 -0.05 1.00 0.34 0.02 0.00 0.00 175.26 176.49 3dr4 s ASP 157 N 1.01 6.59 -0.21 -0.19 -1.08 0.17 -0.85 116.67 122.09 3dr4 s ASP 157 Ca 0.51 -2.05 0.15 0.00 -0.52 0.00 0.00 52.55 50.64 3dr4 s ASP 157 Cb -0.21 -2.35 0.78 0.00 -1.46 0.00 0.00 42.92 39.68 3dr4 s ASP 157 CO 0.27 -0.99 1.70 0.00 0.52 0.00 0.00 175.17 176.68 3dr4 n ALA 158 N 6.08 3.69 -0.31 3.66 0.00 0.24 -1.92 120.51 131.96 3dr4 n ALA 158 Ca 0.17 -1.92 0.12 0.00 0.00 0.00 0.00 53.44 51.80 3dr4 n ALA 158 Cb 0.48 -1.06 0.24 0.00 0.00 0.00 0.00 19.45 19.10 3dr4 n ALA 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dr4 n ALA 159 N 0.57 0.41 -0.92 0.00 0.00 -0.97 -0.24 120.51 119.37 3dr4 n ALA 159 Ca 0.27 0.94 0.07 0.00 0.00 0.00 0.00 53.44 54.72 3dr4 n ALA 159 Cb 1.13 -0.67 0.40 0.00 0.00 0.00 0.00 19.45 20.31 3dr4 n ALA 159 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3dr4 n GLU 160 N -5.30 4.83 -0.78 0.00 1.02 -1.26 -3.27 120.64 115.87 3dr4 n GLU 160 Ca 0.20 -3.16 0.04 0.00 -0.02 0.00 0.00 57.16 54.21 3dr4 n GLU 160 Cb 0.64 -2.26 0.07 0.00 -0.02 0.00 0.00 31.44 29.87 3dr4 n GLU 160 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dr4 n ALA 161 N 0.56 2.45 -1.61 0.62 0.00 0.67 -2.17 120.51 121.02 3dr4 n ALA 161 Ca 0.28 -2.12 -0.46 0.00 0.00 0.00 0.00 53.44 51.14 3dr4 n ALA 161 Cb 1.20 -0.53 -0.03 0.00 0.00 0.00 0.00 19.45 20.09 3dr4 n ALA 161 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3dr4 n VAL 162 N -0.27 1.35 0.00 0.00 0.31 -1.25 -1.78 118.33 116.70 3dr4 n VAL 162 Ca 0.08 -0.34 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 3dr4 n VAL 162 Cb 0.84 -1.10 0.00 0.00 -0.91 0.00 0.00 33.84 32.67 3dr4 n VAL 162 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3dr4 n GLY 163 N 1.70 2.83 3.75 2.92 0.00 -1.26 -4.89 105.19 110.23 3dr4 n GLY 163 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 3dr4 n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dr4 s ALA 164 N -2.02 2.23 0.09 4.61 0.00 -0.73 -4.86 121.76 121.07 3dr4 s ALA 164 Ca 0.00 0.59 0.01 0.00 0.00 0.00 0.00 51.96 52.56 3dr4 s ALA 164 Cb 0.00 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.71 3dr4 s ALA 164 CO 0.00 -1.69 -0.06 0.95 0.00 0.00 0.00 175.76 174.96 3dr4 s THR 165 N -2.38 0.57 -0.19 0.00 -4.23 -0.88 -1.27 115.64 107.26 3dr4 s THR 165 Ca 0.68 -1.89 -0.04 0.00 -1.18 0.00 0.00 61.69 59.26 3dr4 s THR 165 Cb -0.22 -1.63 0.09 0.00 1.34 0.00 0.00 72.50 72.08 3dr4 s THR 165 CO 0.47 -0.90 0.23 -0.47 -0.54 0.00 0.00 174.62 173.41 3dr4 s TYR 166 N -3.67 -0.32 -1.51 3.99 6.14 0.76 -2.30 117.35 120.44 3dr4 s TYR 166 Ca 0.10 0.38 -0.07 0.00 0.64 0.00 0.00 57.07 58.13 3dr4 s TYR 166 Cb 0.06 -0.29 0.06 0.00 0.42 0.00 0.00 41.96 42.20 3dr4 s TYR 166 CO -0.06 -0.55 0.57 0.54 0.64 0.00 0.00 175.55 176.69 3dr4 n ARG 167 N 5.33 -3.42 -0.74 4.97 1.74 0.32 -1.90 116.66 122.95 3dr4 n ARG 167 Ca -0.05 0.41 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 3dr4 n ARG 167 Cb 0.50 -4.77 0.00 0.00 -1.02 0.00 0.00 32.46 27.16 3dr4 n ARG 167 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dr4 n GLY 168 N -1.79 0.96 3.51 -0.13 0.00 -1.26 -5.05 105.19 101.43 3dr4 n GLY 168 Ca -0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 3dr4 n GLY 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dr4 s LYS 169 N -0.22 2.54 0.48 1.61 1.02 -0.80 -5.11 119.74 119.26 3dr4 s LYS 169 Ca 0.00 -0.68 -0.20 0.00 0.02 0.00 0.00 55.97 55.12 3dr4 s LYS 169 Cb 0.00 -2.42 -0.09 0.00 -0.52 0.00 0.00 37.83 34.80 3dr4 s LYS 169 CO 0.00 0.63 1.01 0.15 -0.92 0.00 0.00 175.35 176.22 3dr4 s LYS 170 N -0.83 3.91 0.45 1.68 -0.14 -1.26 -0.17 119.74 123.38 3dr4 s LYS 170 Ca 0.12 1.24 -0.23 0.00 -1.36 0.00 0.00 55.97 55.74 3dr4 s LYS 170 Cb -0.11 -2.12 -0.10 0.00 -1.68 0.00 0.00 37.83 33.83 3dr4 s LYS 170 CO 0.01 -0.32 1.00 -1.13 -0.76 0.00 0.00 175.35 174.16 3dr4 n SER 171 N -0.99 1.18 0.00 2.83 3.41 -0.40 -1.81 113.62 117.84 3dr4 n SER 171 Ca 0.08 1.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.69 3dr4 n SER 171 Cb 0.53 -1.36 0.00 0.00 -0.26 0.00 0.00 64.21 63.12 3dr4 n SER 171 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dr4 n GLY 172 N 1.20 2.99 0.42 5.00 0.00 -1.26 -4.84 105.19 108.70 3dr4 n GLY 172 Ca 0.10 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.16 3dr4 n GLY 172 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3dr4 n SER 173 N 0.00 2.25 -0.07 1.61 3.41 -0.75 -4.45 113.62 115.61 3dr4 n SER 173 Ca 0.00 -1.70 -0.22 0.00 -0.26 0.00 0.00 58.87 56.68 3dr4 n SER 173 Cb 0.00 -0.10 -0.12 0.00 -0.26 0.00 0.00 64.21 63.73 3dr4 n SER 173 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3dr4 n LEU 174 N 0.37 2.14 0.00 1.04 4.77 -1.26 -4.99 117.00 119.07 3dr4 n LEU 174 Ca 0.07 0.33 -0.20 0.00 -0.03 0.00 0.00 56.01 56.18 3dr4 n LEU 174 Cb 0.31 -1.00 0.13 0.00 -2.33 0.00 0.00 43.42 40.52 3dr4 n LEU 174 CO 0.06 0.50 0.55 0.61 -1.33 0.00 0.00 177.39 177.78 3dr4 n GLY 175 N 1.62 -0.43 0.27 -0.72 0.00 -1.26 -4.95 105.19 99.72 3dr4 n GLY 175 Ca -0.34 -1.85 0.07 0.00 0.00 0.00 0.00 46.02 43.91 3dr4 n GLY 175 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dr4 h ASP 176 N -0.92 0.11 -5.01 1.61 3.32 0.76 -3.45 116.42 112.84 3dr4 h ASP 176 Ca -0.29 -0.00 0.05 0.00 0.02 0.00 0.00 57.03 56.81 3dr4 h ASP 176 Cb 0.92 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 40.40 3dr4 h ASP 176 CO 0.25 0.08 0.25 0.00 -1.72 0.00 0.00 179.24 178.10 3dr4 s ALA 178 N -3.54 -0.47 0.10 0.00 0.00 0.73 -1.83 121.76 116.76 3dr4 s ALA 178 Ca 0.12 -0.50 0.04 0.00 0.00 0.00 0.00 51.96 51.63 3dr4 s ALA 178 Cb -0.06 0.76 -0.04 0.00 0.00 0.00 0.00 23.12 23.79 3dr4 s ALA 178 CO 0.08 -0.66 -0.11 0.95 0.00 0.00 0.00 175.76 176.01 3dr4 s THR 179 N -3.89 1.04 0.15 0.00 -4.23 -0.03 -0.40 115.64 108.27 3dr4 s THR 179 Ca 0.10 -1.64 0.04 0.00 -1.18 0.00 0.00 61.69 59.02 3dr4 s THR 179 Cb 0.02 -1.38 -0.04 0.00 1.34 0.00 0.00 72.50 72.44 3dr4 s THR 179 CO -0.05 -0.51 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.07 3dr4 s PHE 180 N -2.30 1.28 0.09 3.99 0.40 -0.01 -0.59 117.98 120.85 3dr4 s PHE 180 Ca 0.06 -0.78 0.10 0.00 -0.60 0.00 0.00 56.93 55.71 3dr4 s PHE 180 Cb -0.04 -0.66 -0.04 0.00 0.51 0.00 0.00 43.02 42.80 3dr4 s PHE 180 CO 0.01 0.07 -0.25 0.45 0.70 0.00 0.00 175.22 176.19 3dr4 s SER 181 N -3.17 3.35 -0.26 1.36 0.15 -1.20 -1.61 113.70 112.30 3dr4 s SER 181 Ca 0.17 -0.66 0.15 0.00 0.70 0.00 0.00 55.95 56.31 3dr4 s SER 181 Cb 0.03 -0.30 0.48 0.00 -1.71 0.00 0.00 66.02 64.52 3dr4 s SER 181 CO 0.01 0.21 1.16 0.49 1.20 0.00 0.00 173.24 176.31 3dr4 n PHE 182 N 1.23 1.90 -0.67 3.44 3.72 0.29 -4.86 117.46 122.52 3dr4 n PHE 182 Ca -0.17 -2.09 -0.29 0.00 -0.05 0.00 0.00 57.45 54.84 3dr4 n PHE 182 Cb 0.53 -0.28 0.21 0.00 -0.94 0.00 0.00 39.48 38.99 3dr4 n PHE 182 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 3dr4 s PHE 183 N -3.54 1.55 0.49 1.38 5.36 -1.26 -0.09 117.98 121.87 3dr4 s PHE 183 Ca 0.40 1.39 0.26 0.00 -0.96 0.00 0.00 56.93 58.02 3dr4 s PHE 183 Cb 0.37 -3.18 1.33 0.00 -0.34 0.00 0.00 43.02 41.20 3dr4 s PHE 183 CO -0.01 -3.37 1.86 0.78 -1.46 0.00 0.00 175.22 173.03 3dr4 h GLY 184 N -2.27 0.38 -0.83 13.12 0.00 -1.70 -1.20 103.07 110.58 3dr4 h GLY 184 Ca -0.54 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.71 3dr4 h GLY 184 CO 0.48 -0.02 0.00 1.16 0.00 0.00 0.00 176.54 178.16 3dr4 n ASN 185 N -4.37 1.84 -4.82 0.19 0.23 -1.26 -3.64 115.26 103.43 3dr4 n ASN 185 Ca 0.20 -1.64 -0.30 0.00 -0.53 0.00 0.00 54.58 52.31 3dr4 n ASN 185 Cb 0.89 -0.03 0.08 0.00 -2.08 0.00 0.00 39.78 38.64 3dr4 n ASN 185 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3dr4 s ALA 186 N -1.94 2.37 0.21 -2.53 0.00 -0.45 -4.66 121.76 114.77 3dr4 s ALA 186 Ca 0.35 -0.25 -0.09 0.00 0.00 0.00 0.00 51.96 51.97 3dr4 s ALA 186 Cb 0.20 -3.09 0.16 0.00 0.00 0.00 0.00 23.12 20.39 3dr4 s ALA 186 CO 0.31 -1.63 1.83 0.82 0.00 0.00 0.00 175.76 177.10 3dr4 h ILE 187 N -1.01 1.23 -3.15 0.00 2.04 -1.89 -3.36 117.51 111.37 3dr4 h ILE 187 Ca -0.47 -0.57 -0.64 0.00 1.00 0.00 0.00 64.86 64.18 3dr4 h ILE 187 Cb 1.27 0.19 -0.35 0.00 -0.74 0.00 0.00 36.82 37.19 3dr4 h ILE 187 CO 0.60 0.26 -0.85 -0.63 0.00 0.00 0.00 178.15 177.53 3dr4 s ILE 188 N -5.85 1.82 0.17 -0.67 1.01 -1.26 -4.98 121.20 111.44 3dr4 s ILE 188 Ca -0.13 -0.81 0.08 0.00 0.00 0.00 0.00 60.65 59.80 3dr4 s ILE 188 Cb 0.15 -1.65 -0.04 0.00 0.01 0.00 0.00 42.46 40.93 3dr4 s ILE 188 CO 0.81 0.50 -0.08 0.28 0.00 0.00 0.00 174.94 176.45 3dr4 s THR 189 N 1.18 3.32 -0.04 2.92 -1.32 -1.26 -4.36 115.64 116.08 3dr4 s THR 189 Ca 0.00 -1.56 0.06 0.00 -1.21 0.00 0.00 61.69 58.98 3dr4 s THR 189 Cb -0.14 -2.64 0.09 0.00 -1.51 0.00 0.00 72.50 68.31 3dr4 s THR 189 CO -0.08 -0.08 0.95 0.35 -2.21 0.00 0.00 174.62 173.56 3dr4 n THR 190 N 0.10 0.81 0.00 5.08 -2.24 0.87 -4.03 114.28 114.87 3dr4 n THR 190 Ca -0.11 -0.93 0.00 0.00 -2.27 0.00 0.00 64.05 60.74 3dr4 n THR 190 Cb 0.55 0.36 0.00 0.00 -2.10 0.00 0.00 70.33 69.14 3dr4 n THR 190 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dr4 n GLY 191 N -0.56 2.04 2.92 3.38 0.00 -1.16 -4.70 105.19 107.11 3dr4 n GLY 191 Ca 0.05 -0.30 -0.16 0.00 0.00 0.00 0.00 46.02 45.61 3dr4 n GLY 191 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dr4 s GLU 192 N 0.00 0.38 0.00 1.61 0.41 -1.25 -1.65 118.70 118.20 3dr4 s GLU 192 Ca 0.00 -0.11 0.00 0.00 -0.41 0.00 0.00 54.97 54.45 3dr4 s GLU 192 Cb 0.00 -0.40 0.00 0.00 -1.78 0.00 0.00 34.13 31.95 3dr4 s GLU 192 CO 0.00 0.04 0.00 0.41 -0.49 0.00 0.00 175.26 175.22 3dr4 n GLY 193 N 3.26 1.57 3.65 -1.39 0.00 -1.03 -4.79 105.19 106.45 3dr4 n GLY 193 Ca -0.16 -0.80 -0.10 0.00 0.00 0.00 0.00 46.02 44.96 3dr4 n GLY 193 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dr4 s GLY 194 N 0.00 0.55 -0.06 -0.02 0.00 0.00 -0.54 107.32 107.25 3dr4 s GLY 194 Ca 0.00 -0.86 -0.14 0.00 0.00 0.00 0.00 44.72 43.73 3dr4 s GLY 194 CO 0.00 -0.55 0.32 -0.29 0.00 0.00 0.00 173.10 172.58 3dr4 s MET 195 N -3.63 0.55 -0.06 2.90 1.75 -0.63 -0.73 119.30 119.45 3dr4 s MET 195 Ca 0.21 0.08 0.03 0.00 -1.25 0.00 0.00 55.69 54.76 3dr4 s MET 195 Cb -0.02 0.25 -0.02 0.00 2.84 0.00 0.00 34.83 37.88 3dr4 s MET 195 CO 0.11 -0.13 -0.15 0.42 -0.65 0.00 0.00 175.02 174.62 3dr4 s ILE 196 N -0.70 3.00 0.09 10.11 1.01 0.29 -0.83 121.20 134.17 3dr4 s ILE 196 Ca -0.08 -0.74 0.10 0.00 0.00 0.00 0.00 60.65 59.93 3dr4 s ILE 196 Cb -0.04 -2.18 -0.03 0.00 0.01 0.00 0.00 42.46 40.22 3dr4 s ILE 196 CO 0.03 0.58 -0.26 0.42 0.00 0.00 0.00 174.94 175.71 3dr4 s THR 197 N -0.61 2.17 0.08 2.92 -4.23 0.46 -0.14 115.64 116.29 3dr4 s THR 197 Ca 0.09 -1.56 -0.26 0.00 -1.18 0.00 0.00 61.69 58.78 3dr4 s THR 197 Cb -0.11 -1.89 0.08 0.00 1.34 0.00 0.00 72.50 71.92 3dr4 s THR 197 CO 0.01 0.22 0.77 0.28 -0.54 0.00 0.00 174.62 175.36 3dr4 s THR 198 N -0.93 0.00 -1.62 3.99 -1.32 -0.78 -0.19 115.64 114.79 3dr4 s THR 198 Ca 0.13 -0.08 0.14 0.00 -1.21 0.00 0.00 61.69 60.66 3dr4 s THR 198 Cb -0.10 -1.11 0.07 0.00 -1.51 0.00 0.00 72.50 69.86 3dr4 s THR 198 CO 0.04 0.00 0.89 0.59 -2.21 0.00 0.00 174.62 173.93 3dr4 n ASN 199 N -0.32 1.94 -4.56 8.08 3.02 -1.26 -1.25 115.26 120.92 3dr4 n ASN 199 Ca -0.12 -1.47 -0.43 0.00 -0.03 0.00 0.00 54.58 52.53 3dr4 n ASN 199 Cb 0.63 0.17 -0.04 0.00 -0.61 0.00 0.00 39.78 39.93 3dr4 n ASN 199 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3dr4 s ASP 200 N -1.39 6.48 0.12 6.41 -1.08 -1.26 -4.82 116.67 121.13 3dr4 s ASP 200 Ca 0.15 0.07 -0.22 0.00 -0.52 0.00 0.00 52.55 52.03 3dr4 s ASP 200 Cb 0.12 -2.44 -0.05 0.00 -1.46 0.00 0.00 42.92 39.09 3dr4 s ASP 200 CO 0.24 -1.03 1.69 0.44 0.52 0.00 0.00 175.17 177.03 3dr4 h ASP 201 N 9.06 -0.33 -0.48 -0.34 5.19 -1.99 0.36 116.42 127.89 3dr4 h ASP 201 Ca -0.24 0.06 0.03 0.00 -0.62 0.00 0.00 57.03 56.27 3dr4 h ASP 201 Cb 1.08 0.16 -0.04 0.00 0.18 0.00 0.00 39.33 40.71 3dr4 h ASP 201 CO 1.02 -0.15 0.25 -0.78 -3.12 0.00 0.00 179.24 176.46 3dr4 h ASP 202 N -0.14 0.38 -0.47 6.45 3.58 -2.00 -1.38 116.42 122.83 3dr4 h ASP 202 Ca 0.07 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 57.52 3dr4 h ASP 202 Cb 0.24 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.22 3dr4 h ASP 202 CO -0.17 0.27 0.22 0.25 -2.88 0.00 0.00 179.24 176.92 3dr4 h LEU 203 N 0.50 0.63 -0.87 2.28 5.85 -1.83 -2.01 115.31 119.87 3dr4 h LEU 203 Ca 0.20 -0.14 0.07 0.00 0.84 0.00 0.00 57.88 58.85 3dr4 h LEU 203 Cb 0.09 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 40.89 3dr4 h LEU 203 CO -0.13 0.60 0.54 0.00 -0.34 0.00 0.00 178.44 179.10 3dr4 h ALA 204 N 1.06 1.20 -0.45 1.25 0.00 -0.55 -0.19 119.26 121.59 3dr4 h ALA 204 Ca 0.16 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 3dr4 h ALA 204 Cb 0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3dr4 h ALA 204 CO -0.02 0.27 0.08 0.00 0.00 0.00 0.00 179.25 179.58 3dr4 h ALA 205 N 1.42 0.60 -0.59 0.00 0.00 -0.95 -1.63 119.26 118.11 3dr4 h ALA 205 Ca 0.38 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 55.11 3dr4 h ALA 205 Cb 0.20 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3dr4 h ALA 205 CO -0.18 0.31 0.34 0.87 0.00 0.00 0.00 179.25 180.59 3dr4 h LYS 206 N 0.61 0.65 -0.87 0.00 1.57 -0.74 0.72 116.57 118.51 3dr4 h LYS 206 Ca 0.14 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 3dr4 h LYS 206 Cb 0.37 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.49 3dr4 h LYS 206 CO 0.01 0.43 0.51 0.52 -0.57 0.00 0.00 179.45 180.35 3dr4 h MET 207 N 0.67 1.19 -0.40 3.15 2.86 -0.67 -0.61 114.93 121.11 3dr4 h MET 207 Ca 0.24 -0.12 -0.10 0.00 -2.06 0.00 0.00 59.70 57.67 3dr4 h MET 207 Cb 0.07 -0.25 -0.01 0.00 0.06 0.00 0.00 31.60 31.47 3dr4 h MET 207 CO -0.12 0.84 -0.14 0.00 1.06 0.00 0.00 176.91 178.55 3dr4 h ARG 208 N 1.20 0.80 -0.23 1.72 3.08 -0.59 0.55 114.38 120.92 3dr4 h ARG 208 Ca 0.31 -0.33 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 3dr4 h ARG 208 Cb -0.03 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.97 3dr4 h ARG 208 CO -0.06 0.95 0.14 1.25 -1.07 0.00 0.00 179.97 181.18 3dr4 h LEU 209 N 0.62 0.28 -0.53 3.04 5.85 -0.39 -2.18 115.31 122.00 3dr4 h LEU 209 Ca 0.10 -0.06 -0.13 0.00 0.84 0.00 0.00 57.88 58.63 3dr4 h LEU 209 Cb 0.68 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 3dr4 h LEU 209 CO 0.05 0.26 -0.20 -0.07 -0.34 0.00 0.00 178.44 178.14 3dr4 h LEU 210 N 0.28 1.00 -1.19 2.25 3.38 -0.82 -0.06 115.31 120.15 3dr4 h LEU 210 Ca 0.08 -0.37 0.08 0.00 0.09 0.00 0.00 57.88 57.77 3dr4 h LEU 210 Cb 0.04 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.45 3dr4 h LEU 210 CO -0.01 1.16 0.57 -0.09 0.09 0.00 0.00 178.44 180.16 3dr4 h ARG 211 N 0.85 0.90 -1.95 1.13 2.43 0.46 -0.40 114.38 117.80 3dr4 h ARG 211 Ca 0.11 -0.05 -0.58 0.00 -0.81 0.00 0.00 59.98 58.65 3dr4 h ARG 211 Cb 0.77 -0.20 -0.21 0.00 -0.42 0.00 0.00 29.97 29.91 3dr4 h ARG 211 CO 0.06 0.59 0.62 0.41 -1.51 0.00 0.00 179.97 180.14 3dr4 n GLY 212 N -1.41 4.75 2.64 2.80 0.00 -0.85 -2.44 105.19 110.68 3dr4 n GLY 212 Ca 0.14 -2.05 -0.15 0.00 0.00 0.00 0.00 46.02 43.96 3dr4 n GLY 212 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3dr4 n GLN 213 N 0.36 -1.58 -1.61 1.61 1.13 0.30 -1.98 117.38 115.61 3dr4 n GLN 213 Ca 0.50 1.00 -0.14 0.00 -1.94 0.00 0.00 57.00 56.42 3dr4 n GLN 213 Cb 0.46 -5.38 -0.05 0.00 0.11 0.00 0.00 30.24 25.38 3dr4 n GLN 213 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dr4 n GLY 214 N -0.03 1.09 3.75 1.08 0.00 -0.05 -3.87 105.19 107.16 3dr4 n GLY 214 Ca -0.15 -0.34 -0.40 0.00 0.00 0.00 0.00 46.02 45.13 3dr4 n GLY 214 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3dr4 s MET 215 N -3.55 4.81 0.01 1.61 0.00 -0.84 -3.46 119.30 117.88 3dr4 s MET 215 Ca 0.00 1.50 -0.30 0.00 0.00 0.00 0.00 55.69 56.89 3dr4 s MET 215 Cb 0.00 -3.30 -0.06 0.00 0.00 0.00 0.00 34.83 31.47 3dr4 s MET 215 CO 0.00 0.43 1.45 0.34 0.00 0.00 0.00 175.02 177.24 3dr4 s ASP 216 N -0.88 6.80 0.48 1.11 -1.08 0.28 -4.85 116.67 118.52 3dr4 s ASP 216 Ca 0.43 2.19 0.19 0.00 -0.52 0.00 0.00 52.55 54.83 3dr4 s ASP 216 Cb -0.26 -2.56 1.19 0.00 -1.46 0.00 0.00 42.92 39.83 3dr4 s ASP 216 CO 0.32 -0.76 2.05 -0.65 0.52 0.00 0.00 175.17 176.65 3dr4 h PRO 217 N 7.94 0.00 -0.00 4.34 0.11 -1.94 -2.73 132.00 139.72 3dr4 h PRO 217 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 3dr4 h PRO 217 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3dr4 h PRO 217 CO 0.91 0.14 -0.65 0.09 -0.21 0.00 0.00 178.00 178.28 3dr4 n ASN 218 N -4.16 1.10 -3.75 -2.05 3.02 -1.26 -4.85 115.26 103.31 3dr4 n ASN 218 Ca -0.02 -0.91 -0.29 0.00 -0.03 0.00 0.00 54.58 53.33 3dr4 n ASN 218 Cb 0.22 0.57 -0.16 0.00 -0.61 0.00 0.00 39.78 39.79 3dr4 n ASN 218 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3dr4 s ARG 219 N -2.81 0.78 0.08 3.52 0.52 -1.03 -5.11 118.95 114.90 3dr4 s ARG 219 Ca 0.14 -0.75 -0.34 0.00 -0.52 0.00 0.00 55.73 54.26 3dr4 s ARG 219 Cb 0.17 -2.09 -0.13 0.00 0.52 0.00 0.00 34.95 33.43 3dr4 s ARG 219 CO 0.71 -0.79 1.68 -2.13 0.02 0.00 0.00 175.30 174.80 3dr4 n ARG 220 N 4.93 2.19 -1.72 3.54 3.00 -1.26 -0.56 116.66 126.78 3dr4 n ARG 220 Ca -0.06 0.79 -0.18 0.00 -0.00 0.00 0.00 57.85 58.40 3dr4 n ARG 220 Cb 0.45 -2.59 -0.06 0.00 0.00 0.00 0.00 32.46 30.25 3dr4 n ARG 220 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 3dr4 n TYR 221 N 4.52 -0.20 -3.88 -0.14 4.01 -1.26 -4.96 117.16 115.25 3dr4 n TYR 221 Ca 0.19 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.57 3dr4 n TYR 221 Cb 0.29 -3.23 -0.14 0.00 -0.31 0.00 0.00 39.34 35.96 3dr4 n TYR 221 CO 0.00 0.00 0.00 -0.46 -0.46 0.00 0.00 176.86 175.94 3dr4 s TRP 222 N -2.73 3.00 -0.33 -0.72 -0.11 0.28 -5.05 118.94 113.27 3dr4 s TRP 222 Ca 0.00 -0.92 0.03 0.00 1.22 0.00 0.00 56.10 56.43 3dr4 s TRP 222 Cb 0.00 -2.13 0.09 0.00 -1.50 0.00 0.00 33.47 29.93 3dr4 s TRP 222 CO 0.00 -0.54 0.03 -0.06 -4.62 0.00 0.00 176.95 171.76 3dr4 s PHE 223 N 1.49 3.61 0.21 5.86 0.40 -1.26 -0.56 117.98 127.72 3dr4 s PHE 223 Ca 0.05 -2.71 0.23 0.00 -0.60 0.00 0.00 56.93 53.90 3dr4 s PHE 223 Cb -0.15 -2.69 0.96 0.00 0.51 0.00 0.00 43.02 41.65 3dr4 s PHE 223 CO -0.02 -0.93 1.85 -1.00 0.70 0.00 0.00 175.22 175.82 3dr4 h PRO 224 N 7.72 0.00 -4.34 0.24 0.13 -1.93 -3.46 132.00 130.36 3dr4 h PRO 224 Ca -0.09 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.84 3dr4 h PRO 224 Cb 1.03 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.03 3dr4 h PRO 224 CO 0.53 0.25 -0.48 0.96 -0.23 0.00 0.00 178.00 179.03 3dr4 s ILE 225 N -3.77 0.00 -0.11 -3.56 -4.36 -1.26 -5.13 121.20 103.01 3dr4 s ILE 225 Ca -0.00 -1.84 -0.26 0.00 -0.26 0.00 0.00 60.65 58.29 3dr4 s ILE 225 Cb 0.11 -2.42 -0.02 0.00 1.25 0.00 0.00 42.46 41.37 3dr4 s ILE 225 CO 0.64 0.00 0.84 -0.69 0.24 0.00 0.00 174.94 175.98 3dr4 s VAL 226 N -4.09 4.91 0.00 8.37 1.01 -1.26 -4.60 120.40 124.74 3dr4 s VAL 226 Ca 0.35 1.70 0.00 0.00 0.00 0.00 0.00 61.98 64.03 3dr4 s VAL 226 Cb 0.05 -4.16 0.00 0.00 0.00 0.00 0.00 36.38 32.26 3dr4 s VAL 226 CO 0.12 0.10 0.00 0.61 0.00 0.00 0.00 175.10 175.93 3dr4 n GLY 227 N 3.24 6.53 3.34 4.51 0.00 -1.25 -4.80 105.19 116.76 3dr4 n GLY 227 Ca 0.04 -1.87 -0.17 0.00 0.00 0.00 0.00 46.02 44.02 3dr4 n GLY 227 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dr4 s PHE 228 N 0.08 1.59 -0.81 1.61 0.08 -0.18 -4.80 117.98 115.56 3dr4 s PHE 228 Ca 0.00 -1.04 -0.05 0.00 0.12 0.00 0.00 56.93 55.97 3dr4 s PHE 228 Cb 0.00 -0.95 0.20 0.00 -0.57 0.00 0.00 43.02 41.70 3dr4 s PHE 228 CO 0.00 -0.16 0.69 1.21 -0.10 0.00 0.00 175.22 176.85 3dr4 s ASN 229 N -3.33 5.94 -0.16 1.36 3.84 -1.26 0.11 114.94 121.45 3dr4 s ASN 229 Ca 0.33 -3.26 0.14 0.00 0.21 0.00 0.00 52.86 50.28 3dr4 s ASN 229 Cb 0.07 -1.96 0.35 0.00 -0.55 0.00 0.00 41.25 39.17 3dr4 s ASN 229 CO 0.11 -0.31 1.18 -1.22 -2.79 0.00 0.00 177.10 174.07 3dr4 n TYR 230 N 3.00 0.00 -2.47 0.43 4.01 -1.02 -4.97 117.16 116.14 3dr4 n TYR 230 Ca 0.16 -1.20 -0.36 0.00 -0.16 0.00 0.00 57.90 56.34 3dr4 n TYR 230 Cb 0.39 -0.20 -0.03 0.00 -0.31 0.00 0.00 39.34 39.19 3dr4 n TYR 230 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 3dr4 s ARG 231 N -2.81 3.89 0.31 -0.72 0.52 -1.25 -1.57 118.95 117.31 3dr4 s ARG 231 Ca 0.34 1.51 -0.04 0.00 -0.52 0.00 0.00 55.73 57.02 3dr4 s ARG 231 Cb 0.32 -2.31 -0.05 0.00 0.52 0.00 0.00 34.95 33.44 3dr4 s ARG 231 CO -0.03 -0.38 0.57 1.41 0.02 0.00 0.00 175.30 176.88 3dr4 s MET 232 N -2.87 3.61 0.55 3.54 -2.45 -1.25 -3.92 119.30 116.50 3dr4 s MET 232 Ca 0.64 -0.02 -0.04 0.00 -1.25 0.00 0.00 55.69 55.01 3dr4 s MET 232 Cb -0.21 -2.63 0.00 0.00 1.25 0.00 0.00 34.83 33.24 3dr4 s MET 232 CO 0.26 0.18 0.83 0.95 1.05 0.00 0.00 175.02 178.29 3dr4 s THR 233 N -2.16 3.85 0.37 10.11 -4.23 -1.26 -4.31 115.64 118.02 3dr4 s THR 233 Ca 0.44 -0.10 0.05 0.00 -1.18 0.00 0.00 61.69 60.90 3dr4 s THR 233 Cb -0.10 -3.50 0.21 0.00 1.34 0.00 0.00 72.50 70.45 3dr4 s THR 233 CO 0.32 -0.47 1.96 -1.13 -0.54 0.00 0.00 174.62 174.76 3dr4 h ASN 234 N -0.00 0.50 -0.21 3.99 -1.24 -1.10 -1.35 115.58 116.16 3dr4 h ASN 234 Ca -0.46 -0.05 -0.05 0.00 0.71 0.00 0.00 56.30 56.45 3dr4 h ASN 234 Cb 1.25 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 40.17 3dr4 h ASN 234 CO 0.60 0.47 -0.05 0.40 -1.29 0.00 0.00 177.43 177.55 3dr4 h ILE 235 N 0.55 1.28 -0.64 2.57 2.04 -1.81 0.27 117.51 121.78 3dr4 h ILE 235 Ca 0.13 -1.03 -0.05 0.00 1.00 0.00 0.00 64.86 64.91 3dr4 h ILE 235 Cb 0.13 1.53 -0.03 0.00 -0.74 0.00 0.00 36.82 37.71 3dr4 h ILE 235 CO -0.01 0.32 0.21 1.56 0.00 0.00 0.00 178.15 180.23 3dr4 h GLN 236 N 0.14 0.98 -0.57 2.37 4.20 -1.75 -2.06 115.11 118.42 3dr4 h GLN 236 Ca 0.05 -0.21 -0.06 0.00 0.06 0.00 0.00 58.65 58.50 3dr4 h GLN 236 Cb 0.50 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 3dr4 h GLN 236 CO 0.02 0.86 0.12 0.00 -0.67 0.00 0.00 178.83 179.16 3dr4 h ALA 237 N 1.08 1.14 -0.55 3.87 0.00 -1.13 0.11 119.26 123.78 3dr4 h ALA 237 Ca 0.21 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 3dr4 h ALA 237 Cb 0.27 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 3dr4 h ALA 237 CO -0.01 0.58 0.20 0.00 0.00 0.00 0.00 179.25 180.02 3dr4 h ALA 238 N 1.27 0.71 -0.44 0.00 0.00 -0.16 0.30 119.26 120.96 3dr4 h ALA 238 Ca 0.18 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 3dr4 h ALA 238 Cb 0.34 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3dr4 h ALA 238 CO 0.00 0.34 -0.25 0.82 0.00 0.00 0.00 179.25 180.17 3dr4 h ILE 239 N 0.75 1.27 -0.46 0.00 2.04 -1.06 -2.03 117.51 118.02 3dr4 h ILE 239 Ca 0.18 -1.41 -0.03 0.00 1.00 0.00 0.00 64.86 64.60 3dr4 h ILE 239 Cb 0.22 1.23 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 3dr4 h ILE 239 CO -0.01 0.48 0.17 1.23 0.00 0.00 0.00 178.15 180.01 3dr4 h GLY 240 N 0.77 0.76 0.78 5.37 0.00 -0.46 -0.66 103.07 109.63 3dr4 h GLY 240 Ca 0.09 -0.43 0.03 0.00 0.00 0.00 0.00 47.33 47.02 3dr4 h GLY 240 CO 0.07 0.41 0.07 -2.00 0.00 0.00 0.00 176.54 175.09 3dr4 h LEU 241 N 0.61 0.06 -1.51 3.11 5.85 -0.23 -0.81 115.31 122.40 3dr4 h LEU 241 Ca 0.15 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 3dr4 h LEU 241 Cb 0.23 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 3dr4 h LEU 241 CO -0.01 0.07 0.17 0.00 -0.34 0.00 0.00 178.44 178.33 3dr4 h ALA 242 N 1.16 1.62 -0.07 1.25 0.00 -1.25 -1.23 119.26 120.73 3dr4 h ALA 242 Ca 0.11 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3dr4 h ALA 242 Cb 0.08 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 3dr4 h ALA 242 CO -0.12 0.31 -0.12 1.96 0.00 0.00 0.00 179.25 181.28 3dr4 h GLN 243 N 0.50 0.20 0.00 0.00 1.08 -0.35 -3.04 115.11 113.50 3dr4 h GLN 243 Ca 0.13 -0.12 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 3dr4 h GLN 243 Cb 0.07 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.51 3dr4 h GLN 243 CO -0.02 0.70 -0.07 1.25 -0.95 0.00 0.00 178.83 179.74 3dr4 h LEU 244 N -0.27 0.00 -1.99 1.46 5.85 -1.01 -0.11 115.31 119.24 3dr4 h LEU 244 Ca 0.01 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.79 3dr4 h LEU 244 Cb 0.68 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 3dr4 h LEU 244 CO 0.03 0.07 0.16 -0.33 -0.34 0.00 0.00 178.44 178.02 3dr4 h GLU 245 N 0.00 0.01 -0.22 1.25 5.08 -1.10 -0.99 114.58 118.61 3dr4 h GLU 245 Ca -0.00 -0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.19 3dr4 h GLU 245 Cb 0.14 -0.00 -0.17 0.00 0.50 0.00 0.00 28.75 29.22 3dr4 h GLU 245 CO 0.01 0.01 -0.66 0.54 -1.00 0.00 0.00 179.01 177.90 3dr4 n ARG 246 N -4.47 1.98 -0.35 2.33 1.74 -0.12 -4.79 116.66 112.98 3dr4 n ARG 246 Ca 0.02 -3.42 0.02 0.00 -0.77 0.00 0.00 57.85 53.70 3dr4 n ARG 246 Cb 0.30 -1.64 0.17 0.00 -1.02 0.00 0.00 32.46 30.26 3dr4 n ARG 246 CO 0.00 0.00 0.00 -0.24 -1.52 0.00 0.00 177.63 175.87 3dr4 h VAL 247 N 2.07 1.07 -0.73 1.55 3.04 -0.50 0.84 116.25 123.60 3dr4 h VAL 247 Ca 0.07 -0.38 -0.05 0.00 -1.01 0.00 0.00 66.70 65.33 3dr4 h VAL 247 Cb 1.24 -0.14 -0.03 0.00 -2.01 0.00 0.00 31.29 30.35 3dr4 h VAL 247 CO 0.22 0.20 0.26 0.44 -1.01 0.00 0.00 177.57 177.68 3dr4 h ASP 248 N 1.11 1.03 0.22 3.17 3.32 -1.86 0.50 116.42 123.91 3dr4 h ASP 248 Ca 0.42 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.27 3dr4 h ASP 248 Cb 0.18 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.47 3dr4 h ASP 248 CO -0.18 0.94 -0.11 -0.33 -1.72 0.00 0.00 179.24 177.85 3dr4 h GLU 249 N 1.06 -0.29 -0.77 3.56 3.07 -1.84 0.71 114.58 120.07 3dr4 h GLU 249 Ca 0.24 0.02 0.02 0.00 -0.50 0.00 0.00 59.36 59.14 3dr4 h GLU 249 Cb 0.26 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.19 3dr4 h GLU 249 CO -0.01 -0.12 0.51 0.45 -1.40 0.00 0.00 179.01 178.44 3dr4 h HIS 250 N -0.39 0.94 -0.51 4.33 3.86 -0.39 -0.93 115.15 122.06 3dr4 h HIS 250 Ca -0.03 0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.10 3dr4 h HIS 250 Cb 0.30 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 28.44 3dr4 h HIS 250 CO -0.03 0.57 -0.07 -0.07 0.86 0.00 0.00 177.93 179.19 3dr4 h LEU 251 N 1.00 0.95 -0.34 2.43 3.38 0.88 -2.44 115.31 121.17 3dr4 h LEU 251 Ca 0.29 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.94 3dr4 h LEU 251 Cb -0.04 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 3dr4 h LEU 251 CO -0.07 1.06 0.20 0.00 0.09 0.00 0.00 178.44 179.72 3dr4 h ALA 252 N 0.92 0.43 -0.91 1.53 0.00 0.13 0.53 119.26 121.89 3dr4 h ALA 252 Ca 0.14 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.12 3dr4 h ALA 252 Cb 0.62 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.24 3dr4 h ALA 252 CO 0.04 -0.16 0.56 0.00 0.00 0.00 0.00 179.25 179.69 3dr4 h ALA 253 N 1.15 1.29 -0.27 0.00 0.00 -1.05 0.40 119.26 120.79 3dr4 h ALA 253 Ca 0.14 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.90 3dr4 h ALA 253 Cb 0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3dr4 h ALA 253 CO -0.07 0.25 -0.44 -0.09 0.00 0.00 0.00 179.25 178.90 3dr4 h ARG 254 N 0.97 0.68 -0.28 0.00 2.43 -0.88 -1.46 114.38 115.85 3dr4 h ARG 254 Ca 0.42 -0.38 -0.10 0.00 -0.81 0.00 0.00 59.98 59.11 3dr4 h ARG 254 Cb 0.29 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 3dr4 h ARG 254 CO -0.21 0.99 -0.26 1.49 -1.51 0.00 0.00 179.97 180.46 3dr4 h GLU 255 N 0.55 0.54 -0.10 0.20 4.81 0.32 -1.00 114.58 119.91 3dr4 h GLU 255 Ca 0.04 -0.21 0.04 0.00 -0.13 0.00 0.00 59.36 59.09 3dr4 h GLU 255 Cb 0.99 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.29 3dr4 h GLU 255 CO 0.09 0.76 -0.19 -0.09 -0.73 0.00 0.00 179.01 178.85 3dr4 h ARG 256 N 0.47 -0.24 -0.59 1.92 2.43 0.30 -2.11 114.38 116.56 3dr4 h ARG 256 Ca 0.07 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.31 3dr4 h ARG 256 Cb 0.71 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 30.26 3dr4 h ARG 256 CO 0.05 -0.16 0.31 0.28 -1.51 0.00 0.00 179.97 178.94 3dr4 h VAL 257 N -0.25 0.94 -0.82 0.20 2.07 -0.65 -2.40 116.25 115.34 3dr4 h VAL 257 Ca 0.09 -0.20 0.05 0.00 0.82 0.00 0.00 66.70 67.46 3dr4 h VAL 257 Cb 0.38 0.31 -0.05 0.00 -1.52 0.00 0.00 31.29 30.41 3dr4 h VAL 257 CO -0.25 0.11 0.54 0.58 0.02 0.00 0.00 177.57 178.57 3dr4 h VAL 258 N 0.58 1.10 0.10 2.57 2.07 -0.82 -1.82 116.25 120.02 3dr4 h VAL 258 Ca 0.27 -0.33 0.01 0.00 0.82 0.00 0.00 66.70 67.46 3dr4 h VAL 258 Cb 0.19 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 29.98 3dr4 h VAL 258 CO -0.19 0.18 -0.11 1.23 0.02 0.00 0.00 177.57 178.70 3dr4 h GLY 259 N 0.97 -0.22 0.30 2.17 0.00 -0.88 0.83 103.07 106.25 3dr4 h GLY 259 Ca 0.34 0.13 0.07 0.00 0.00 0.00 0.00 47.33 47.86 3dr4 h GLY 259 CO -0.11 -0.12 -0.11 1.49 0.00 0.00 0.00 176.54 177.69 3dr4 h TRP 260 N -0.24 -0.26 -0.40 5.60 6.55 -1.19 1.19 115.95 127.19 3dr4 h TRP 260 Ca 0.01 0.03 0.08 0.00 0.95 0.00 0.00 58.89 59.96 3dr4 h TRP 260 Cb 0.24 0.16 -0.07 0.00 -0.86 0.00 0.00 29.16 28.63 3dr4 h TRP 260 CO -0.13 -0.18 -0.03 1.88 -1.05 0.00 0.00 178.44 178.93 3dr4 h TYR 261 N -0.05 -0.08 -0.27 0.49 0.05 -0.56 0.15 116.97 116.69 3dr4 h TYR 261 Ca 0.16 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.97 3dr4 h TYR 261 Cb 0.29 0.10 -0.02 0.00 1.01 0.00 0.00 36.73 38.11 3dr4 h TYR 261 CO -0.32 -0.11 0.17 0.93 -1.05 0.00 0.00 178.16 177.78 3dr4 h GLU 262 N 0.07 0.34 0.00 4.88 5.08 0.20 -0.26 114.58 124.89 3dr4 h GLU 262 Ca 0.20 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.49 3dr4 h GLU 262 Cb 0.29 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3dr4 h GLU 262 CO -0.36 0.22 -0.21 1.96 -1.00 0.00 0.00 179.01 179.63 3dr4 h GLN 263 N 0.35 0.00 0.00 2.33 4.20 0.29 -3.32 115.11 118.96 3dr4 h GLN 263 Ca 0.10 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.81 3dr4 h GLN 263 Cb -0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 3dr4 h GLN 263 CO -0.03 0.21 -0.33 1.63 -0.67 0.00 0.00 178.83 179.63 3dr4 n LYS 264 N -4.03 4.87 0.25 1.46 5.02 0.36 -4.64 118.16 121.44 3dr4 n LYS 264 Ca -0.02 -0.00 0.10 0.00 -2.02 0.00 0.00 58.31 56.37 3dr4 n LYS 264 Cb 0.28 -0.77 0.63 0.00 -0.02 0.00 0.00 35.03 35.15 3dr4 n LYS 264 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 3dr4 h LEU 265 N 0.00 0.00 -1.37 -0.35 5.85 -1.15 -2.12 115.31 116.17 3dr4 h LEU 265 Ca 0.00 0.00 0.27 0.00 0.84 0.00 0.00 57.88 58.99 3dr4 h LEU 265 Cb 0.13 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 41.06 3dr4 h LEU 265 CO 0.00 0.17 0.67 0.00 -0.34 0.00 0.00 178.44 178.94 3dr4 h ALA 266 N 1.83 2.25 -0.11 1.25 0.00 -1.81 0.38 119.26 123.04 3dr4 h ALA 266 Ca -0.00 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.00 3dr4 h ALA 266 Cb 0.40 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 3dr4 h ALA 266 CO 0.02 -0.65 0.31 -0.09 0.00 0.00 0.00 179.25 178.84 3dr4 h ARG 267 N 0.39 0.00 -0.05 0.00 9.65 -1.72 0.40 114.38 123.04 3dr4 h ARG 267 Ca 0.59 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.47 3dr4 h ARG 267 Cb 1.52 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.10 3dr4 h ARG 267 CO -0.29 0.00 0.00 1.28 2.80 0.00 0.00 179.97 183.76 3dr4 n LEU 268 N -3.20 2.13 0.00 3.80 4.77 0.13 -5.02 117.00 119.61 3dr4 n LEU 268 Ca 0.00 -0.74 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 3dr4 n LEU 268 Cb 0.40 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 3dr4 n LEU 268 CO 0.19 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.23 3dr4 n GLY 269 N 1.25 2.82 0.07 -0.72 0.00 0.13 -1.92 105.19 106.81 3dr4 n GLY 269 Ca 0.17 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3dr4 n GLY 269 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dr4 n ASN 270 N 1.16 0.13 0.24 1.61 6.94 -1.26 -3.99 115.26 120.10 3dr4 n ASN 270 Ca 0.00 -2.00 0.13 0.00 -0.02 0.00 0.00 54.58 52.70 3dr4 n ASN 270 Cb 0.00 -0.07 0.49 0.00 -2.36 0.00 0.00 39.78 37.84 3dr4 n ASN 270 CO 0.00 0.00 0.00 0.03 -1.03 0.00 0.00 177.26 176.26 3dr4 h ARG 271 N 0.00 0.00 -4.13 -3.83 3.08 -1.78 -3.40 114.38 104.32 3dr4 h ARG 271 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 3dr4 h ARG 271 Cb 0.07 0.00 -0.15 0.00 0.08 0.00 0.00 29.97 29.96 3dr4 h ARG 271 CO 0.00 0.09 -0.63 0.14 -1.07 0.00 0.00 179.97 178.51 3dr4 s VAL 272 N -3.54 0.20 -0.17 2.04 -7.23 -1.26 -0.06 120.40 110.38 3dr4 s VAL 272 Ca 0.02 -1.61 -0.02 0.00 -1.81 0.00 0.00 61.98 58.56 3dr4 s VAL 272 Cb 0.08 -1.37 -0.01 0.00 0.56 0.00 0.00 36.38 35.64 3dr4 s VAL 272 CO 0.60 -0.89 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.53 3dr4 s THR 273 N -3.67 3.33 0.53 5.32 2.01 0.24 -4.80 115.64 118.60 3dr4 s THR 273 Ca 0.04 -0.54 -0.18 0.00 0.31 0.00 0.00 61.69 61.32 3dr4 s THR 273 Cb 0.06 -2.46 -0.07 0.00 0.01 0.00 0.00 72.50 70.05 3dr4 s THR 273 CO -0.09 0.48 1.04 -1.59 -0.69 0.00 0.00 174.62 173.77 3dr4 s LYS 274 N 0.77 3.64 0.14 4.92 -2.85 -1.26 -1.48 119.74 123.61 3dr4 s LYS 274 Ca -0.03 1.26 -0.31 0.00 -1.00 0.00 0.00 55.97 55.89 3dr4 s LYS 274 Cb -0.15 -2.08 -0.10 0.00 -2.06 0.00 0.00 37.83 33.44 3dr4 s LYS 274 CO 0.02 -0.56 1.77 -1.25 0.10 0.00 0.00 175.35 175.43 3dr4 s PRO 275 N -3.63 4.15 0.14 1.78 0.04 -1.20 -4.88 135.00 131.40 3dr4 s PRO 275 Ca 0.65 2.55 -0.30 0.00 0.04 0.00 0.00 61.00 63.94 3dr4 s PRO 275 Cb -0.15 -3.47 -0.08 0.00 0.04 0.00 0.00 34.50 30.84 3dr4 s PRO 275 CO 0.27 -0.80 1.27 -1.58 0.04 0.00 0.00 177.00 176.20 3dr4 s HIS 276 N 2.33 3.35 -0.30 0.56 2.46 -1.25 -5.00 115.29 117.44 3dr4 s HIS 276 Ca 0.78 1.24 -0.09 0.00 0.47 0.00 0.00 55.06 57.46 3dr4 s HIS 276 Cb -0.46 -3.52 -0.01 0.00 -0.13 0.00 0.00 32.58 28.46 3dr4 s HIS 276 CO 0.35 -1.64 0.13 0.08 -2.47 0.00 0.00 174.74 171.19 3dr4 s VAL 277 N 0.54 4.45 0.42 0.89 1.01 -1.26 -4.74 120.40 121.71 3dr4 s VAL 277 Ca 0.58 -0.43 -0.24 0.00 0.00 0.00 0.00 61.98 61.89 3dr4 s VAL 277 Cb -0.34 -3.25 -0.08 0.00 0.00 0.00 0.00 36.38 32.71 3dr4 s VAL 277 CO 0.33 0.11 1.10 0.00 0.00 0.00 0.00 175.10 176.64 3dr4 s ALA 278 N 1.59 3.05 -0.14 5.51 0.00 -1.26 -4.90 121.76 125.61 3dr4 s ALA 278 Ca 0.04 0.80 0.01 0.00 0.00 0.00 0.00 51.96 52.81 3dr4 s ALA 278 Cb -0.17 -3.32 0.11 0.00 0.00 0.00 0.00 23.12 19.75 3dr4 s ALA 278 CO 0.05 -0.39 1.12 1.28 0.00 0.00 0.00 175.76 177.82 3dr4 n LEU 279 N -0.23 3.47 -0.47 0.00 4.77 -1.26 -4.26 117.00 119.03 3dr4 n LEU 279 Ca 0.06 -1.77 0.13 0.00 -0.03 0.00 0.00 56.01 54.40 3dr4 n LEU 279 Cb 0.49 -0.55 0.31 0.00 -2.33 0.00 0.00 43.42 41.34 3dr4 n LEU 279 CO 0.46 0.57 0.65 0.35 -1.33 0.00 0.00 177.39 178.09 3dr4 n THR 280 N 0.22 0.00 -2.11 -5.08 -2.24 -1.26 -5.00 114.28 98.82 3dr4 n THR 280 Ca 0.09 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 3dr4 n THR 280 Cb 0.67 0.75 0.00 0.00 -2.10 0.00 0.00 70.33 69.65 3dr4 n THR 280 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3dr4 n GLY 281 N 1.31 -1.13 3.69 3.38 0.00 -1.24 0.12 105.19 111.30 3dr4 n GLY 281 Ca 0.14 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.31 3dr4 n GLY 281 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dr4 s ARG 282 N -1.93 4.40 -0.33 1.61 3.52 -0.97 -4.81 118.95 120.45 3dr4 s ARG 282 Ca 0.00 1.53 -0.18 0.00 -0.13 0.00 0.00 55.73 56.95 3dr4 s ARG 282 Cb 0.00 -3.53 -0.01 0.00 -1.56 0.00 0.00 34.95 29.85 3dr4 s ARG 282 CO 0.00 -0.35 0.49 -1.58 -0.81 0.00 0.00 175.30 173.05 3dr4 s HIS 283 N 1.98 3.20 -1.79 5.12 5.65 -1.26 -2.07 115.29 126.12 3dr4 s HIS 283 Ca 0.52 0.25 0.29 0.00 0.25 0.00 0.00 55.06 56.37 3dr4 s HIS 283 Cb -0.22 -2.84 1.31 0.00 -1.18 0.00 0.00 32.58 29.65 3dr4 s HIS 283 CO 0.21 -0.47 1.90 1.33 -0.65 0.00 0.00 174.74 177.07 3dr4 n VAL 284 N 5.35 0.00 -3.61 0.89 0.24 -0.45 -4.97 118.33 115.77 3dr4 n VAL 284 Ca -0.05 -0.07 -0.28 0.00 -2.04 0.00 0.00 64.34 61.90 3dr4 n VAL 284 Cb 0.49 -0.10 0.04 0.00 -1.47 0.00 0.00 33.84 32.80 3dr4 n VAL 284 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 3dr4 n PHE 285 N -0.85 -2.04 -0.23 6.34 3.72 -1.21 -4.84 117.46 118.36 3dr4 n PHE 285 Ca 0.16 0.55 -0.00 0.00 -0.05 0.00 0.00 57.45 58.11 3dr4 n PHE 285 Cb 0.26 -3.48 0.22 0.00 -0.94 0.00 0.00 39.48 35.54 3dr4 n PHE 285 CO 0.00 0.00 0.00 2.35 -0.05 0.00 0.00 176.76 179.06 3dr4 h TRP 286 N -1.55 0.99 -3.94 1.38 7.01 -0.44 -3.42 115.95 115.98 3dr4 h TRP 286 Ca -0.61 0.01 -0.25 0.00 2.11 0.00 0.00 58.89 60.15 3dr4 h TRP 286 Cb 1.33 -0.33 -0.20 0.00 -2.10 0.00 0.00 29.16 27.87 3dr4 h TRP 286 CO 0.31 0.64 -0.72 -1.64 -2.79 0.00 0.00 178.44 174.25 3dr4 s MET 287 N -5.81 0.59 -0.34 2.65 -1.94 -1.18 -4.75 119.30 108.52 3dr4 s MET 287 Ca -0.11 -0.89 -0.11 0.00 -1.71 0.00 0.00 55.69 52.87 3dr4 s MET 287 Cb 0.17 -0.24 0.00 0.00 2.01 0.00 0.00 34.83 36.77 3dr4 s MET 287 CO 0.79 0.03 0.19 -0.47 -0.01 0.00 0.00 175.02 175.55 3dr4 s TYR 288 N -1.95 3.21 -0.16 -0.03 6.14 -1.24 -4.84 117.35 118.48 3dr4 s TYR 288 Ca -0.05 -0.59 0.00 0.00 0.64 0.00 0.00 57.07 57.07 3dr4 s TYR 288 Cb -0.06 -2.42 -0.00 0.00 0.42 0.00 0.00 41.96 39.90 3dr4 s TYR 288 CO -0.01 -0.49 -0.15 0.99 0.64 0.00 0.00 175.55 176.53 3dr4 s THR 289 N 1.63 2.69 0.24 4.34 2.01 -1.26 -0.33 115.64 124.95 3dr4 s THR 289 Ca 0.04 -0.76 0.09 0.00 0.31 0.00 0.00 61.69 61.37 3dr4 s THR 289 Cb -0.18 -2.14 -0.04 0.00 0.01 0.00 0.00 72.50 70.15 3dr4 s THR 289 CO 0.07 0.51 0.01 0.68 -0.69 0.00 0.00 174.62 175.20 3dr4 s VAL 290 N 0.83 3.56 -0.23 3.82 -7.23 -0.80 -3.22 120.40 117.13 3dr4 s VAL 290 Ca -0.05 -1.77 -0.05 0.00 -1.81 0.00 0.00 61.98 58.30 3dr4 s VAL 290 Cb -0.15 -2.87 -0.02 0.00 0.56 0.00 0.00 36.38 33.89 3dr4 s VAL 290 CO -0.00 -0.31 0.00 -0.13 -0.31 0.00 0.00 175.10 174.35 3dr4 s ARG 291 N -3.50 3.51 0.31 4.82 0.52 -0.55 -1.28 118.95 122.79 3dr4 s ARG 291 Ca 0.30 -0.56 -0.28 0.00 -0.52 0.00 0.00 55.73 54.68 3dr4 s ARG 291 Cb -0.07 -3.13 -0.09 0.00 0.52 0.00 0.00 34.95 32.17 3dr4 s ARG 291 CO 0.20 -0.16 1.10 -0.51 0.02 0.00 0.00 175.30 175.94 3dr4 s LEU 292 N 1.45 4.44 0.52 2.53 1.43 -0.26 0.81 118.68 129.61 3dr4 s LEU 292 Ca 0.05 2.24 -0.23 0.00 -1.03 0.00 0.00 54.13 55.16 3dr4 s LEU 292 Cb -0.15 -3.77 -0.06 0.00 0.03 0.00 0.00 46.19 42.25 3dr4 s LEU 292 CO 0.00 -0.26 1.37 0.61 0.23 0.00 0.00 176.35 178.30 3dr4 n GLY 293 N 0.98 0.81 0.16 -3.19 0.00 0.91 -4.86 105.19 99.99 3dr4 n GLY 293 Ca 0.00 0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.21 3dr4 n GLY 293 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3dr4 h GLU 294 N 1.62 0.00 -0.06 1.61 3.07 -1.89 -3.00 114.58 115.92 3dr4 h GLU 294 Ca -0.51 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 58.25 3dr4 h GLU 294 Cb 1.30 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.19 3dr4 h GLU 294 CO 0.58 0.00 -0.45 0.78 -1.40 0.00 0.00 179.01 178.52 3dr4 h GLY 295 N 2.39 0.16 -2.76 -3.84 0.00 -1.92 -3.46 103.07 93.64 3dr4 h GLY 295 Ca 0.00 -0.16 -0.56 0.00 0.00 0.00 0.00 47.33 46.61 3dr4 h GLY 295 CO 0.00 0.14 -0.64 1.04 0.00 0.00 0.00 176.54 177.09 3dr4 n LEU 296 N -3.99 -0.43 0.01 3.11 4.77 -1.14 -4.90 117.00 114.42 3dr4 n LEU 296 Ca -0.02 0.54 -0.00 0.00 -0.03 0.00 0.00 56.01 56.50 3dr4 n LEU 296 Cb 0.50 -1.13 -0.10 0.00 -2.33 0.00 0.00 43.42 40.35 3dr4 n LEU 296 CO 0.41 -3.63 -0.48 -1.20 -1.33 0.00 0.00 177.39 171.17 3dr4 n SER 297 N 0.32 0.63 -4.29 -1.43 7.64 0.11 -4.92 113.62 111.68 3dr4 n SER 297 Ca 0.08 0.28 -0.29 0.00 1.01 0.00 0.00 58.87 59.94 3dr4 n SER 297 Cb 0.50 0.51 0.19 0.00 -1.01 0.00 0.00 64.21 64.40 3dr4 n SER 297 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3dr4 s THR 298 N -2.93 1.86 0.30 0.44 -1.32 -1.26 -5.05 115.64 107.68 3dr4 s THR 298 Ca -0.05 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.53 3dr4 s THR 298 Cb 0.09 -2.71 -0.05 0.00 -1.51 0.00 0.00 72.50 68.32 3dr4 s THR 298 CO 0.83 0.00 -0.04 0.42 -2.21 0.00 0.00 174.62 173.62 3dr4 s THR 299 N -3.32 2.91 0.29 5.08 -4.23 -1.26 -5.00 115.64 110.10 3dr4 s THR 299 Ca 0.69 -2.04 -0.02 0.00 -1.18 0.00 0.00 61.69 59.13 3dr4 s THR 299 Cb -0.10 -2.71 0.26 0.00 1.34 0.00 0.00 72.50 71.29 3dr4 s THR 299 CO 0.54 -0.31 1.95 -0.09 -0.54 0.00 0.00 174.62 176.17 3dr4 h ARG 300 N 1.93 1.13 -0.40 3.99 1.12 -1.95 -1.38 114.38 118.83 3dr4 h ARG 300 Ca -0.43 -0.07 -0.11 0.00 -1.11 0.00 0.00 59.98 58.27 3dr4 h ARG 300 Cb 1.25 -0.26 -0.02 0.00 -0.01 0.00 0.00 29.97 30.94 3dr4 h ARG 300 CO 0.63 0.75 -0.18 -0.44 -3.11 0.00 0.00 179.97 177.61 3dr4 h ASP 301 N 1.16 0.76 -0.34 -3.80 3.32 -1.95 -1.80 116.42 113.77 3dr4 h ASP 301 Ca 0.34 -0.25 -0.09 0.00 0.02 0.00 0.00 57.03 57.04 3dr4 h ASP 301 Cb -0.08 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 3dr4 h ASP 301 CO -0.08 0.94 -0.13 -0.61 -1.72 0.00 0.00 179.24 177.63 3dr4 h GLN 302 N 0.67 0.69 -0.95 3.56 5.75 -1.82 -1.49 115.11 121.52 3dr4 h GLN 302 Ca 0.10 -0.29 0.11 0.00 -0.15 0.00 0.00 58.65 58.43 3dr4 h GLN 302 Cb 0.67 -0.03 -0.07 0.00 1.07 0.00 0.00 27.48 29.12 3dr4 h GLN 302 CO 0.05 0.88 0.60 0.28 -2.65 0.00 0.00 178.83 177.99 3dr4 h VAL 303 N 0.47 0.94 -0.58 2.39 2.07 -1.06 0.65 116.25 121.13 3dr4 h VAL 303 Ca 0.08 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 3dr4 h VAL 303 Cb 0.65 -0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.33 3dr4 h VAL 303 CO 0.04 0.17 0.24 0.40 0.02 0.00 0.00 177.57 178.44 3dr4 h ILE 304 N 0.92 1.22 0.07 4.57 2.04 -0.83 0.17 117.51 125.67 3dr4 h ILE 304 Ca 0.45 -0.69 -0.00 0.00 1.00 0.00 0.00 64.86 65.62 3dr4 h ILE 304 Cb 0.47 0.59 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 3dr4 h ILE 304 CO -0.22 0.27 -0.03 0.11 0.00 0.00 0.00 178.15 178.28 3dr4 h LYS 305 N 0.80 -0.08 -0.97 2.37 1.57 -0.03 -1.95 116.57 118.27 3dr4 h LYS 305 Ca 0.19 0.01 0.03 0.00 -1.87 0.00 0.00 60.65 59.01 3dr4 h LYS 305 Cb 0.19 0.02 -0.06 0.00 0.08 0.00 0.00 32.23 32.46 3dr4 h LYS 305 CO -0.02 0.08 0.63 -0.44 -0.57 0.00 0.00 179.45 179.14 3dr4 h ASP 306 N -0.24 1.06 0.17 0.86 3.32 0.44 0.56 116.42 122.60 3dr4 h ASP 306 Ca -0.01 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.92 3dr4 h ASP 306 Cb 0.21 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 3dr4 h ASP 306 CO 0.01 0.73 -0.39 -0.07 -1.72 0.00 0.00 179.24 177.81 3dr4 h LEU 307 N 1.24 0.31 -0.19 1.55 3.38 -0.59 -1.99 115.31 119.01 3dr4 h LEU 307 Ca 0.38 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 3dr4 h LEU 307 Cb -0.02 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3dr4 h LEU 307 CO -0.12 0.67 -0.09 -0.78 0.09 0.00 0.00 178.44 178.22 3dr4 h ASP 308 N 0.25 0.41 -0.27 -0.43 3.58 -0.53 0.62 116.42 120.05 3dr4 h ASP 308 Ca 0.03 -0.40 0.08 0.00 0.42 0.00 0.00 57.03 57.15 3dr4 h ASP 308 Cb 0.80 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.72 3dr4 h ASP 308 CO 0.06 0.72 0.24 0.00 -2.88 0.00 0.00 179.24 177.38 3dr4 h ALA 309 N 0.70 2.04 -0.37 -0.78 0.00 -0.78 0.70 119.26 120.76 3dr4 h ALA 309 Ca 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3dr4 h ALA 309 Cb 0.56 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3dr4 h ALA 309 CO 0.03 -0.37 0.00 1.28 0.00 0.00 0.00 179.25 180.18 3dr4 n LEU 310 N -4.06 2.54 -0.31 0.00 4.77 -0.66 -4.89 117.00 114.39 3dr4 n LEU 310 Ca 0.04 -1.28 -0.03 0.00 -0.03 0.00 0.00 56.01 54.70 3dr4 n LEU 310 Cb 0.39 -0.36 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 3dr4 n LEU 310 CO 0.31 0.51 -0.04 0.61 -1.33 0.00 0.00 177.39 177.45 3dr4 n GLY 311 N 0.90 0.47 3.11 -0.72 0.00 0.24 -4.98 105.19 104.21 3dr4 n GLY 311 Ca 0.14 -0.85 -0.33 0.00 0.00 0.00 0.00 46.02 44.98 3dr4 n GLY 311 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dr4 s ILE 312 N -2.14 2.17 0.12 -0.61 1.01 0.21 -0.80 121.20 121.16 3dr4 s ILE 312 Ca 0.00 -1.22 -0.28 0.00 0.00 0.00 0.00 60.65 59.15 3dr4 s ILE 312 Cb 0.00 -2.08 -0.06 0.00 0.01 0.00 0.00 42.46 40.33 3dr4 s ILE 312 CO 0.00 0.29 0.89 -1.61 0.00 0.00 0.00 174.94 174.51 3dr4 s GLU 313 N 1.22 4.66 0.16 2.79 2.02 0.15 -2.25 118.70 127.45 3dr4 s GLU 313 Ca -0.01 1.33 -0.11 0.00 0.02 0.00 0.00 54.97 56.20 3dr4 s GLU 313 Cb -0.16 -3.35 0.00 0.00 0.10 0.00 0.00 34.13 30.73 3dr4 s GLU 313 CO -0.09 0.31 0.34 -1.54 0.02 0.00 0.00 175.26 174.29 3dr4 s SER 314 N -0.29 -0.04 0.03 -0.19 1.04 -1.26 -3.92 113.70 109.07 3dr4 s SER 314 Ca 0.43 -0.70 0.03 0.00 0.48 0.00 0.00 55.95 56.18 3dr4 s SER 314 Cb -0.23 0.46 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 3dr4 s SER 314 CO 0.28 -0.90 -0.09 -0.13 0.98 0.00 0.00 173.24 173.38 3dr4 s ARG 315 N -3.92 0.59 0.42 4.02 1.81 -1.12 -4.99 118.95 115.77 3dr4 s ARG 315 Ca 0.12 -0.63 -0.23 0.00 -1.72 0.00 0.00 55.73 53.27 3dr4 s ARG 315 Cb 0.02 -0.47 -0.09 0.00 -0.45 0.00 0.00 34.95 33.97 3dr4 s ARG 315 CO -0.03 0.11 1.06 -1.25 -0.68 0.00 0.00 175.30 174.51 3dr4 s PRO 316 N -1.14 4.06 0.50 3.54 0.04 -1.26 0.64 135.00 141.37 3dr4 s PRO 316 Ca -0.04 1.52 -0.23 0.00 0.04 0.00 0.00 61.00 62.29 3dr4 s PRO 316 Cb -0.08 -2.45 -0.06 0.00 0.04 0.00 0.00 34.50 31.95 3dr4 s PRO 316 CO 0.01 -0.24 1.30 0.08 0.04 0.00 0.00 177.00 178.19 3dr4 s VAL 317 N -1.70 2.43 0.47 -0.36 1.01 -0.63 -4.77 120.40 116.86 3dr4 s VAL 317 Ca 0.60 0.33 -0.20 0.00 0.00 0.00 0.00 61.98 62.71 3dr4 s VAL 317 Cb -0.22 -3.17 -0.12 0.00 0.00 0.00 0.00 36.38 32.87 3dr4 s VAL 317 CO 0.27 0.00 0.37 0.49 0.00 0.00 0.00 175.10 176.24 3dr4 n PHE 318 N -0.72 -1.14 -2.59 5.22 3.72 -1.26 -4.75 117.46 115.94 3dr4 n PHE 318 Ca 0.09 0.53 -0.42 0.00 -0.05 0.00 0.00 57.45 57.60 3dr4 n PHE 318 Cb 0.46 -1.90 -0.03 0.00 -0.94 0.00 0.00 39.48 37.06 3dr4 n PHE 318 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 3dr4 s HIS 319 N -1.66 3.42 0.58 1.38 3.76 -1.26 -4.24 115.29 117.28 3dr4 s HIS 319 Ca 0.63 1.46 -0.19 0.00 -0.15 0.00 0.00 55.06 56.81 3dr4 s HIS 319 Cb -0.54 -3.28 -0.05 0.00 1.11 0.00 0.00 32.58 29.81 3dr4 s HIS 319 CO 0.59 -0.65 0.97 -2.30 -0.85 0.00 0.00 174.74 172.49 3dr4 n PRO 320 N 4.84 0.95 -0.14 8.40 -0.02 -1.26 -4.79 135.00 142.97 3dr4 n PRO 320 Ca 0.09 0.36 -0.03 0.00 -2.02 0.00 0.00 63.50 61.90 3dr4 n PRO 320 Cb 0.48 -2.15 0.05 0.00 -0.02 0.00 0.00 33.50 31.85 3dr4 n PRO 320 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 3dr4 h MET 321 N 0.60 0.11 0.00 -0.52 2.86 -1.04 -2.40 114.93 114.53 3dr4 h MET 321 Ca -0.48 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.15 3dr4 h MET 321 Cb 1.36 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 33.00 3dr4 h MET 321 CO 0.51 0.07 0.00 -2.39 1.06 0.00 0.00 176.91 176.17 3dr4 n HIS 322 N -5.22 0.00 0.72 -0.22 1.44 -1.26 -1.52 115.22 109.16 3dr4 n HIS 322 Ca 0.04 0.00 0.09 0.00 -2.01 0.00 0.00 57.72 55.84 3dr4 n HIS 322 Cb 0.24 -0.18 -0.12 0.00 0.12 0.00 0.00 29.99 30.05 3dr4 n HIS 322 CO 0.00 0.00 0.00 0.44 -2.81 0.00 0.00 176.34 173.97 3dr4 n ILE 323 N -1.18 0.00 -3.74 0.61 -5.35 -0.90 -4.06 119.36 104.74 3dr4 n ILE 323 Ca 0.05 -0.13 -0.31 0.00 -0.27 0.00 0.00 62.75 62.10 3dr4 n ILE 323 Cb 0.06 0.82 -0.04 0.00 -1.74 0.00 0.00 39.64 38.73 3dr4 n ILE 323 CO 0.00 0.00 0.00 -0.04 -1.76 0.00 0.00 176.55 174.75 3dr4 s MET 324 N -2.90 3.56 0.30 6.28 -1.94 -0.58 -4.90 119.30 119.12 3dr4 s MET 324 Ca 0.04 -0.22 0.03 0.00 -1.71 0.00 0.00 55.69 53.83 3dr4 s MET 324 Cb 0.14 -2.89 0.76 0.00 2.01 0.00 0.00 34.83 34.84 3dr4 s MET 324 CO 0.78 0.49 1.61 -1.35 -0.01 0.00 0.00 175.02 176.54 3dr4 h PRO 325 N 2.76 0.09 0.00 2.03 0.11 -1.93 -0.71 132.00 134.35 3dr4 h PRO 325 Ca -0.46 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 3dr4 h PRO 325 Cb 1.17 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 3dr4 h PRO 325 CO 0.73 0.06 -0.12 -1.35 -0.21 0.00 0.00 178.00 177.11 3dr4 h PRO 326 N 0.09 0.00 0.00 1.05 0.11 -1.95 -3.28 132.00 128.02 3dr4 h PRO 326 Ca 0.58 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.69 3dr4 h PRO 326 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 3dr4 h PRO 326 CO -0.78 0.12 -0.09 0.66 -0.21 0.00 0.00 178.00 177.70 3dr4 n TYR 327 N -3.44 0.00 0.27 0.65 4.01 -0.75 -4.70 117.16 113.21 3dr4 n TYR 327 Ca -0.01 -0.39 0.11 0.00 -0.16 0.00 0.00 57.90 57.45 3dr4 n TYR 327 Cb 0.28 -0.06 0.76 0.00 -0.31 0.00 0.00 39.34 40.01 3dr4 n TYR 327 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3dr4 h ALA 328 N 0.00 1.75 0.00 -0.72 0.00 -1.22 0.04 119.26 119.11 3dr4 h ALA 328 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dr4 h ALA 328 Cb 0.90 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3dr4 h ALA 328 CO 0.00 0.02 0.00 -2.39 0.00 0.00 0.00 179.25 176.88 3dr4 n HIS 329 N -4.19 0.00 0.38 0.00 1.44 -1.26 -2.02 115.22 109.58 3dr4 n HIS 329 Ca -0.03 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.79 3dr4 n HIS 329 Cb 0.10 -0.32 0.17 0.00 0.12 0.00 0.00 29.99 30.06 3dr4 n HIS 329 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 3dr4 n LEU 330 N -1.32 3.14 -4.76 2.39 4.77 0.00 -5.01 117.00 116.22 3dr4 n LEU 330 Ca 0.06 -1.41 -0.38 0.00 -0.03 0.00 0.00 56.01 54.25 3dr4 n LEU 330 Cb 0.11 -0.18 0.02 0.00 -2.33 0.00 0.00 43.42 41.04 3dr4 n LEU 330 CO 0.10 0.66 0.91 0.00 -1.33 0.00 0.00 177.39 177.73 3dr4 s ALA 331 N -1.44 2.85 0.23 -1.18 0.00 -0.85 -4.74 121.76 116.63 3dr4 s ALA 331 Ca 0.32 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.43 3dr4 s ALA 331 Cb 0.20 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.78 3dr4 s ALA 331 CO 0.28 -1.08 0.12 0.95 0.00 0.00 0.00 175.76 176.03 3dr4 s THR 332 N -1.42 0.23 -2.16 0.00 -4.23 -1.26 -5.04 115.64 101.76 3dr4 s THR 332 Ca 0.69 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 59.40 3dr4 s THR 332 Cb -0.35 -2.55 0.48 0.00 1.34 0.00 0.00 72.50 71.42 3dr4 s THR 332 CO 0.41 0.00 1.61 -0.90 -0.54 0.00 0.00 174.62 175.20 3dr4 n ASP 333 N -0.41 0.97 -1.93 3.99 5.68 -1.26 -3.92 116.55 119.67 3dr4 n ASP 333 Ca 0.01 -1.59 -0.23 0.00 -0.50 0.00 0.00 54.79 52.48 3dr4 n ASP 333 Cb 0.66 -0.06 0.05 0.00 -1.14 0.00 0.00 41.12 40.63 3dr4 n ASP 333 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 3dr4 n ASP 334 N -0.14 4.98 -0.95 -1.12 2.03 -1.26 -4.63 116.55 115.46 3dr4 n ASP 334 Ca 0.15 -3.77 0.03 0.00 0.52 0.00 0.00 54.79 51.72 3dr4 n ASP 334 Cb 0.22 -0.45 0.15 0.00 -0.72 0.00 0.00 41.12 40.32 3dr4 n ASP 334 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3dr4 n LEU 335 N -0.78 2.59 -0.11 -2.67 4.77 -1.25 -4.24 117.00 115.31 3dr4 n LEU 335 Ca 0.44 -3.63 -0.11 0.00 -0.03 0.00 0.00 56.01 52.69 3dr4 n LEU 335 Cb 0.91 -0.39 0.03 0.00 -2.33 0.00 0.00 43.42 41.64 3dr4 n LEU 335 CO 0.42 1.31 0.63 0.11 -1.33 0.00 0.00 177.39 178.52 3dr4 h LYS 336 N 1.15 0.87 -0.37 3.23 1.57 -1.90 -2.13 116.57 118.99 3dr4 h LYS 336 Ca -0.01 -0.41 -0.12 0.00 -1.87 0.00 0.00 60.65 58.25 3dr4 h LYS 336 Cb 1.22 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.50 3dr4 h LYS 336 CO 0.09 1.05 -0.24 0.82 -0.57 0.00 0.00 179.45 180.60 3dr4 h ILE 337 N 0.74 1.27 -0.60 1.86 1.08 -1.89 -1.57 117.51 118.40 3dr4 h ILE 337 Ca 0.08 -1.36 0.01 0.00 -0.39 0.00 0.00 64.86 63.21 3dr4 h ILE 337 Cb 0.86 1.25 -0.03 0.00 -3.07 0.00 0.00 36.82 35.82 3dr4 h ILE 337 CO 0.08 0.45 0.39 0.00 -0.69 0.00 0.00 178.15 178.37 3dr4 h ALA 338 N 1.07 0.76 -0.54 1.87 0.00 -1.80 -0.64 119.26 119.99 3dr4 h ALA 338 Ca 0.09 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3dr4 h ALA 338 Cb 0.75 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.30 3dr4 h ALA 338 CO 0.06 0.16 0.22 0.93 0.00 0.00 0.00 179.25 180.62 3dr4 h GLU 339 N 0.78 0.80 -0.87 0.00 5.08 -1.13 0.34 114.58 119.59 3dr4 h GLU 339 Ca 0.23 -0.14 0.02 0.00 -1.00 0.00 0.00 59.36 58.47 3dr4 h GLU 339 Cb -0.05 -0.13 -0.05 0.00 0.50 0.00 0.00 28.75 29.02 3dr4 h GLU 339 CO -0.07 0.70 0.57 0.00 -1.00 0.00 0.00 179.01 179.22 3dr4 h ALA 340 N 1.06 1.43 -0.29 3.43 0.00 -0.75 -1.25 119.26 122.89 3dr4 h ALA 340 Ca 0.18 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.86 3dr4 h ALA 340 Cb 0.19 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 3dr4 h ALA 340 CO -0.02 0.50 -0.51 0.00 0.00 0.00 0.00 179.25 179.22 3dr4 h GLY 342 N 0.77 0.00 0.68 0.00 0.00 -0.10 -0.87 103.07 103.55 3dr4 h GLY 342 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.23 3dr4 h GLY 342 CO 0.11 0.00 -0.49 -2.08 0.00 0.00 0.00 176.54 174.08 3dr4 h VAL 343 N 0.00 1.46 -0.02 4.60 2.07 -1.11 -3.40 116.25 119.85 3dr4 h VAL 343 Ca -0.00 -2.03 0.00 0.00 0.82 0.00 0.00 66.70 65.48 3dr4 h VAL 343 Cb 0.66 2.64 0.00 0.00 -1.52 0.00 0.00 31.29 33.07 3dr4 h VAL 343 CO 0.05 0.58 -0.06 -0.90 0.02 0.00 0.00 177.57 177.26 3dr4 n ASP 344 N -4.31 2.26 -4.83 0.57 5.68 -0.81 -4.46 116.55 110.65 3dr4 n ASP 344 Ca -0.10 -1.63 -0.34 0.00 -0.50 0.00 0.00 54.79 52.22 3dr4 n ASP 344 Cb 0.62 0.09 -0.06 0.00 -1.14 0.00 0.00 41.12 40.63 3dr4 n ASP 344 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 3dr4 s GLY 345 N -1.50 2.44 -0.11 6.12 0.00 -0.34 -1.10 107.32 112.84 3dr4 s GLY 345 Ca 0.18 0.11 -0.05 0.00 0.00 0.00 0.00 44.72 44.97 3dr4 s GLY 345 CO 0.25 0.38 0.23 -2.27 0.00 0.00 0.00 173.10 171.69 3dr4 s LEU 346 N -2.62 0.18 0.06 0.66 2.96 -0.41 -1.60 118.68 117.91 3dr4 s LEU 346 Ca 0.51 0.51 -0.24 0.00 -0.22 0.00 0.00 54.13 54.68 3dr4 s LEU 346 Cb -0.13 0.65 -0.06 0.00 0.50 0.00 0.00 46.19 47.15 3dr4 s LEU 346 CO 0.19 -0.19 0.72 0.20 -1.32 0.00 0.00 176.35 175.94 3dr4 s ASN 347 N 1.70 7.18 0.16 3.68 0.01 0.21 -1.91 114.94 125.97 3dr4 s ASN 347 Ca -0.05 1.41 0.05 0.00 -0.71 0.00 0.00 52.86 53.56 3dr4 s ASN 347 Cb -0.11 -2.44 -0.04 0.00 0.41 0.00 0.00 41.25 39.07 3dr4 s ASN 347 CO -0.08 0.09 0.16 -0.76 -1.51 0.00 0.00 177.10 174.99 3dr4 s LEU 348 N -0.35 3.89 -0.09 0.60 1.43 0.55 -2.77 118.68 121.93 3dr4 s LEU 348 Ca 0.36 -0.08 -0.39 0.00 -1.03 0.00 0.00 54.13 52.99 3dr4 s LEU 348 Cb -0.20 -2.49 -0.16 0.00 0.03 0.00 0.00 46.19 43.36 3dr4 s LEU 348 CO 0.22 0.07 1.53 -2.65 0.23 0.00 0.00 176.35 175.75 3dr4 n PRO 349 N -0.36 1.11 -3.47 1.29 -0.02 -1.26 -3.71 135.00 128.58 3dr4 n PRO 349 Ca -0.08 0.40 -0.21 0.00 -2.02 0.00 0.00 63.50 61.59 3dr4 n PRO 349 Cb 0.54 -2.06 -0.12 0.00 -0.02 0.00 0.00 33.50 31.84 3dr4 n PRO 349 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3dr4 s THR 350 N 1.94 -0.28 0.01 3.45 2.01 -0.60 -4.82 115.64 117.35 3dr4 s THR 350 Ca 0.91 -0.44 -0.28 0.00 0.31 0.00 0.00 61.69 62.20 3dr4 s THR 350 Cb -1.02 -0.88 0.09 0.00 0.01 0.00 0.00 72.50 70.69 3dr4 s THR 350 CO 0.56 -0.45 0.75 -1.38 -0.69 0.00 0.00 174.62 173.41 3dr4 s HIS 351 N 2.27 -0.51 -0.58 4.92 -3.43 -1.26 -4.62 115.29 112.08 3dr4 s HIS 351 Ca 0.08 0.60 0.08 0.00 -0.80 0.00 0.00 55.06 55.03 3dr4 s HIS 351 Cb -0.15 0.49 0.44 0.00 -1.43 0.00 0.00 32.58 31.93 3dr4 s HIS 351 CO -0.27 -0.63 1.21 0.00 -2.00 0.00 0.00 174.74 173.05 3dr4 n ALA 352 N 0.23 0.91 1.04 -1.38 0.00 -1.26 -1.43 120.51 118.62 3dr4 n ALA 352 Ca -0.15 0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.48 3dr4 n ALA 352 Cb 0.61 -1.02 0.07 0.00 0.00 0.00 0.00 19.45 19.11 3dr4 n ALA 352 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dr4 n GLY 353 N -1.38 -0.79 3.79 0.00 0.00 -1.26 -4.93 105.19 100.61 3dr4 n GLY 353 Ca -0.01 -0.52 -0.36 0.00 0.00 0.00 0.00 46.02 45.14 3dr4 n GLY 353 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dr4 s LEU 354 N -2.82 4.13 0.33 0.99 1.43 -0.51 -5.04 118.68 117.19 3dr4 s LEU 354 Ca 0.13 1.97 0.09 0.00 -1.03 0.00 0.00 54.13 55.29 3dr4 s LEU 354 Cb 0.17 -4.21 -0.04 0.00 0.03 0.00 0.00 46.19 42.13 3dr4 s LEU 354 CO 0.71 -0.43 0.10 0.42 0.23 0.00 0.00 176.35 177.38 3dr4 s THR 355 N -1.72 3.02 0.23 5.49 -4.23 -1.26 -4.91 115.64 112.26 3dr4 s THR 355 Ca 0.58 -1.78 -0.06 0.00 -1.18 0.00 0.00 61.69 59.24 3dr4 s THR 355 Cb -0.20 -2.93 0.21 0.00 1.34 0.00 0.00 72.50 70.92 3dr4 s THR 355 CO 0.25 -0.21 1.70 -0.08 -0.54 0.00 0.00 174.62 175.73 3dr4 h GLU 356 N 1.65 0.28 -0.33 3.99 4.81 -1.99 0.52 114.58 123.50 3dr4 h GLU 356 Ca -0.44 -0.02 0.06 0.00 -0.13 0.00 0.00 59.36 58.83 3dr4 h GLU 356 Cb 1.25 -0.06 -0.05 0.00 0.63 0.00 0.00 28.75 30.52 3dr4 h GLU 356 CO 0.64 0.19 0.02 0.00 -0.73 0.00 0.00 179.01 179.12 3dr4 h ALA 357 N 1.56 0.31 -0.58 2.92 0.00 -1.99 0.25 119.26 121.73 3dr4 h ALA 357 Ca 0.38 0.09 0.11 0.00 0.00 0.00 0.00 54.91 55.49 3dr4 h ALA 357 Cb 0.62 0.14 -0.11 0.00 0.00 0.00 0.00 17.79 18.43 3dr4 h ALA 357 CO -0.46 -0.39 -0.22 -0.44 0.00 0.00 0.00 179.25 177.74 3dr4 h ASP 358 N 0.12 -0.77 -0.41 0.00 3.32 -0.59 0.28 116.42 118.36 3dr4 h ASP 358 Ca 0.16 0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.38 3dr4 h ASP 358 Cb 0.21 0.44 -0.02 0.00 0.22 0.00 0.00 39.33 40.18 3dr4 h ASP 358 CO -0.25 -0.24 0.17 0.40 -1.72 0.00 0.00 179.24 177.59 3dr4 h ILE 359 N -0.07 1.19 -0.78 0.35 1.08 0.15 -0.19 117.51 119.23 3dr4 h ILE 359 Ca 0.27 -0.59 0.13 0.00 -0.39 0.00 0.00 64.86 64.27 3dr4 h ILE 359 Cb 0.49 0.81 -0.09 0.00 -3.07 0.00 0.00 36.82 34.97 3dr4 h ILE 359 CO -0.64 0.22 0.38 0.44 -0.69 0.00 0.00 178.15 177.86 3dr4 h ASP 360 N 0.52 0.45 -0.19 1.72 3.32 0.76 0.20 116.42 123.20 3dr4 h ASP 360 Ca 0.14 0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.28 3dr4 h ASP 360 Cb 0.18 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.73 3dr4 h ASP 360 CO -0.01 0.21 0.11 -0.09 -1.72 0.00 0.00 179.24 177.74 3dr4 h ARG 361 N 0.58 0.22 -0.72 3.56 2.43 0.41 0.37 114.38 121.23 3dr4 h ARG 361 Ca 0.41 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.52 3dr4 h ARG 361 Cb 0.55 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.02 3dr4 h ARG 361 CO -0.34 0.15 0.24 0.28 -1.51 0.00 0.00 179.97 178.79 3dr4 h VAL 362 N 0.23 1.25 -0.30 0.20 2.07 0.49 0.16 116.25 120.36 3dr4 h VAL 362 Ca 0.07 -0.87 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 3dr4 h VAL 362 Cb -0.01 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 3dr4 h VAL 362 CO -0.03 0.34 0.11 0.40 0.02 0.00 0.00 177.57 178.41 3dr4 h ILE 363 N 1.07 1.19 -0.73 4.57 1.08 -0.27 0.33 117.51 124.74 3dr4 h ILE 363 Ca 0.24 -0.60 0.00 0.00 -0.39 0.00 0.00 64.86 64.11 3dr4 h ILE 363 Cb 0.28 1.02 -0.04 0.00 -3.07 0.00 0.00 36.82 35.01 3dr4 h ILE 363 CO -0.01 0.20 0.46 0.00 -0.69 0.00 0.00 178.15 178.11 3dr4 h ALA 364 N 0.95 1.43 -0.29 1.87 0.00 0.11 0.22 119.26 123.54 3dr4 h ALA 364 Ca 0.10 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 3dr4 h ALA 364 Cb 0.21 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3dr4 h ALA 364 CO -0.01 0.51 0.07 0.00 0.00 0.00 0.00 179.25 179.82 3dr4 h ALA 365 N 1.51 0.39 -0.67 0.00 0.00 0.03 -2.00 119.26 118.51 3dr4 h ALA 365 Ca 0.27 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3dr4 h ALA 365 Cb -0.07 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3dr4 h ALA 365 CO -0.05 0.04 0.26 -0.07 0.00 0.00 0.00 179.25 179.43 3dr4 h LEU 366 N 0.31 0.94 -0.74 0.00 3.38 0.26 0.68 115.31 120.13 3dr4 h LEU 366 Ca 0.09 -0.18 0.12 0.00 0.09 0.00 0.00 57.88 58.00 3dr4 h LEU 366 Cb 0.28 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 3dr4 h LEU 366 CO 0.00 0.86 0.34 -0.78 0.09 0.00 0.00 178.44 178.96 3dr4 h ASP 367 N 0.96 0.40 -0.00 -0.43 3.58 -0.42 0.16 116.42 120.67 3dr4 h ASP 367 Ca 0.22 0.08 -0.00 0.00 0.42 0.00 0.00 57.03 57.75 3dr4 h ASP 367 Cb 0.23 0.02 -0.00 0.00 1.72 0.00 0.00 39.33 41.30 3dr4 h ASP 367 CO -0.02 0.20 0.00 -0.61 -2.88 0.00 0.00 179.24 175.93 3dr4 h GLN 368 N 0.54 0.00 0.00 0.28 4.15 -0.58 -3.30 115.11 116.21 3dr4 h GLN 368 Ca 0.39 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.81 3dr4 h GLN 368 Cb 0.50 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.19 3dr4 h GLN 368 CO -0.33 0.30 -0.12 -0.39 -1.93 0.00 0.00 178.83 176.36 3dr4 h VAL 369 N -0.30 0.00 -2.60 2.39 -1.51 0.91 -3.43 116.25 111.71 3dr4 h VAL 369 Ca 0.00 -0.96 -0.54 0.00 -1.23 0.00 0.00 66.70 63.97 3dr4 h VAL 369 Cb 0.30 1.89 -0.07 0.00 -2.13 0.00 0.00 31.29 31.28 3dr4 h VAL 369 CO 0.00 0.00 1.07 -0.76 -1.23 0.00 0.00 177.57 176.65 3dr4 s LEU 370 N -5.97 3.28 0.00 4.19 1.43 0.52 -4.93 118.68 117.20 3dr4 s LEU 370 Ca 0.06 -0.12 0.00 0.00 -1.03 0.00 0.00 54.13 53.04 3dr4 s LEU 370 Cb 0.06 -2.79 0.00 0.00 0.03 0.00 0.00 46.19 43.49 3dr4 s LEU 370 CO 0.68 -1.78 0.07 0.52 0.23 0.00 0.00 176.35 176.07