#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dr4 s ARG 6 N 0.00 4.38 -0.25 0.54 3.00 -1.26 -4.94 118.95 120.42 3dr4 s ARG 6 Ca 0.00 2.11 -0.08 0.00 -1.00 0.00 0.00 55.73 56.75 3dr4 s ARG 6 Cb 0.00 -3.15 -0.04 0.00 0.00 0.00 0.00 34.95 31.76 3dr4 s ARG 6 CO 0.00 -0.23 0.10 0.42 0.00 0.00 0.00 175.30 175.60 3dr4 s ILE 7 N -0.28 4.68 0.39 4.11 1.01 -0.11 -5.03 121.20 125.96 3dr4 s ILE 7 Ca 0.54 -0.05 -0.08 0.00 0.00 0.00 0.00 60.65 61.07 3dr4 s ILE 7 Cb -0.38 -3.19 -0.05 0.00 0.01 0.00 0.00 42.46 38.85 3dr4 s ILE 7 CO 0.42 0.33 0.71 -0.44 0.00 0.00 0.00 174.94 175.97 3dr4 s SER 8 N 1.45 6.45 0.46 3.58 0.01 -1.26 -0.79 113.70 123.59 3dr4 s SER 8 Ca 0.06 0.97 0.26 0.00 1.31 0.00 0.00 55.95 58.55 3dr4 s SER 8 Cb -0.15 -2.26 0.89 0.00 0.21 0.00 0.00 66.02 64.72 3dr4 s SER 8 CO 0.05 -0.38 1.81 1.62 0.41 0.00 0.00 173.24 176.75 3dr4 h VAL 9 N 0.98 0.32 -3.12 3.43 3.04 -1.95 -3.42 116.25 115.53 3dr4 h VAL 9 Ca -0.47 -1.01 -0.01 0.00 -1.01 0.00 0.00 66.70 64.20 3dr4 h VAL 9 Cb 1.19 1.78 -0.10 0.00 -2.01 0.00 0.00 31.29 32.15 3dr4 h VAL 9 CO 0.64 0.14 0.14 0.00 -1.01 0.00 0.00 177.57 177.48 3dr4 s ALA 10 N -3.53 -1.28 -0.22 3.17 0.00 -1.26 -1.45 121.76 117.19 3dr4 s ALA 10 Ca 0.02 0.08 -0.29 0.00 0.00 0.00 0.00 51.96 51.77 3dr4 s ALA 10 Cb 0.09 0.86 0.16 0.00 0.00 0.00 0.00 23.12 24.22 3dr4 s ALA 10 CO 0.62 -0.82 1.16 0.00 0.00 0.00 0.00 175.76 176.72 3dr4 s ALA 11 N -3.82 -2.02 0.66 0.00 0.00 -1.26 -4.98 121.76 110.33 3dr4 s ALA 11 Ca 0.05 1.73 -0.09 0.00 0.00 0.00 0.00 51.96 53.65 3dr4 s ALA 11 Cb -0.02 -1.13 0.01 0.00 0.00 0.00 0.00 23.12 21.98 3dr4 s ALA 11 CO -0.06 -0.26 1.02 -1.25 0.00 0.00 0.00 175.76 175.21 3dr4 s PRO 12 N -0.92 2.93 -0.29 0.00 0.04 -1.23 -4.56 135.00 130.97 3dr4 s PRO 12 Ca 0.03 0.31 0.01 0.00 0.04 0.00 0.00 61.00 61.39 3dr4 s PRO 12 Cb -0.01 -2.12 0.09 0.00 0.04 0.00 0.00 34.50 32.50 3dr4 s PRO 12 CO -0.04 -0.88 0.04 0.50 0.04 0.00 0.00 177.00 176.66 3dr4 s ARG 13 N -5.21 1.22 -1.12 4.56 3.52 -1.26 -4.92 118.95 115.74 3dr4 s ARG 13 Ca 0.56 -1.28 -0.06 0.00 -0.13 0.00 0.00 55.73 54.83 3dr4 s ARG 13 Cb -0.11 -2.55 0.28 0.00 -1.56 0.00 0.00 34.95 31.01 3dr4 s ARG 13 CO 0.49 -0.85 1.53 1.28 -0.81 0.00 0.00 175.30 176.95 3dr4 n LEU 14 N 4.61 6.38 -1.79 -0.88 4.77 -1.26 -4.74 117.00 124.10 3dr4 n LEU 14 Ca -0.03 -5.08 -0.20 0.00 -0.03 0.00 0.00 56.01 50.67 3dr4 n LEU 14 Cb 0.43 -1.33 0.08 0.00 -2.33 0.00 0.00 43.42 40.26 3dr4 n LEU 14 CO 0.17 1.59 0.50 -0.90 -1.33 0.00 0.00 177.39 177.42 3dr4 n ASP 15 N 1.98 4.66 0.00 -1.43 5.75 -1.26 -4.87 116.55 121.38 3dr4 n ASP 15 Ca 0.29 -3.78 0.00 0.00 -0.01 0.00 0.00 54.79 51.28 3dr4 n ASP 15 Cb 0.34 -0.52 0.00 0.00 -1.03 0.00 0.00 41.12 39.91 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 4.74 0.25 6.12 0.00 -1.26 -5.01 105.19 109.17 3dr4 n GLY 16 Ca 0.43 -0.96 0.04 0.00 0.00 0.00 0.00 46.02 45.52 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 0.74 -0.01 1.61 3.02 -1.26 -4.55 115.26 114.80 3dr4 n ASN 17 Ca 0.00 -1.91 -0.12 0.00 -0.03 0.00 0.00 54.58 52.52 3dr4 n ASN 17 Cb 0.00 -0.08 -0.05 0.00 -0.61 0.00 0.00 39.78 39.03 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 0.83 -0.44 -0.27 3.52 3.07 -1.88 0.32 114.58 119.74 3dr4 h GLU 18 Ca 0.00 0.03 0.03 0.00 -0.50 0.00 0.00 59.36 58.92 3dr4 h GLU 18 Cb 0.19 0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 28.17 3dr4 h GLU 18 CO 0.00 -0.29 0.10 -0.09 -1.40 0.00 0.00 179.01 177.33 3dr4 h ARG 19 N -0.45 0.22 -0.31 2.33 2.43 -1.91 0.03 114.38 116.72 3dr4 h ARG 19 Ca 0.09 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 3dr4 h ARG 19 Cb 0.61 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 3dr4 h ARG 19 CO -0.41 0.14 0.15 -0.44 -1.51 0.00 0.00 179.97 177.90 3dr4 h ASP 20 N 0.22 0.40 -0.85 -3.80 3.32 -1.75 -0.27 116.42 113.69 3dr4 h ASP 20 Ca 0.12 -0.12 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3dr4 h ASP 20 Cb 0.08 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.48 3dr4 h ASP 20 CO -0.11 0.41 0.46 1.88 -1.72 0.00 0.00 179.24 180.16 3dr4 h TYR 21 N 0.36 1.17 -0.60 4.55 0.05 -0.83 0.64 116.97 122.31 3dr4 h TYR 21 Ca 0.11 -0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.78 3dr4 h TYR 21 Cb 0.11 -0.37 -0.02 0.00 1.01 0.00 0.00 36.73 37.46 3dr4 h TYR 21 CO -0.02 0.81 0.07 0.28 -1.05 0.00 0.00 178.16 178.25 3dr4 h VAL 22 N 1.18 1.26 -0.57 -2.88 2.07 -0.73 -1.80 116.25 114.78 3dr4 h VAL 22 Ca 0.30 -1.02 -0.04 0.00 0.82 0.00 0.00 66.70 66.75 3dr4 h VAL 22 Cb 0.03 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 3dr4 h VAL 22 CO -0.05 0.38 0.18 -0.07 0.02 0.00 0.00 177.57 178.02 3dr4 h LEU 23 N 0.93 0.80 -1.00 2.57 3.38 -0.30 -0.32 115.31 121.36 3dr4 h LEU 23 Ca 0.18 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3dr4 h LEU 23 Cb 0.44 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 3dr4 h LEU 23 CO 0.02 0.76 0.52 -0.08 0.09 0.00 0.00 178.44 179.74 3dr4 h GLU 24 N 0.84 1.20 -0.17 1.13 4.81 -0.41 0.29 114.58 122.27 3dr4 h GLU 24 Ca 0.19 -0.12 0.00 0.00 -0.13 0.00 0.00 59.36 59.30 3dr4 h GLU 24 Cb 0.25 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 3dr4 h GLU 24 CO -0.01 0.85 0.11 0.00 -0.73 0.00 0.00 179.01 179.23 3dr4 h MET 26 N 0.21 0.24 -0.28 0.00 2.86 -0.70 -0.66 114.93 116.61 3dr4 h MET 26 Ca 0.06 -0.03 -0.14 0.00 -2.06 0.00 0.00 59.70 57.53 3dr4 h MET 26 Cb -0.00 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 3dr4 h MET 26 CO -0.01 0.26 -0.40 -0.44 1.06 0.00 0.00 176.91 177.38 3dr4 h ASP 27 N 0.16 0.72 1.35 1.22 3.32 -0.37 -2.64 116.42 120.18 3dr4 h ASP 27 Ca 0.06 -0.32 0.00 0.00 0.02 0.00 0.00 57.03 56.79 3dr4 h ASP 27 Cb 0.09 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.44 3dr4 h ASP 27 CO -0.01 1.04 0.00 0.71 -1.72 0.00 0.00 179.24 179.26 3dr4 h THR 28 N 0.56 0.00 0.00 0.35 1.35 -1.11 -3.47 112.91 110.59 3dr4 h THR 28 Ca 0.05 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.36 3dr4 h THR 28 Cb 0.93 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.83 3dr4 h THR 28 CO 0.08 0.00 0.00 0.35 -0.25 0.00 0.00 175.52 175.70 3dr4 n THR 29 N -2.59 0.00 -2.87 6.82 -2.24 -0.33 -4.98 114.28 108.10 3dr4 n THR 29 Ca 0.04 0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.38 3dr4 n THR 29 Cb 0.39 -0.19 -0.02 0.00 -2.10 0.00 0.00 70.33 68.41 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 -1.82 3.08 -0.33 4.78 0.52 -0.77 -4.74 118.94 119.67 3dr4 s TRP 30 Ca 0.00 -1.43 0.04 0.00 0.02 0.00 0.00 56.10 54.73 3dr4 s TRP 30 Cb 0.00 -4.36 -0.02 0.00 -1.15 0.00 0.00 33.47 27.94 3dr4 s TRP 30 CO 0.00 -1.55 0.34 0.44 0.02 0.00 0.00 176.95 176.20 3dr4 n ILE 31 N 5.60 0.00 -1.34 2.03 -5.35 -1.26 -4.62 119.36 114.41 3dr4 n ILE 31 Ca 0.28 -0.44 0.00 0.00 -0.27 0.00 0.00 62.75 62.32 3dr4 n ILE 31 Cb 0.48 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 -0.63 0.00 0.00 7.28 3.41 -1.26 -4.23 113.62 118.18 3dr4 n SER 32 Ca 0.01 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.64 3dr4 n SER 32 Cb 0.08 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.15 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 0.00 0.00 -4.35 4.04 3.41 -1.26 0.25 113.62 115.71 3dr4 n SER 33 Ca 0.00 -1.65 -0.36 0.00 -0.26 0.00 0.00 58.87 56.60 3dr4 n SER 33 Cb 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 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 -2.00 3.76 0.00 -3.33 1.01 -1.26 -4.81 120.40 113.77 3dr4 s VAL 34 Ca 0.06 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 61.55 3dr4 s VAL 34 Cb 0.03 -2.80 0.00 0.00 0.00 0.00 0.00 36.38 33.60 3dr4 s VAL 34 CO 0.05 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.05 3dr4 n GLY 35 N 4.84 1.99 0.21 4.51 0.00 -1.26 -4.42 105.19 111.05 3dr4 n GLY 35 Ca -0.17 -0.51 0.06 0.00 0.00 0.00 0.00 46.02 45.41 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 0.00 0.00 1.61 0.11 -1.96 -3.19 114.38 110.95 3dr4 h ARG 36 Ca 0.00 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 60.02 3dr4 h ARG 36 Cb 0.00 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.07 3dr4 h ARG 36 CO 0.00 0.30 -0.29 0.74 0.10 0.00 0.00 179.97 180.82 3dr4 h PHE 37 N 0.00 0.00 0.25 4.08 0.04 -1.94 -2.72 116.94 116.64 3dr4 h PHE 37 Ca -0.00 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.76 3dr4 h PHE 37 Cb 0.65 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.79 3dr4 h PHE 37 CO 0.00 0.29 -0.19 0.82 -0.60 0.00 0.00 178.31 178.64 3dr4 h ILE 38 N 0.00 0.60 -0.40 -0.55 2.04 -1.84 0.48 117.51 117.84 3dr4 h ILE 38 Ca -0.00 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 3dr4 h ILE 38 Cb 0.71 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 3dr4 h ILE 38 CO 0.04 0.00 -0.15 0.58 0.00 0.00 0.00 178.15 178.62 3dr4 h VAL 39 N -0.44 1.26 -0.48 1.67 2.07 -1.76 0.07 116.25 118.65 3dr4 h VAL 39 Ca -0.02 -1.22 -0.12 0.00 0.82 0.00 0.00 66.70 66.17 3dr4 h VAL 39 Cb 0.38 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 3dr4 h VAL 39 CO -0.01 0.41 -0.17 -0.33 0.02 0.00 0.00 177.57 177.50 3dr4 h GLU 40 N 0.67 0.93 -0.75 1.57 5.08 -1.20 0.97 114.58 121.85 3dr4 h GLU 40 Ca 0.11 -0.36 -0.04 0.00 -1.00 0.00 0.00 59.36 58.06 3dr4 h GLU 40 Cb 0.63 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 3dr4 h GLU 40 CO 0.04 1.02 0.30 0.35 -1.00 0.00 0.00 179.01 179.73 3dr4 h PHE 41 N 0.82 1.14 -0.58 4.33 3.57 0.34 -1.28 116.94 125.29 3dr4 h PHE 41 Ca 0.12 -0.08 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 3dr4 h PHE 41 Cb 0.71 -0.34 -0.03 0.00 2.79 0.00 0.00 35.95 39.09 3dr4 h PHE 41 CO 0.04 0.87 0.28 0.93 -2.23 0.00 0.00 178.31 178.20 3dr4 h GLU 42 N 1.08 0.83 -0.04 1.11 5.08 -0.65 0.79 114.58 122.78 3dr4 h GLU 42 Ca 0.25 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.49 3dr4 h GLU 42 Cb 0.21 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.31 3dr4 h GLU 42 CO -0.02 0.68 0.02 0.87 -1.00 0.00 0.00 179.01 179.56 3dr4 h LYS 43 N 0.79 0.06 -0.90 2.33 1.57 -0.56 0.27 116.57 120.13 3dr4 h LYS 43 Ca 0.20 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.95 3dr4 h LYS 43 Cb 0.12 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.38 3dr4 h LYS 43 CO -0.02 0.15 0.50 0.00 -0.57 0.00 0.00 179.45 179.50 3dr4 h ALA 44 N 0.91 1.16 -0.55 3.86 0.00 -1.05 0.18 119.26 123.77 3dr4 h ALA 44 Ca 0.02 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 3dr4 h ALA 44 Cb 0.10 -0.36 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 3dr4 h ALA 44 CO -0.00 0.66 -0.03 0.35 0.00 0.00 0.00 179.25 180.23 3dr4 h PHE 45 N 1.27 1.10 -0.51 0.00 3.57 -0.49 0.11 116.94 121.98 3dr4 h PHE 45 Ca 0.32 -0.20 -0.03 0.00 3.53 0.00 0.00 57.97 61.59 3dr4 h PHE 45 Cb 0.02 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.46 3dr4 h PHE 45 CO 0.01 1.00 0.22 0.00 -2.23 0.00 0.00 178.31 177.31 3dr4 h ALA 46 N 0.95 0.66 -0.75 2.41 0.00 -0.55 -1.38 119.26 120.60 3dr4 h ALA 46 Ca 0.15 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3dr4 h ALA 46 Cb 0.59 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 3dr4 h ALA 46 CO 0.04 0.25 0.34 -0.44 0.00 0.00 0.00 179.25 179.43 3dr4 h ASP 47 N 0.68 1.00 -0.95 0.00 3.32 -0.15 -1.30 116.42 119.02 3dr4 h ASP 47 Ca 0.17 -0.15 0.04 0.00 0.02 0.00 0.00 57.03 57.11 3dr4 h ASP 47 Cb 0.17 -0.26 -0.05 0.00 0.22 0.00 0.00 39.33 39.41 3dr4 h ASP 47 CO -0.02 0.87 0.62 0.22 -1.72 0.00 0.00 179.24 179.22 3dr4 h TYR 48 N 1.06 1.16 -0.01 4.55 3.20 -0.05 -1.59 116.97 125.29 3dr4 h TYR 48 Ca 0.25 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.15 3dr4 h TYR 48 Cb 0.15 -0.39 0.00 0.00 1.54 0.00 0.00 36.73 38.04 3dr4 h TYR 48 CO 0.01 0.67 -0.20 0.00 -1.64 0.00 0.00 178.16 177.00 3dr4 n GLY 50 N 1.31 0.21 3.46 0.00 0.00 -0.58 -4.39 105.19 105.19 3dr4 n GLY 50 Ca 0.14 -0.41 -0.22 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.82 1.80 -0.01 1.61 -7.23 -0.67 -5.00 120.40 108.08 3dr4 s VAL 51 Ca 0.13 -2.15 -0.21 0.00 -1.81 0.00 0.00 61.98 57.95 3dr4 s VAL 51 Cb -0.06 -2.50 -0.24 0.00 0.56 0.00 0.00 36.38 34.14 3dr4 s VAL 51 CO 0.16 -0.28 1.07 0.50 -0.31 0.00 0.00 175.10 176.24 3dr4 h LYS 52 N 2.22 0.36 -6.10 4.82 3.64 -1.85 -3.40 116.57 116.26 3dr4 h LYS 52 Ca -0.40 -0.40 -0.57 0.00 -1.27 0.00 0.00 60.65 58.00 3dr4 h LYS 52 Cb 1.24 0.12 -0.24 0.00 -0.41 0.00 0.00 32.23 32.93 3dr4 h LYS 52 CO 0.68 1.09 -0.84 -1.01 -2.27 0.00 0.00 179.45 177.10 3dr4 s HIS 53 N -3.11 1.80 -0.04 1.91 3.76 0.29 -4.99 115.29 114.90 3dr4 s HIS 53 Ca -0.14 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.39 3dr4 s HIS 53 Cb 0.03 -1.04 0.03 0.00 1.11 0.00 0.00 32.58 32.70 3dr4 s HIS 53 CO 0.81 0.13 -0.01 0.00 -0.85 0.00 0.00 174.74 174.81 3dr4 s ALA 54 N -0.91 0.53 -0.27 -1.40 0.00 -1.26 -1.57 121.76 116.87 3dr4 s ALA 54 Ca 0.07 0.02 0.01 0.00 0.00 0.00 0.00 51.96 52.06 3dr4 s ALA 54 Cb -0.09 -0.47 0.05 0.00 0.00 0.00 0.00 23.12 22.61 3dr4 s ALA 54 CO 0.03 -0.16 -0.07 0.42 0.00 0.00 0.00 175.76 175.98 3dr4 s ILE 55 N 1.26 2.57 0.20 0.00 1.09 0.28 -4.82 121.20 121.78 3dr4 s ILE 55 Ca -0.06 -1.44 -0.30 0.00 -1.10 0.00 0.00 60.65 57.75 3dr4 s ILE 55 Cb -0.13 -2.46 -0.08 0.00 -1.06 0.00 0.00 42.46 38.73 3dr4 s ILE 55 CO -0.02 -0.01 1.02 0.00 -0.10 0.00 0.00 174.94 175.83 3dr4 s ALA 56 N 1.19 3.34 0.29 9.38 0.00 -1.26 -0.78 121.76 133.92 3dr4 s ALA 56 Ca -0.06 0.72 0.03 0.00 0.00 0.00 0.00 51.96 52.65 3dr4 s ALA 56 Cb -0.19 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.58 3dr4 s ALA 56 CO -0.04 -0.02 0.06 0.00 0.00 0.00 0.00 175.76 175.76 3dr4 h ASN 58 N 2.27 0.00 -5.36 0.00 -0.00 -1.40 -0.59 115.58 110.50 3dr4 h ASN 58 Ca -0.39 0.00 0.18 0.00 -0.00 0.00 0.00 56.30 56.09 3dr4 h ASN 58 Cb 1.24 0.00 -0.07 0.00 -0.00 0.00 0.00 38.32 39.49 3dr4 h ASN 58 CO 0.66 0.00 0.51 0.54 -0.00 0.00 0.00 177.43 179.14 3dr4 s ASN 59 N -5.57 -0.14 0.48 6.14 2.20 -1.26 -2.52 114.94 114.27 3dr4 s ASN 59 Ca 0.03 -0.44 0.27 0.00 -0.94 0.00 0.00 52.86 51.77 3dr4 s ASN 59 Cb 0.08 0.48 1.17 0.00 -2.00 0.00 0.00 41.25 40.99 3dr4 s ASN 59 CO 0.55 -0.90 1.93 1.23 -2.94 0.00 0.00 177.10 176.98 3dr4 h GLY 60 N 2.00 0.00 0.70 0.45 0.00 -1.70 -2.07 103.07 102.44 3dr4 h GLY 60 Ca -0.25 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 3dr4 h GLY 60 CO 0.27 0.00 -0.36 -0.84 0.00 0.00 0.00 176.54 175.61 3dr4 h THR 61 N 0.00 1.43 0.00 4.70 2.02 -1.92 -2.62 112.91 116.52 3dr4 h THR 61 Ca -0.00 -1.79 -0.14 0.00 0.77 0.00 0.00 66.41 65.25 3dr4 h THR 61 Cb 0.58 2.37 -0.02 0.00 -1.74 0.00 0.00 68.15 69.34 3dr4 h THR 61 CO 0.02 0.51 -0.65 0.71 0.37 0.00 0.00 175.52 176.48 3dr4 h THR 62 N -0.15 1.47 -0.49 3.16 1.35 -1.95 -1.65 112.91 114.65 3dr4 h THR 62 Ca -0.03 -2.24 0.01 0.00 -0.55 0.00 0.00 66.41 63.60 3dr4 h THR 62 Cb 1.02 2.21 -0.03 0.00 -1.73 0.00 0.00 68.15 69.62 3dr4 h THR 62 CO 0.07 0.64 0.31 0.00 -0.25 0.00 0.00 175.52 176.29 3dr4 h ALA 63 N 1.35 0.62 -0.14 6.62 0.00 -1.39 0.26 119.26 126.58 3dr4 h ALA 63 Ca -0.01 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3dr4 h ALA 63 Cb 1.16 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3dr4 h ALA 63 CO 0.08 0.03 0.04 -0.07 0.00 0.00 0.00 179.25 179.33 3dr4 h LEU 64 N 0.62 0.04 0.12 0.00 3.38 -1.15 0.40 115.31 118.71 3dr4 h LEU 64 Ca 0.19 0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.18 3dr4 h LEU 64 Cb -0.03 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3dr4 h LEU 64 CO -0.06 0.04 -0.17 -0.74 0.09 0.00 0.00 178.44 177.60 3dr4 h HIS 65 N 0.10 -0.45 -0.28 1.13 2.76 -0.96 0.16 115.15 117.61 3dr4 h HIS 65 Ca 0.06 0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.29 3dr4 h HIS 65 Cb 0.04 0.18 -0.06 0.00 1.55 0.00 0.00 27.41 29.12 3dr4 h HIS 65 CO -0.11 -0.26 -0.09 1.25 -1.30 0.00 0.00 177.93 177.42 3dr4 h LEU 66 N -0.34 -0.32 -0.27 0.26 5.85 -0.34 -0.46 115.31 119.69 3dr4 h LEU 66 Ca 0.02 0.09 0.03 0.00 0.84 0.00 0.00 57.88 58.86 3dr4 h LEU 66 Cb 0.35 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 3dr4 h LEU 66 CO -0.08 -0.12 0.06 0.00 -0.34 0.00 0.00 178.44 177.97 3dr4 h ALA 67 N 1.24 0.28 -0.59 1.25 0.00 -0.65 -0.12 119.26 120.67 3dr4 h ALA 67 Ca 0.14 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 3dr4 h ALA 67 Cb 0.24 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 3dr4 h ALA 67 CO -0.31 -0.35 0.21 -0.07 0.00 0.00 0.00 179.25 178.73 3dr4 h LEU 68 N 0.17 0.84 -0.65 0.00 3.38 -0.05 -0.48 115.31 118.52 3dr4 h LEU 68 Ca 0.12 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 3dr4 h LEU 68 Cb 0.11 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 3dr4 h LEU 68 CO -0.15 0.80 0.26 0.58 0.09 0.00 0.00 178.44 180.03 3dr4 h VAL 69 N 0.83 1.24 -0.53 1.22 2.07 -0.83 -1.49 116.25 118.76 3dr4 h VAL 69 Ca 0.19 -0.74 -0.04 0.00 0.82 0.00 0.00 66.70 66.94 3dr4 h VAL 69 Cb 0.25 0.51 -0.03 0.00 -1.52 0.00 0.00 31.29 30.50 3dr4 h VAL 69 CO -0.01 0.29 0.18 0.00 0.02 0.00 0.00 177.57 178.05 3dr4 h ALA 70 N 1.11 1.32 0.00 1.67 0.00 -0.77 0.01 119.26 122.61 3dr4 h ALA 70 Ca 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3dr4 h ALA 70 Cb 0.20 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3dr4 h ALA 70 CO -0.02 0.49 0.00 -1.33 0.00 0.00 0.00 179.25 178.40 3dr4 n MET 71 N -4.32 0.20 -0.08 0.00 2.00 -0.21 -4.89 117.12 109.82 3dr4 n MET 71 Ca 0.04 0.43 0.00 0.00 0.00 0.00 0.00 57.70 58.17 3dr4 n MET 71 Cb 0.18 -1.88 0.00 0.00 0.00 0.00 0.00 33.22 31.52 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 -0.05 0.94 3.73 3.03 0.00 -0.01 -5.05 105.19 107.78 3dr4 n GLY 72 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.01 3.62 0.00 -0.61 -1.09 -0.63 -4.97 121.20 115.51 3dr4 s ILE 73 Ca 0.00 1.28 0.00 0.00 -2.23 0.00 0.00 60.65 59.70 3dr4 s ILE 73 Cb 0.00 -3.82 0.00 0.00 -1.58 0.00 0.00 42.46 37.06 3dr4 s ILE 73 CO 0.00 0.17 0.00 0.61 -1.23 0.00 0.00 174.94 174.49 3dr4 n GLY 74 N 2.59 2.60 3.64 6.18 0.00 -1.26 -4.60 105.19 114.34 3dr4 n GLY 74 Ca 0.06 -0.97 -0.47 0.00 0.00 0.00 0.00 46.02 44.64 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 1.81 0.00 1.61 -0.02 -1.15 -1.36 135.00 135.90 3dr4 n PRO 75 Ca 0.00 0.65 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 3dr4 n PRO 75 Cb 0.00 -2.32 0.00 0.00 -0.02 0.00 0.00 33.50 31.16 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 2.62 3.26 3.85 -1.23 0.00 -1.21 -4.93 105.19 107.56 3dr4 n GLY 76 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.43 6.39 -0.04 1.61 1.01 -0.46 -4.85 116.67 119.91 3dr4 s ASP 77 Ca 0.00 1.52 0.04 0.00 0.71 0.00 0.00 52.55 54.82 3dr4 s ASP 77 Cb 0.00 -2.49 -0.03 0.00 1.01 0.00 0.00 42.92 41.41 3dr4 s ASP 77 CO 0.00 -0.75 -0.14 -1.61 0.21 0.00 0.00 175.17 172.87 3dr4 s GLU 78 N -4.54 2.46 -0.07 8.23 2.02 -0.32 0.63 118.70 127.11 3dr4 s GLU 78 Ca 0.58 -0.73 0.01 0.00 0.02 0.00 0.00 54.97 54.85 3dr4 s GLU 78 Cb -0.11 -2.36 0.02 0.00 0.10 0.00 0.00 34.13 31.78 3dr4 s GLU 78 CO 0.41 0.61 -0.10 0.08 0.02 0.00 0.00 175.26 176.29 3dr4 s VAL 79 N -0.77 1.00 -0.08 2.63 1.01 -0.40 -1.09 120.40 122.70 3dr4 s VAL 79 Ca 0.12 -0.36 -0.27 0.00 0.00 0.00 0.00 61.98 61.47 3dr4 s VAL 79 Cb -0.11 -0.95 -0.02 0.00 0.00 0.00 0.00 36.38 35.30 3dr4 s VAL 79 CO 0.01 0.34 0.89 -0.63 0.00 0.00 0.00 175.10 175.71 3dr4 s ILE 80 N 0.99 4.89 0.01 2.22 1.01 -0.48 -0.47 121.20 129.37 3dr4 s ILE 80 Ca -0.09 1.83 0.02 0.00 0.00 0.00 0.00 60.65 62.40 3dr4 s ILE 80 Cb -0.15 -4.22 -0.01 0.00 0.01 0.00 0.00 42.46 38.10 3dr4 s ILE 80 CO -0.00 0.12 -0.05 -0.69 0.00 0.00 0.00 174.94 174.31 3dr4 s VAL 81 N 1.43 0.39 0.40 2.92 1.01 -0.57 -0.51 120.40 125.47 3dr4 s VAL 81 Ca 0.45 -0.50 -0.25 0.00 0.00 0.00 0.00 61.98 61.68 3dr4 s VAL 81 Cb -0.19 -0.38 -0.08 0.00 0.00 0.00 0.00 36.38 35.72 3dr4 s VAL 81 CO 0.20 -0.09 1.17 -2.84 0.00 0.00 0.00 175.10 173.55 3dr4 s PRO 82 N -0.64 4.03 0.30 2.72 0.01 -1.26 -1.58 135.00 138.58 3dr4 s PRO 82 Ca -0.03 1.84 0.06 0.00 0.01 0.00 0.00 61.00 62.88 3dr4 s PRO 82 Cb -0.05 -2.66 0.47 0.00 0.01 0.00 0.00 34.50 32.28 3dr4 s PRO 82 CO -0.00 -0.34 1.72 1.03 0.01 0.00 0.00 177.00 179.42 3dr4 h SER 83 N 2.59 0.28 -2.62 2.53 0.87 -1.73 -3.38 113.55 112.10 3dr4 h SER 83 Ca -0.49 -0.11 -0.62 0.00 -1.23 0.00 0.00 61.79 59.35 3dr4 h SER 83 Cb 1.24 -0.08 -0.14 0.00 -0.44 0.00 0.00 62.40 62.98 3dr4 h SER 83 CO 0.62 0.63 0.62 -0.22 -0.53 0.00 0.00 176.83 177.95 3dr4 s LEU 84 N -8.35 4.21 0.14 2.23 2.96 -1.26 -0.39 118.68 118.22 3dr4 s LEU 84 Ca -0.05 -0.91 -0.24 0.00 -0.22 0.00 0.00 54.13 52.71 3dr4 s LEU 84 Cb 0.14 -2.44 0.08 0.00 0.50 0.00 0.00 46.19 44.46 3dr4 s LEU 84 CO 0.77 -1.50 1.05 0.28 -1.32 0.00 0.00 176.35 175.63 3dr4 s THR 85 N 4.31 0.00 0.24 3.68 -1.32 -1.26 -4.97 115.64 116.31 3dr4 s THR 85 Ca 0.24 -0.56 -0.30 0.00 -1.21 0.00 0.00 61.69 59.87 3dr4 s THR 85 Cb -0.16 -2.49 -0.09 0.00 -1.51 0.00 0.00 72.50 68.26 3dr4 s THR 85 CO 0.11 0.00 1.10 -0.47 -2.21 0.00 0.00 174.62 173.15 3dr4 s TYR 86 N -2.57 3.60 0.57 9.09 5.04 -1.26 -4.77 117.35 127.05 3dr4 s TYR 86 Ca 0.18 1.66 0.30 0.00 -2.44 0.00 0.00 57.07 56.78 3dr4 s TYR 86 Cb -0.01 -3.27 1.44 0.00 0.35 0.00 0.00 41.96 40.46 3dr4 s TYR 86 CO 0.03 -0.55 1.84 0.97 -1.34 0.00 0.00 175.55 176.49 3dr4 h ILE 87 N 3.33 0.38 -0.67 3.14 2.10 -1.96 -1.93 117.51 121.89 3dr4 h ILE 87 Ca -0.46 0.00 0.11 0.00 1.08 0.00 0.00 64.86 65.59 3dr4 h ILE 87 Cb 1.21 0.53 -0.04 0.00 -1.09 0.00 0.00 36.82 37.43 3dr4 h ILE 87 CO 0.69 0.00 0.45 0.00 -1.08 0.00 0.00 178.15 178.21 3dr4 h ALA 88 N 1.40 2.00 -0.56 0.18 0.00 -1.97 0.13 119.26 120.43 3dr4 h ALA 88 Ca 0.32 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.28 3dr4 h ALA 88 Cb 1.56 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 19.21 3dr4 h ALA 88 CO -0.00 -0.16 0.28 0.77 0.00 0.00 0.00 179.25 180.14 3dr4 h SER 89 N 0.47 0.40 0.17 0.00 0.02 -1.73 -0.73 113.55 112.14 3dr4 h SER 89 Ca 0.32 0.03 -0.25 0.00 -0.84 0.00 0.00 61.79 61.05 3dr4 h SER 89 Cb 0.61 -0.04 0.03 0.00 0.14 0.00 0.00 62.40 63.14 3dr4 h SER 89 CO -0.10 0.26 -1.09 0.00 -1.14 0.00 0.00 176.83 174.76 3dr4 h ALA 90 N 1.31 -0.10 -0.82 3.77 0.00 -1.48 -3.31 119.26 118.62 3dr4 h ALA 90 Ca 0.25 -0.76 0.09 0.00 0.00 0.00 0.00 54.91 54.49 3dr4 h ALA 90 Cb 0.18 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 3dr4 h ALA 90 CO -0.18 0.52 0.53 -0.91 0.00 0.00 0.00 179.25 179.22 3dr4 h ASN 91 N -0.10 0.73 -0.48 0.00 2.35 -0.62 -1.41 115.58 116.06 3dr4 h ASN 91 Ca -0.19 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.56 3dr4 h ASN 91 Cb 1.85 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 40.05 3dr4 h ASN 91 CO 0.21 0.45 0.23 0.77 -1.65 0.00 0.00 177.43 177.43 3dr4 h SER 92 N 0.82 0.66 -0.18 5.81 4.64 -1.22 0.18 113.55 124.25 3dr4 h SER 92 Ca 0.37 -0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.60 3dr4 h SER 92 Cb 0.36 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.28 3dr4 h SER 92 CO -0.14 0.58 0.00 0.58 -0.87 0.00 0.00 176.83 176.98 3dr4 h VAL 93 N 0.73 1.25 -0.79 0.95 2.07 -1.38 -3.11 116.25 115.97 3dr4 h VAL 93 Ca 0.18 -0.85 0.12 0.00 0.82 0.00 0.00 66.70 66.97 3dr4 h VAL 93 Cb 0.11 1.46 -0.08 0.00 -1.52 0.00 0.00 31.29 31.26 3dr4 h VAL 93 CO -0.02 0.26 0.40 0.74 0.02 0.00 0.00 177.57 178.96 3dr4 h THR 94 N 0.07 0.79 -0.67 2.57 2.02 -0.35 -1.23 112.91 116.12 3dr4 h THR 94 Ca 0.05 -0.21 0.08 0.00 0.77 0.00 0.00 66.41 67.10 3dr4 h THR 94 Cb 0.38 0.11 -0.04 0.00 -1.74 0.00 0.00 68.15 66.86 3dr4 h THR 94 CO 0.01 0.11 0.44 1.88 0.37 0.00 0.00 175.52 178.33 3dr4 h TYR 95 N 0.62 0.61 0.00 3.16 0.05 -0.64 -0.85 116.97 119.93 3dr4 h TYR 95 Ca 0.41 0.02 0.00 0.00 0.05 0.00 0.00 58.73 59.20 3dr4 h TYR 95 Cb 0.50 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 38.04 3dr4 h TYR 95 CO -0.10 0.31 0.00 0.00 -1.05 0.00 0.00 178.16 177.32 3dr4 n GLY 97 N 0.44 0.72 3.93 0.00 0.00 -0.32 -2.92 105.19 107.04 3dr4 n GLY 97 Ca 0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.49 3.47 -0.19 4.61 0.00 -1.06 -3.31 121.76 122.80 3dr4 s ALA 98 Ca 0.00 -0.90 -0.03 0.00 0.00 0.00 0.00 51.96 51.02 3dr4 s ALA 98 Cb 0.00 -2.42 -0.02 0.00 0.00 0.00 0.00 23.12 20.69 3dr4 s ALA 98 CO 0.00 -0.75 -0.05 0.99 0.00 0.00 0.00 175.76 175.95 3dr4 s THR 99 N -2.88 3.57 0.33 0.00 2.01 0.20 -4.12 115.64 114.76 3dr4 s THR 99 Ca 0.54 -0.45 -0.28 0.00 0.31 0.00 0.00 61.69 61.81 3dr4 s THR 99 Cb -0.10 -2.59 -0.09 0.00 0.01 0.00 0.00 72.50 69.72 3dr4 s THR 99 CO 0.42 0.46 1.18 -2.84 -0.69 0.00 0.00 174.62 173.15 3dr4 s PRO 100 N 0.94 4.38 -0.29 4.92 0.02 -1.26 -1.27 135.00 142.42 3dr4 s PRO 100 Ca -0.00 1.92 0.03 0.00 0.02 0.00 0.00 61.00 62.97 3dr4 s PRO 100 Cb -0.15 -2.99 0.08 0.00 0.02 0.00 0.00 34.50 31.47 3dr4 s PRO 100 CO 0.01 -0.06 -0.03 0.08 -0.33 0.00 0.00 177.00 176.67 3dr4 s VAL 101 N -1.24 2.13 0.42 3.83 1.01 0.38 -4.86 120.40 122.07 3dr4 s VAL 101 Ca 0.50 -1.91 -0.23 0.00 0.00 0.00 0.00 61.98 60.33 3dr4 s VAL 101 Cb -0.33 -2.40 -0.09 0.00 0.00 0.00 0.00 36.38 33.55 3dr4 s VAL 101 CO 0.43 -0.31 1.06 -0.76 0.00 0.00 0.00 175.10 175.53 3dr4 s LEU 102 N 1.05 4.07 0.06 3.92 1.43 -1.25 -1.51 118.68 126.46 3dr4 s LEU 102 Ca 0.01 2.05 0.04 0.00 -1.03 0.00 0.00 54.13 55.19 3dr4 s LEU 102 Cb -0.19 -4.26 -0.03 0.00 0.03 0.00 0.00 46.19 41.74 3dr4 s LEU 102 CO -0.07 -0.59 -0.11 0.54 0.23 0.00 0.00 176.35 176.35 3dr4 s VAL 103 N -1.70 0.85 0.92 -1.59 0.11 -0.61 -4.86 120.40 113.51 3dr4 s VAL 103 Ca 0.60 -1.28 -0.12 0.00 -2.93 0.00 0.00 61.98 58.25 3dr4 s VAL 103 Cb -0.22 -0.94 0.14 0.00 -1.53 0.00 0.00 36.38 33.84 3dr4 s VAL 103 CO 0.27 -0.35 1.14 -0.62 -3.33 0.00 0.00 175.10 172.21 3dr4 s ASP 104 N -1.80 3.45 0.43 3.54 -1.08 -1.26 -1.96 116.67 117.99 3dr4 s ASP 104 Ca -0.04 0.95 0.04 0.00 -0.52 0.00 0.00 52.55 52.98 3dr4 s ASP 104 Cb -0.09 -1.51 -0.04 0.00 -1.46 0.00 0.00 42.92 39.82 3dr4 s ASP 104 CO 0.01 -2.58 0.04 0.54 0.52 0.00 0.00 175.17 173.69 3dr4 s ASN 105 N -4.03 3.54 0.18 -0.34 4.22 -1.26 -0.89 114.94 116.35 3dr4 s ASN 105 Ca 0.64 -1.53 -0.30 0.00 -2.14 0.00 0.00 52.86 49.53 3dr4 s ASN 105 Cb -0.15 0.15 -0.08 0.00 1.28 0.00 0.00 41.25 42.46 3dr4 s ASN 105 CO 0.53 -0.71 1.04 -0.62 -2.04 0.00 0.00 177.10 175.31 3dr4 s ASP 106 N -3.72 7.38 0.13 3.54 2.15 0.13 -4.64 116.67 121.64 3dr4 s ASP 106 Ca 0.23 2.01 0.23 0.00 0.43 0.00 0.00 52.55 55.44 3dr4 s ASP 106 Cb 0.05 -2.60 0.90 0.00 -0.30 0.00 0.00 42.92 40.98 3dr4 s ASP 106 CO 0.11 -0.12 1.71 -0.81 -0.17 0.00 0.00 175.17 175.90 3dr4 n PRO 107 N 2.25 0.12 -0.12 4.34 -0.04 -1.26 -1.06 135.00 139.22 3dr4 n PRO 107 Ca 0.02 0.24 -0.21 0.00 -0.04 0.00 0.00 63.50 63.51 3dr4 n PRO 107 Cb 0.47 -1.69 -0.10 0.00 -0.04 0.00 0.00 33.50 32.14 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 -1.91 0.58 0.00 0.54 1.74 -1.26 -4.54 116.66 111.82 3dr4 n ARG 108 Ca 0.04 0.18 0.12 0.00 -0.77 0.00 0.00 57.85 57.42 3dr4 n ARG 108 Cb 0.29 -1.46 0.22 0.00 -1.02 0.00 0.00 32.46 30.49 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 -3.57 0.00 -0.80 0.55 -2.24 -1.24 -4.02 114.28 102.96 3dr4 n THR 109 Ca -0.46 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 3dr4 n THR 109 Cb 0.92 0.48 0.00 0.00 -2.10 0.00 0.00 70.33 69.63 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 -1.10 0.00 -4.02 4.78 3.72 -0.22 -4.84 117.46 115.77 3dr4 n PHE 110 Ca 0.08 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.26 3dr4 n PHE 110 Cb 0.35 -1.01 -0.04 0.00 -0.94 0.00 0.00 39.48 37.84 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 -2.26 5.66 -0.13 4.37 0.01 -1.25 -4.64 114.94 116.70 3dr4 s ASN 111 Ca 0.00 -0.22 -0.32 0.00 -0.71 0.00 0.00 52.86 51.61 3dr4 s ASN 111 Cb 0.00 -1.42 -0.15 0.00 0.41 0.00 0.00 41.25 40.09 3dr4 s ASN 111 CO 0.00 -0.10 0.94 -0.11 -1.51 0.00 0.00 177.10 176.32 3dr4 n LEU 112 N -1.27 0.31 -4.45 0.60 0.00 -1.26 0.19 117.00 111.12 3dr4 n LEU 112 Ca -0.07 0.88 -0.43 0.00 0.00 0.00 0.00 56.01 56.39 3dr4 n LEU 112 Cb 0.58 -0.68 -0.04 0.00 0.00 0.00 0.00 43.42 43.28 3dr4 n LEU 112 CO 0.43 -1.16 0.71 -0.62 0.00 0.00 0.00 177.39 176.75 3dr4 s ASP 113 N 0.78 6.19 0.44 1.96 -1.08 -0.07 -4.62 116.67 120.26 3dr4 s ASP 113 Ca 0.72 -0.98 0.19 0.00 -0.52 0.00 0.00 52.55 51.96 3dr4 s ASP 113 Cb -1.01 -2.40 1.13 0.00 -1.46 0.00 0.00 42.92 39.17 3dr4 s ASP 113 CO 0.49 -1.38 1.88 0.00 0.52 0.00 0.00 175.17 176.68 3dr4 h ALA 114 N 9.49 2.26 0.00 3.66 0.00 -1.88 0.20 119.26 133.00 3dr4 h ALA 114 Ca -0.29 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3dr4 h ALA 114 Cb 1.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3dr4 h ALA 114 CO 1.16 -0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.89 3dr4 n ALA 115 N -2.54 1.36 0.35 0.00 0.00 -1.26 -1.37 120.51 117.05 3dr4 n ALA 115 Ca 0.18 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.71 3dr4 n ALA 115 Cb 0.69 -1.16 0.14 0.00 0.00 0.00 0.00 19.45 19.11 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 -1.62 1.96 0.12 0.00 4.76 0.72 -4.62 118.16 119.47 3dr4 n LYS 116 Ca 0.02 -1.86 -0.12 0.00 -2.87 0.00 0.00 58.31 53.47 3dr4 n LYS 116 Cb 0.10 -1.37 -0.08 0.00 -1.84 0.00 0.00 35.03 31.84 3dr4 n LYS 116 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 3dr4 h LEU 117 N 3.36 -0.30 -0.92 -0.35 3.38 -1.27 -3.36 115.31 115.85 3dr4 h LEU 117 Ca 0.00 -0.23 0.24 0.00 0.09 0.00 0.00 57.88 57.98 3dr4 h LEU 117 Cb 0.78 0.08 -0.16 0.00 0.09 0.00 0.00 40.66 41.45 3dr4 h LEU 117 CO 0.00 0.13 0.05 -0.08 0.09 0.00 0.00 178.44 178.63 3dr4 h GLU 118 N -0.80 0.06 0.00 1.13 4.57 -1.82 0.66 114.58 118.38 3dr4 h GLU 118 Ca -0.04 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 3dr4 h GLU 118 Cb 0.51 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 3dr4 h GLU 118 CO 0.06 0.04 0.00 0.00 -1.18 0.00 0.00 179.01 177.93 3dr4 n ALA 119 N -3.03 1.81 0.75 2.92 0.00 -1.26 -2.17 120.51 119.53 3dr4 n ALA 119 Ca 0.21 -0.07 0.08 0.00 0.00 0.00 0.00 53.44 53.66 3dr4 n ALA 119 Cb 0.68 -1.22 -0.00 0.00 0.00 0.00 0.00 19.45 18.90 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 -1.25 1.65 -4.73 0.00 4.77 0.23 -4.94 117.00 112.73 3dr4 n LEU 120 Ca 0.07 -0.76 -0.41 0.00 -0.03 0.00 0.00 56.01 54.88 3dr4 n LEU 120 Cb 0.10 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.15 3dr4 n LEU 120 CO 0.10 0.32 0.74 -0.63 -1.33 0.00 0.00 177.39 176.59 3dr4 s ILE 121 N -1.98 4.23 0.37 -0.08 1.01 -0.92 -4.97 121.20 118.85 3dr4 s ILE 121 Ca 0.14 1.82 0.06 0.00 0.00 0.00 0.00 60.65 62.67 3dr4 s ILE 121 Cb 0.14 -4.16 -0.02 0.00 0.01 0.00 0.00 42.46 38.42 3dr4 s ILE 121 CO 0.43 0.27 0.20 0.35 0.00 0.00 0.00 174.94 176.19 3dr4 n THR 122 N 2.84 0.00 0.29 2.92 -2.24 -1.26 -5.02 114.28 111.81 3dr4 n THR 122 Ca 0.03 -2.36 0.17 0.00 -2.27 0.00 0.00 64.05 59.62 3dr4 n THR 122 Cb 0.48 1.00 0.82 0.00 -2.10 0.00 0.00 70.33 70.53 3dr4 n THR 122 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3dr4 h PRO 123 N 0.00 0.00 -0.00 -0.78 0.11 -2.02 -2.38 132.00 126.93 3dr4 h PRO 123 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3dr4 h PRO 123 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3dr4 h PRO 123 CO 0.42 0.00 -0.47 0.54 -0.21 0.00 0.00 178.00 178.29 3dr4 n ARG 124 N -2.74 0.33 -2.10 1.05 1.74 -1.26 -4.93 116.66 108.75 3dr4 n ARG 124 Ca -0.01 -0.21 -0.41 0.00 -0.77 0.00 0.00 57.85 56.45 3dr4 n ARG 124 Cb 0.14 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.06 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 -2.81 2.88 0.00 0.55 2.01 -0.90 -1.17 115.64 116.20 3dr4 s THR 125 Ca 0.15 0.74 0.00 0.00 0.31 0.00 0.00 61.69 62.89 3dr4 s THR 125 Cb 0.18 -3.47 0.00 0.00 0.01 0.00 0.00 72.50 69.22 3dr4 s THR 125 CO 0.65 0.12 0.00 0.29 -0.69 0.00 0.00 174.62 174.99 3dr4 n LYS 126 N 2.42 1.53 -3.60 4.92 4.76 -0.25 -4.87 118.16 123.08 3dr4 n LYS 126 Ca 0.06 0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.41 3dr4 n LYS 126 Cb 0.41 -0.92 -0.02 0.00 -1.84 0.00 0.00 35.03 32.66 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 -1.74 -1.48 -0.04 7.82 0.00 -1.23 -1.25 121.76 123.84 3dr4 s ALA 127 Ca 0.00 0.22 0.04 0.00 0.00 0.00 0.00 51.96 52.21 3dr4 s ALA 127 Cb 0.00 0.84 -0.00 0.00 0.00 0.00 0.00 23.12 23.96 3dr4 s ALA 127 CO 0.00 -0.87 -0.15 0.42 0.00 0.00 0.00 175.76 175.15 3dr4 s ILE 128 N -3.75 1.29 -0.76 0.00 1.01 0.69 -1.38 121.20 118.29 3dr4 s ILE 128 Ca 0.05 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.08 3dr4 s ILE 128 Cb -0.03 -1.11 0.19 0.00 0.01 0.00 0.00 42.46 41.51 3dr4 s ILE 128 CO -0.05 0.38 0.59 -0.32 0.00 0.00 0.00 174.94 175.54 3dr4 s MET 129 N 0.09 2.79 0.34 2.79 1.75 0.33 -0.94 119.30 126.45 3dr4 s MET 129 Ca -0.04 -3.16 -0.29 0.00 -1.25 0.00 0.00 55.69 50.95 3dr4 s MET 129 Cb -0.11 -3.69 -0.11 0.00 2.84 0.00 0.00 34.83 33.76 3dr4 s MET 129 CO 0.02 -1.25 1.45 -1.25 -0.65 0.00 0.00 175.02 173.34 3dr4 s PRO 130 N -1.14 4.19 -0.19 4.11 0.04 -1.24 -4.40 135.00 136.38 3dr4 s PRO 130 Ca 0.24 2.45 -0.01 0.00 0.04 0.00 0.00 61.00 63.72 3dr4 s PRO 130 Cb -0.09 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.43 3dr4 s PRO 130 CO -0.12 -0.45 -0.12 0.08 0.04 0.00 0.00 177.00 176.44 3dr4 s VAL 131 N -0.81 2.82 -1.11 -0.36 1.01 -1.26 -1.06 120.40 119.63 3dr4 s VAL 131 Ca 0.54 -0.70 -0.17 0.00 0.00 0.00 0.00 61.98 61.66 3dr4 s VAL 131 Cb -0.44 -2.23 0.13 0.00 0.00 0.00 0.00 36.38 33.84 3dr4 s VAL 131 CO 0.56 0.49 1.38 -1.00 0.00 0.00 0.00 175.10 176.52 3dr4 s HIS 132 N 1.17 3.19 0.28 5.22 3.76 -0.73 -4.57 115.29 123.61 3dr4 s HIS 132 Ca 0.02 -1.70 -0.29 0.00 -0.15 0.00 0.00 55.06 52.94 3dr4 s HIS 132 Cb -0.14 -4.40 -0.10 0.00 1.11 0.00 0.00 32.58 29.05 3dr4 s HIS 132 CO -0.04 -1.53 1.27 -0.51 -0.85 0.00 0.00 174.74 173.07 3dr4 s LEU 133 N 2.63 4.45 -0.23 0.89 1.43 -1.21 -3.63 118.68 123.01 3dr4 s LEU 133 Ca 0.41 2.52 0.00 0.00 -1.03 0.00 0.00 54.13 56.04 3dr4 s LEU 133 Cb -0.02 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.56 3dr4 s LEU 133 CO -0.03 -0.46 0.00 -1.22 0.23 0.00 0.00 176.35 174.87 3dr4 n TYR 134 N 1.45 0.00 0.00 0.29 4.01 -1.26 -2.20 117.16 119.46 3dr4 n TYR 134 Ca 0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.76 3dr4 n TYR 134 Cb 0.43 -1.53 0.00 0.00 -0.31 0.00 0.00 39.34 37.92 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 -0.43 1.03 3.28 2.72 0.00 -0.63 -1.35 105.19 109.81 3dr4 n GLY 135 Ca -0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 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 -0.77 3.18 0.24 1.61 0.74 -0.93 -0.93 119.66 122.79 3dr4 s GLN 136 Ca 0.00 -0.80 -0.30 0.00 0.05 0.00 0.00 55.36 54.31 3dr4 s GLN 136 Cb 0.00 -2.43 -0.09 0.00 1.10 0.00 0.00 33.01 31.59 3dr4 s GLN 136 CO 0.00 0.20 0.99 0.42 -0.55 0.00 0.00 175.29 176.35 3dr4 s ILE 137 N 0.33 3.92 1.09 -2.34 1.01 -1.26 -3.33 121.20 120.62 3dr4 s ILE 137 Ca -0.16 1.90 -0.12 0.00 0.00 0.00 0.00 60.65 62.27 3dr4 s ILE 137 Cb -0.17 -4.21 0.24 0.00 0.01 0.00 0.00 42.46 38.33 3dr4 s ILE 137 CO 0.08 0.44 1.04 0.00 0.00 0.00 0.00 174.94 176.50 3dr4 s ASP 139 N -2.47 5.88 0.29 0.00 -1.08 -1.26 -4.80 116.67 113.23 3dr4 s ASP 139 Ca 0.68 -1.63 -0.02 0.00 -0.52 0.00 0.00 52.55 51.05 3dr4 s ASP 139 Cb -0.25 -2.58 0.42 0.00 -1.46 0.00 0.00 42.92 39.06 3dr4 s ASP 139 CO 0.63 -2.13 1.92 0.24 0.52 0.00 0.00 175.17 176.35 3dr4 h MET 140 N 9.46 1.02 0.07 4.34 2.86 -1.99 -3.27 114.93 127.42 3dr4 h MET 140 Ca 0.25 -0.10 0.02 0.00 -2.06 0.00 0.00 59.70 57.81 3dr4 h MET 140 Cb 0.95 -0.21 -0.05 0.00 0.06 0.00 0.00 31.60 32.35 3dr4 h MET 140 CO 1.33 0.74 -0.51 -0.44 1.06 0.00 0.00 176.91 179.09 3dr4 h ASP 141 N 1.04 -1.55 0.29 1.22 3.32 -1.99 0.27 116.42 119.01 3dr4 h ASP 141 Ca 0.27 0.17 -0.06 0.00 0.02 0.00 0.00 57.03 57.43 3dr4 h ASP 141 Cb -0.00 0.58 -0.01 0.00 0.22 0.00 0.00 39.33 40.12 3dr4 h ASP 141 CO -0.05 -0.53 -0.27 1.55 -1.72 0.00 0.00 179.24 178.22 3dr4 h PRO 142 N -0.71 0.00 -0.24 3.56 0.13 -1.99 0.06 132.00 132.81 3dr4 h PRO 142 Ca 0.01 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.07 3dr4 h PRO 142 Cb 0.74 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 3dr4 h PRO 142 CO -0.31 0.27 -0.10 0.82 -0.23 0.00 0.00 178.00 178.45 3dr4 h ILE 143 N 0.00 1.30 -0.27 -3.56 2.04 -1.32 0.20 117.51 115.90 3dr4 h ILE 143 Ca -0.00 -1.16 -0.06 0.00 1.00 0.00 0.00 64.86 64.63 3dr4 h ILE 143 Cb 0.49 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 3dr4 h ILE 143 CO 0.04 0.36 -0.11 -0.07 0.00 0.00 0.00 178.15 178.37 3dr4 h LEU 144 N 0.22 0.42 -0.24 1.44 3.38 -0.16 -0.42 115.31 119.95 3dr4 h LEU 144 Ca 0.06 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 3dr4 h LEU 144 Cb 0.60 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 3dr4 h LEU 144 CO 0.03 0.57 -0.01 -0.08 0.09 0.00 0.00 178.44 179.04 3dr4 h GLU 145 N 0.41 0.42 -0.52 1.13 4.81 -0.46 0.17 114.58 120.55 3dr4 h GLU 145 Ca 0.08 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.15 3dr4 h GLU 145 Cb 0.45 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 3dr4 h GLU 145 CO 0.02 0.62 0.25 0.28 -0.73 0.00 0.00 179.01 179.45 3dr4 h VAL 146 N 0.19 1.20 -0.91 0.32 2.07 -0.05 -1.98 116.25 117.09 3dr4 h VAL 146 Ca 0.07 -0.56 0.03 0.00 0.82 0.00 0.00 66.70 67.05 3dr4 h VAL 146 Cb 0.43 0.61 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 3dr4 h VAL 146 CO 0.01 0.22 0.60 0.00 0.02 0.00 0.00 177.57 178.42 3dr4 h ALA 147 N 1.09 1.40 -0.37 1.67 0.00 -0.84 -2.35 119.26 119.86 3dr4 h ALA 147 Ca 0.18 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 3dr4 h ALA 147 Cb 0.12 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3dr4 h ALA 147 CO -0.02 0.52 -0.20 -0.09 0.00 0.00 0.00 179.25 179.46 3dr4 h ARG 148 N 1.16 0.79 -0.01 0.00 2.43 -0.18 0.13 114.38 118.71 3dr4 h ARG 148 Ca 0.35 -0.36 -0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3dr4 h ARG 148 Cb -0.03 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 29.50 3dr4 h ARG 148 CO -0.10 0.98 0.00 -0.09 -1.51 0.00 0.00 179.97 179.26 3dr4 h ARG 149 N 0.59 0.01 -0.37 0.20 2.43 -1.02 -2.60 114.38 113.62 3dr4 h ARG 149 Ca 0.08 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 3dr4 h ARG 149 Cb 0.75 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.30 3dr4 h ARG 149 CO 0.06 0.01 0.00 0.72 -1.51 0.00 0.00 179.97 179.25 3dr4 n HIS 150 N -4.54 0.77 -3.92 2.20 8.25 -0.92 -4.99 115.22 112.08 3dr4 n HIS 150 Ca -0.03 -0.64 -0.27 0.00 -0.26 0.00 0.00 57.72 56.52 3dr4 n HIS 150 Cb 0.09 -0.15 -0.01 0.00 1.12 0.00 0.00 29.99 31.04 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 0.28 -1.35 -4.68 0.41 5.15 -0.34 -4.97 115.26 109.76 3dr4 n ASN 151 Ca 0.17 -1.03 -0.24 0.00 -0.60 0.00 0.00 54.58 52.88 3dr4 n ASN 151 Cb 0.65 -3.02 -0.07 0.00 -0.53 0.00 0.00 39.78 36.81 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 -6.91 3.35 0.44 1.20 1.43 -0.11 -4.99 118.68 113.08 3dr4 s LEU 152 Ca 0.11 -0.50 -0.02 0.00 -1.03 0.00 0.00 54.13 52.69 3dr4 s LEU 152 Cb -0.04 -1.91 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 3dr4 s LEU 152 CO 0.89 0.02 0.69 -0.76 0.23 0.00 0.00 176.35 177.42 3dr4 s LEU 153 N -3.49 3.72 -0.10 1.79 1.43 -0.38 -4.65 118.68 117.00 3dr4 s LEU 153 Ca 0.30 0.57 0.00 0.00 -1.03 0.00 0.00 54.13 53.98 3dr4 s LEU 153 Cb -0.08 -3.46 0.02 0.00 0.03 0.00 0.00 46.19 42.70 3dr4 s LEU 153 CO 0.20 -0.57 -0.08 -0.69 0.23 0.00 0.00 176.35 175.45 3dr4 s VAL 154 N -2.58 1.00 -0.28 -1.59 1.01 -1.26 -0.22 120.40 116.48 3dr4 s VAL 154 Ca 0.46 -0.30 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 3dr4 s VAL 154 Cb -0.10 -1.00 0.02 0.00 0.00 0.00 0.00 36.38 35.29 3dr4 s VAL 154 CO 0.40 0.35 0.03 -0.51 0.00 0.00 0.00 175.10 175.38 3dr4 s ILE 155 N 1.47 3.61 -0.03 2.22 2.07 -0.12 0.74 121.20 131.16 3dr4 s ILE 155 Ca 0.00 -0.81 -0.28 0.00 -1.41 0.00 0.00 60.65 58.15 3dr4 s ILE 155 Cb -0.13 -2.86 -0.03 0.00 0.13 0.00 0.00 42.46 39.57 3dr4 s ILE 155 CO -0.05 0.11 0.91 -1.61 -1.91 0.00 0.00 174.94 172.39 3dr4 s GLU 156 N 1.44 4.51 -0.69 3.50 2.02 -0.32 -3.61 118.70 125.55 3dr4 s GLU 156 Ca 0.02 1.27 -0.19 0.00 0.02 0.00 0.00 54.97 56.09 3dr4 s GLU 156 Cb -0.17 -3.47 0.11 0.00 0.10 0.00 0.00 34.13 30.70 3dr4 s GLU 156 CO 0.00 -0.06 0.85 0.34 0.02 0.00 0.00 175.26 176.42 3dr4 s ASP 157 N 0.97 6.31 -0.27 -0.19 -1.08 -0.22 -0.97 116.67 121.22 3dr4 s ASP 157 Ca 0.48 -1.56 0.12 0.00 -0.52 0.00 0.00 52.55 51.07 3dr4 s ASP 157 Cb -0.20 -2.34 0.65 0.00 -1.46 0.00 0.00 42.92 39.58 3dr4 s ASP 157 CO 0.24 -1.14 1.64 0.00 0.52 0.00 0.00 175.17 176.44 3dr4 n ALA 158 N 6.50 4.06 -0.35 3.66 0.00 0.15 -1.78 120.51 132.75 3dr4 n ALA 158 Ca 0.00 -2.45 0.12 0.00 0.00 0.00 0.00 53.44 51.11 3dr4 n ALA 158 Cb 0.45 -1.01 0.24 0.00 0.00 0.00 0.00 19.45 19.13 3dr4 n ALA 158 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dr4 h ALA 159 N 2.23 1.00 -0.59 0.00 0.00 -1.72 0.04 119.26 120.22 3dr4 h ALA 159 Ca 0.17 0.36 0.00 0.00 0.00 0.00 0.00 54.91 55.44 3dr4 h ALA 159 Cb 1.96 0.65 0.00 0.00 0.00 0.00 0.00 17.79 20.41 3dr4 h ALA 159 CO 0.53 -0.51 0.00 0.39 0.00 0.00 0.00 179.25 179.66 3dr4 n GLU 160 N -5.54 4.05 -1.43 0.00 1.02 -1.26 -3.17 120.64 114.31 3dr4 n GLU 160 Ca 0.21 -2.83 0.03 0.00 -0.02 0.00 0.00 57.16 54.56 3dr4 n GLU 160 Cb 0.68 -2.02 0.06 0.00 -0.02 0.00 0.00 31.44 30.14 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 0.88 2.74 -1.78 0.62 0.00 0.00 -1.61 120.51 121.37 3dr4 n ALA 161 Ca 0.25 -2.63 -0.41 0.00 0.00 0.00 0.00 53.44 50.65 3dr4 n ALA 161 Cb 0.97 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.77 3dr4 n ALA 161 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3dr4 s VAL 162 N -1.16 2.05 0.00 0.00 0.11 -1.26 -1.98 120.40 118.16 3dr4 s VAL 162 Ca 0.35 0.05 0.00 0.00 -2.93 0.00 0.00 61.98 59.45 3dr4 s VAL 162 Cb 0.38 -3.03 0.00 0.00 -1.53 0.00 0.00 36.38 32.20 3dr4 s VAL 162 CO -0.13 0.01 0.00 0.61 -3.33 0.00 0.00 175.10 172.26 3dr4 n GLY 163 N 0.48 3.19 3.76 6.54 0.00 -1.26 -4.93 105.19 112.97 3dr4 n GLY 163 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.99 2.31 0.10 4.61 0.00 -0.84 -4.87 121.76 121.07 3dr4 s ALA 164 Ca 0.00 0.48 0.05 0.00 0.00 0.00 0.00 51.96 52.48 3dr4 s ALA 164 Cb 0.00 -3.32 -0.04 0.00 0.00 0.00 0.00 23.12 19.76 3dr4 s ALA 164 CO 0.00 -1.59 -0.12 0.95 0.00 0.00 0.00 175.76 175.01 3dr4 s THR 165 N -2.53 1.08 -0.08 0.00 -4.23 -1.06 -1.09 115.64 107.72 3dr4 s THR 165 Ca 0.65 -1.65 -0.03 0.00 -1.18 0.00 0.00 61.69 59.49 3dr4 s THR 165 Cb -0.20 -1.40 0.04 0.00 1.34 0.00 0.00 72.50 72.28 3dr4 s THR 165 CO 0.48 -0.49 0.10 -0.47 -0.54 0.00 0.00 174.62 173.69 3dr4 s TYR 166 N -2.28 0.02 -1.57 3.99 6.14 0.21 -2.73 117.35 121.13 3dr4 s TYR 166 Ca 0.06 0.22 -0.08 0.00 0.64 0.00 0.00 57.07 57.91 3dr4 s TYR 166 Cb -0.04 -0.47 0.07 0.00 0.42 0.00 0.00 41.96 41.95 3dr4 s TYR 166 CO 0.01 -0.29 0.50 0.54 0.64 0.00 0.00 175.55 176.95 3dr4 n ARG 167 N 5.30 -2.71 -0.79 4.97 1.74 0.36 -0.82 116.66 124.72 3dr4 n ARG 167 Ca -0.04 0.33 0.00 0.00 -0.77 0.00 0.00 57.85 57.36 3dr4 n ARG 167 Cb 0.50 -4.60 0.00 0.00 -1.02 0.00 0.00 32.46 27.34 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 -1.81 0.86 3.45 -0.13 0.00 -1.26 -5.03 105.19 101.26 3dr4 n GLY 168 Ca -0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.21 2.17 0.49 1.61 1.02 -0.00 -5.10 119.74 119.71 3dr4 s LYS 169 Ca 0.00 -0.91 -0.19 0.00 0.02 0.00 0.00 55.97 54.89 3dr4 s LYS 169 Cb 0.00 -2.22 -0.08 0.00 -0.52 0.00 0.00 37.83 35.01 3dr4 s LYS 169 CO 0.00 0.56 1.00 0.15 -0.92 0.00 0.00 175.35 176.14 3dr4 s LYS 170 N -1.20 3.91 0.61 1.68 -0.14 -1.26 0.68 119.74 124.02 3dr4 s LYS 170 Ca 0.13 1.14 -0.18 0.00 -1.36 0.00 0.00 55.97 55.71 3dr4 s LYS 170 Cb -0.10 -2.12 -0.04 0.00 -1.68 0.00 0.00 37.83 33.88 3dr4 s LYS 170 CO 0.04 -0.31 1.01 -1.13 -0.76 0.00 0.00 175.35 174.19 3dr4 n SER 171 N -1.19 0.94 0.00 2.83 3.41 -0.25 -1.85 113.62 117.51 3dr4 n SER 171 Ca 0.08 0.81 0.00 0.00 -0.26 0.00 0.00 58.87 59.49 3dr4 n SER 171 Cb 0.53 -1.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 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 1.24 2.02 0.37 5.00 0.00 -1.26 -4.85 105.19 107.71 3dr4 n GLY 172 Ca 0.14 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.20 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 2.15 -0.02 1.61 3.41 -0.77 -4.48 113.62 115.52 3dr4 n SER 173 Ca 0.00 -1.67 -0.21 0.00 -0.26 0.00 0.00 58.87 56.73 3dr4 n SER 173 Cb 0.00 -0.08 -0.13 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 0.30 2.59 0.00 1.04 4.77 -1.26 -4.99 117.00 119.45 3dr4 n LEU 174 Ca 0.06 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.24 3dr4 n LEU 174 Cb 0.28 -1.08 0.00 0.00 -2.33 0.00 0.00 43.42 40.29 3dr4 n LEU 174 CO 0.05 0.80 0.00 0.61 -1.33 0.00 0.00 177.39 177.52 3dr4 n GLY 175 N 1.95 0.67 0.23 -0.72 0.00 -1.26 -4.96 105.19 101.09 3dr4 n GLY 175 Ca -0.34 -1.93 0.08 0.00 0.00 0.00 0.00 46.02 43.83 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 0.00 0.00 -5.05 1.61 3.32 -0.06 -3.46 116.42 112.78 3dr4 h ASP 176 Ca 0.00 0.00 0.02 0.00 0.02 0.00 0.00 57.03 57.07 3dr4 h ASP 176 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3dr4 h ASP 176 CO 0.00 0.22 0.18 0.00 -1.72 0.00 0.00 179.24 177.91 3dr4 s ALA 178 N -3.50 -0.78 0.14 0.00 0.00 0.22 -1.17 121.76 116.66 3dr4 s ALA 178 Ca 0.14 -0.11 0.07 0.00 0.00 0.00 0.00 51.96 52.06 3dr4 s ALA 178 Cb -0.05 0.58 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 3dr4 s ALA 178 CO 0.09 -0.58 -0.17 0.95 0.00 0.00 0.00 175.76 176.05 3dr4 s THR 179 N -3.56 1.60 0.13 0.00 -4.23 -0.15 -0.54 115.64 108.88 3dr4 s THR 179 Ca 0.02 -1.78 0.05 0.00 -1.18 0.00 0.00 61.69 58.80 3dr4 s THR 179 Cb 0.02 -1.67 -0.04 0.00 1.34 0.00 0.00 72.50 72.15 3dr4 s THR 179 CO -0.10 -0.32 -0.11 -0.36 -0.54 0.00 0.00 174.62 173.19 3dr4 s PHE 180 N -1.96 1.25 0.05 3.99 0.40 0.27 0.32 117.98 122.31 3dr4 s PHE 180 Ca 0.11 -0.66 0.07 0.00 -0.60 0.00 0.00 56.93 55.86 3dr4 s PHE 180 Cb -0.06 -0.65 -0.03 0.00 0.51 0.00 0.00 43.02 42.79 3dr4 s PHE 180 CO 0.05 0.08 -0.19 0.45 0.70 0.00 0.00 175.22 176.31 3dr4 s SER 181 N -2.74 3.73 -0.19 1.36 0.15 -1.19 -1.96 113.70 112.86 3dr4 s SER 181 Ca 0.11 -0.45 0.13 0.00 0.70 0.00 0.00 55.95 56.43 3dr4 s SER 181 Cb -0.01 -0.57 0.43 0.00 -1.71 0.00 0.00 66.02 64.16 3dr4 s SER 181 CO 0.01 0.25 1.21 0.49 1.20 0.00 0.00 173.24 176.40 3dr4 n PHE 182 N 1.53 0.26 -0.67 3.44 3.72 0.40 -4.86 117.46 121.28 3dr4 n PHE 182 Ca -0.16 -1.43 -0.31 0.00 -0.05 0.00 0.00 57.45 55.50 3dr4 n PHE 182 Cb 0.52 -0.24 0.17 0.00 -0.94 0.00 0.00 39.48 38.99 3dr4 n PHE 182 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3dr4 n PHE 183 N -0.85 0.46 0.30 1.38 7.35 -1.26 -0.35 117.46 124.50 3dr4 n PHE 183 Ca 0.19 0.34 0.16 0.00 -0.76 0.00 0.00 57.45 57.39 3dr4 n PHE 183 Cb 0.78 -1.95 0.83 0.00 0.35 0.00 0.00 39.48 39.48 3dr4 n PHE 183 CO 0.00 0.00 0.00 0.78 -0.76 0.00 0.00 176.76 176.78 3dr4 h GLY 184 N -1.93 0.00 -0.78 7.13 0.00 -1.62 -0.89 103.07 104.98 3dr4 h GLY 184 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 3dr4 h GLY 184 CO 0.41 0.00 -0.14 1.16 0.00 0.00 0.00 176.54 177.96 3dr4 n ASN 185 N -3.04 1.88 -4.82 0.19 0.23 -1.26 -3.57 115.26 104.88 3dr4 n ASN 185 Ca -0.01 -1.49 -0.31 0.00 -0.53 0.00 0.00 54.58 52.24 3dr4 n ASN 185 Cb 0.40 0.12 0.06 0.00 -2.08 0.00 0.00 39.78 38.27 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 -2.20 2.59 0.23 -2.53 0.00 -0.34 -4.68 121.76 114.83 3dr4 s ALA 186 Ca 0.29 0.04 -0.07 0.00 0.00 0.00 0.00 51.96 52.22 3dr4 s ALA 186 Cb 0.20 -3.17 0.30 0.00 0.00 0.00 0.00 23.12 20.45 3dr4 s ALA 186 CO 0.41 -1.33 1.82 0.82 0.00 0.00 0.00 175.76 177.48 3dr4 h ILE 187 N -0.80 0.99 -3.31 0.00 2.04 -1.90 -3.37 117.51 111.15 3dr4 h ILE 187 Ca -0.44 -0.28 -0.68 0.00 1.00 0.00 0.00 64.86 64.46 3dr4 h ILE 187 Cb 1.22 0.11 -0.33 0.00 -0.74 0.00 0.00 36.82 37.08 3dr4 h ILE 187 CO 0.57 0.15 -0.88 -0.63 0.00 0.00 0.00 178.15 177.36 3dr4 s ILE 188 N -6.07 2.05 0.18 -0.67 1.01 -1.26 -4.95 121.20 111.49 3dr4 s ILE 188 Ca -0.13 -1.00 0.08 0.00 0.00 0.00 0.00 60.65 59.60 3dr4 s ILE 188 Cb 0.17 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.82 3dr4 s ILE 188 CO 0.77 0.55 -0.16 0.28 0.00 0.00 0.00 174.94 176.38 3dr4 s THR 189 N 0.45 1.78 -0.04 2.92 -1.32 -1.26 -4.47 115.64 113.71 3dr4 s THR 189 Ca -0.16 -2.05 0.05 0.00 -1.21 0.00 0.00 61.69 58.32 3dr4 s THR 189 Cb -0.17 -1.93 0.08 0.00 -1.51 0.00 0.00 72.50 68.97 3dr4 s THR 189 CO 0.06 -0.45 0.94 0.35 -2.21 0.00 0.00 174.62 173.32 3dr4 n THR 190 N -0.02 0.87 0.00 5.08 -2.24 0.53 -3.88 114.28 114.62 3dr4 n THR 190 Ca -0.11 -0.98 0.00 0.00 -2.27 0.00 0.00 64.05 60.69 3dr4 n THR 190 Cb 0.59 0.39 0.00 0.00 -2.10 0.00 0.00 70.33 69.21 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 -0.58 2.14 2.99 3.38 0.00 -1.16 -4.66 105.19 107.32 3dr4 n GLY 191 Ca 0.05 -0.28 -0.17 0.00 0.00 0.00 0.00 46.02 45.62 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 0.58 0.00 1.61 0.41 -1.26 -1.40 118.70 118.64 3dr4 s GLU 192 Ca 0.00 -0.27 0.00 0.00 -0.41 0.00 0.00 54.97 54.29 3dr4 s GLU 192 Cb 0.00 -0.55 0.00 0.00 -1.78 0.00 0.00 34.13 31.80 3dr4 s GLU 192 CO 0.00 0.15 0.00 0.41 -0.49 0.00 0.00 175.26 175.33 3dr4 n GLY 193 N 2.86 1.42 3.65 -1.39 0.00 -1.05 -4.81 105.19 105.87 3dr4 n GLY 193 Ca -0.13 -0.83 -0.11 0.00 0.00 0.00 0.00 46.02 44.95 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 0.82 -0.09 -0.02 0.00 -0.23 -0.45 107.32 107.35 3dr4 s GLY 194 Ca 0.00 -1.05 -0.22 0.00 0.00 0.00 0.00 44.72 43.45 3dr4 s GLY 194 CO 0.00 -0.62 0.52 -0.29 0.00 0.00 0.00 173.10 172.70 3dr4 s MET 195 N -2.99 0.80 -0.05 2.90 1.75 -0.83 -1.04 119.30 119.84 3dr4 s MET 195 Ca 0.22 0.27 0.04 0.00 -1.25 0.00 0.00 55.69 54.96 3dr4 s MET 195 Cb -0.03 0.37 -0.03 0.00 2.84 0.00 0.00 34.83 37.99 3dr4 s MET 195 CO 0.14 -0.20 -0.14 0.42 -0.65 0.00 0.00 175.02 174.59 3dr4 s ILE 196 N -0.78 3.07 0.04 10.11 1.01 0.04 -0.56 121.20 134.14 3dr4 s ILE 196 Ca -0.08 -0.72 0.08 0.00 0.00 0.00 0.00 60.65 59.93 3dr4 s ILE 196 Cb -0.03 -2.20 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 3dr4 s ILE 196 CO 0.05 0.59 -0.23 0.42 0.00 0.00 0.00 174.94 175.77 3dr4 s THR 197 N -0.73 1.90 0.05 2.92 -4.23 0.30 -0.55 115.64 115.30 3dr4 s THR 197 Ca 0.11 -1.29 -0.27 0.00 -1.18 0.00 0.00 61.69 59.07 3dr4 s THR 197 Cb -0.11 -1.63 0.08 0.00 1.34 0.00 0.00 72.50 72.18 3dr4 s THR 197 CO 0.01 0.29 0.73 0.28 -0.54 0.00 0.00 174.62 175.38 3dr4 s THR 198 N -0.80 0.00 -2.05 3.99 -1.32 -0.61 -0.61 115.64 114.25 3dr4 s THR 198 Ca 0.10 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.80 3dr4 s THR 198 Cb -0.09 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.90 3dr4 s THR 198 CO 0.02 0.00 1.07 0.59 -2.21 0.00 0.00 174.62 174.09 3dr4 n ASN 199 N -0.01 2.07 -4.59 8.08 3.02 -1.26 -0.55 115.26 122.02 3dr4 n ASN 199 Ca -0.15 -1.53 -0.41 0.00 -0.03 0.00 0.00 54.58 52.46 3dr4 n ASN 199 Cb 0.62 0.44 -0.07 0.00 -0.61 0.00 0.00 39.78 40.17 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 -2.38 6.46 0.19 6.41 2.15 -1.26 -4.82 116.67 123.42 3dr4 s ASP 200 Ca 0.19 0.32 -0.11 0.00 0.43 0.00 0.00 52.55 53.37 3dr4 s ASP 200 Cb 0.18 -2.33 0.18 0.00 -0.30 0.00 0.00 42.92 40.65 3dr4 s ASP 200 CO 0.54 -0.52 1.80 0.44 -0.17 0.00 0.00 175.17 177.26 3dr4 h ASP 201 N 8.29 0.49 -0.11 -0.34 5.19 -1.99 -1.19 116.42 126.76 3dr4 h ASP 201 Ca -0.27 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.16 3dr4 h ASP 201 Cb 1.12 -0.07 -0.00 0.00 0.18 0.00 0.00 39.33 40.55 3dr4 h ASP 201 CO 0.81 0.33 0.05 0.44 -3.12 0.00 0.00 179.24 177.75 3dr4 h ASP 202 N 0.62 0.14 -0.47 6.45 3.32 -2.00 -1.85 116.42 122.63 3dr4 h ASP 202 Ca 0.26 -0.13 0.03 0.00 0.02 0.00 0.00 57.03 57.21 3dr4 h ASP 202 Cb 0.13 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.61 3dr4 h ASP 202 CO -0.16 0.23 0.26 0.25 -1.72 0.00 0.00 179.24 178.10 3dr4 h LEU 203 N 0.05 0.39 -0.99 1.55 5.85 -1.90 -0.04 115.31 120.22 3dr4 h LEU 203 Ca 0.04 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 3dr4 h LEU 203 Cb 0.12 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 3dr4 h LEU 203 CO -0.00 0.28 0.58 0.00 -0.34 0.00 0.00 178.44 178.95 3dr4 h ALA 204 N 1.23 1.25 -0.29 1.25 0.00 -1.01 0.97 119.26 122.66 3dr4 h ALA 204 Ca 0.20 -0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 3dr4 h ALA 204 Cb 0.07 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3dr4 h ALA 204 CO -0.12 0.66 -0.46 0.00 0.00 0.00 0.00 179.25 179.33 3dr4 h ALA 205 N 1.34 0.63 -0.38 0.00 0.00 -0.73 0.11 119.26 120.24 3dr4 h ALA 205 Ca 0.34 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 3dr4 h ALA 205 Cb -0.07 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3dr4 h ALA 205 CO -0.07 0.67 0.09 0.87 0.00 0.00 0.00 179.25 180.82 3dr4 h LYS 206 N 0.61 0.60 -0.71 0.00 1.57 -0.51 -1.04 116.57 117.09 3dr4 h LYS 206 Ca 0.03 -0.14 -0.02 0.00 -1.87 0.00 0.00 60.65 58.65 3dr4 h LYS 206 Cb 1.03 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 33.23 3dr4 h LYS 206 CO 0.10 0.64 0.35 0.52 -0.57 0.00 0.00 179.45 180.48 3dr4 h MET 207 N 0.46 1.02 -0.23 3.15 2.86 -0.40 -0.85 114.93 120.93 3dr4 h MET 207 Ca 0.12 -0.15 -0.08 0.00 -2.06 0.00 0.00 59.70 57.53 3dr4 h MET 207 Cb 0.30 -0.18 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 3dr4 h MET 207 CO 0.00 0.80 -0.21 0.00 1.06 0.00 0.00 176.91 178.56 3dr4 h ARG 208 N 0.99 0.41 -0.13 1.72 3.08 -0.73 -0.31 114.38 119.40 3dr4 h ARG 208 Ca 0.24 -0.13 -0.06 0.00 0.07 0.00 0.00 59.98 60.10 3dr4 h ARG 208 Cb 0.11 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 3dr4 h ARG 208 CO -0.03 0.60 -0.14 1.25 -1.07 0.00 0.00 179.97 180.58 3dr4 h LEU 209 N 0.37 0.35 -0.96 3.04 5.85 -0.86 -2.68 115.31 120.43 3dr4 h LEU 209 Ca 0.06 -0.49 -0.08 0.00 0.84 0.00 0.00 57.88 58.22 3dr4 h LEU 209 Cb 0.58 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 3dr4 h LEU 209 CO 0.04 0.77 -0.07 -0.07 -0.34 0.00 0.00 178.44 178.77 3dr4 h LEU 210 N -0.06 0.66 -1.01 2.25 3.38 -1.06 -0.50 115.31 118.97 3dr4 h LEU 210 Ca 0.02 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 3dr4 h LEU 210 Cb 0.67 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 3dr4 h LEU 210 CO 0.03 0.77 0.07 -0.09 0.09 0.00 0.00 178.44 179.32 3dr4 h ARG 211 N 0.63 0.79 -1.84 1.13 2.43 -0.99 0.11 114.38 116.64 3dr4 h ARG 211 Ca 0.12 -0.18 -0.55 0.00 -0.81 0.00 0.00 59.98 58.56 3dr4 h ARG 211 Cb 0.49 -0.11 -0.20 0.00 -0.42 0.00 0.00 29.97 29.73 3dr4 h ARG 211 CO 0.03 0.75 0.60 0.41 -1.51 0.00 0.00 179.97 180.24 3dr4 n GLY 212 N -0.79 4.72 2.76 2.80 0.00 -1.02 -2.81 105.19 110.86 3dr4 n GLY 212 Ca 0.03 -1.95 -0.12 0.00 0.00 0.00 0.00 46.02 43.99 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 0.31 -1.66 -1.05 1.61 1.13 0.85 -2.19 117.38 116.38 3dr4 n GLN 213 Ca 0.49 0.91 -0.02 0.00 -1.94 0.00 0.00 57.00 56.44 3dr4 n GLN 213 Cb 0.49 -5.33 -0.01 0.00 0.11 0.00 0.00 30.24 25.50 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 0.14 0.48 3.78 1.08 0.00 -0.21 -3.91 105.19 106.55 3dr4 n GLY 214 Ca -0.12 -0.18 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.16 4.00 -0.09 1.61 1.75 -0.93 -3.33 119.30 121.16 3dr4 s MET 215 Ca 0.00 1.52 -0.30 0.00 -1.25 0.00 0.00 55.69 55.66 3dr4 s MET 215 Cb 0.00 -2.40 -0.04 0.00 2.84 0.00 0.00 34.83 35.23 3dr4 s MET 215 CO 0.00 -0.28 1.43 0.34 -0.65 0.00 0.00 175.02 175.86 3dr4 s ASP 216 N -1.64 6.83 0.65 1.11 -1.08 0.16 -4.86 116.67 117.84 3dr4 s ASP 216 Ca 0.61 1.98 0.36 0.00 -0.52 0.00 0.00 52.55 54.98 3dr4 s ASP 216 Cb -0.22 -2.54 1.96 0.00 -1.46 0.00 0.00 42.92 40.67 3dr4 s ASP 216 CO 0.27 -0.81 2.13 1.55 0.52 0.00 0.00 175.17 178.83 3dr4 h PRO 217 N 8.59 0.00 -0.27 4.34 0.13 -1.94 -2.09 132.00 140.76 3dr4 h PRO 217 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3dr4 h PRO 217 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3dr4 h PRO 217 CO 0.95 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.81 3dr4 n ASN 218 N -3.12 2.71 -3.47 1.44 3.02 -1.26 -4.87 115.26 109.72 3dr4 n ASN 218 Ca -0.02 -1.96 -0.20 0.00 -0.03 0.00 0.00 54.58 52.37 3dr4 n ASN 218 Cb 0.25 -0.18 -0.12 0.00 -0.61 0.00 0.00 39.78 39.12 3dr4 n ASN 218 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 3dr4 s ARG 219 N -0.98 0.25 0.01 3.52 3.52 -0.79 -5.10 118.95 119.37 3dr4 s ARG 219 Ca 0.19 -0.12 -0.34 0.00 -0.13 0.00 0.00 55.73 55.33 3dr4 s ARG 219 Cb 0.10 -0.97 -0.12 0.00 -1.56 0.00 0.00 34.95 32.39 3dr4 s ARG 219 CO 0.13 -0.90 1.78 -2.13 -0.81 0.00 0.00 175.30 173.37 3dr4 n ARG 220 N 5.30 2.21 -1.87 5.12 3.00 -1.26 -1.50 116.66 127.66 3dr4 n ARG 220 Ca -0.04 0.80 -0.17 0.00 -0.00 0.00 0.00 57.85 58.44 3dr4 n ARG 220 Cb 0.46 -2.63 -0.04 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 5.52 -0.36 -3.69 -0.14 4.01 -1.26 -4.99 117.16 116.25 3dr4 n TYR 221 Ca 0.20 0.00 -0.37 0.00 -0.16 0.00 0.00 57.90 57.57 3dr4 n TYR 221 Cb 0.30 -3.18 -0.12 0.00 -0.31 0.00 0.00 39.34 36.03 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 -2.74 3.14 -0.32 -0.72 -0.11 -0.56 -5.05 118.94 112.58 3dr4 s TRP 222 Ca 0.00 -0.34 -0.00 0.00 1.22 0.00 0.00 56.10 56.97 3dr4 s TRP 222 Cb 0.00 -2.30 0.07 0.00 -1.50 0.00 0.00 33.47 29.74 3dr4 s TRP 222 CO 0.00 -0.34 0.03 -0.06 -4.62 0.00 0.00 176.95 171.96 3dr4 s PHE 223 N 1.65 3.41 -0.23 5.86 0.40 -1.26 0.38 117.98 128.19 3dr4 s PHE 223 Ca 0.06 -2.25 0.24 0.00 -0.60 0.00 0.00 56.93 54.39 3dr4 s PHE 223 Cb -0.16 -2.43 0.58 0.00 0.51 0.00 0.00 43.02 41.52 3dr4 s PHE 223 CO 0.06 -0.87 1.69 -1.00 0.70 0.00 0.00 175.22 175.79 3dr4 h PRO 224 N 7.90 0.00 -4.49 0.24 0.13 -1.91 -3.46 132.00 130.40 3dr4 h PRO 224 Ca -0.16 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.73 3dr4 h PRO 224 Cb 1.05 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.04 3dr4 h PRO 224 CO 0.55 0.09 -0.55 0.96 -0.23 0.00 0.00 178.00 178.82 3dr4 s ILE 225 N -3.32 0.00 -0.19 -3.56 -4.36 -1.25 -5.12 121.20 103.41 3dr4 s ILE 225 Ca 0.05 -1.93 -0.28 0.00 -0.26 0.00 0.00 60.65 58.23 3dr4 s ILE 225 Cb 0.07 -2.47 -0.00 0.00 1.25 0.00 0.00 42.46 41.31 3dr4 s ILE 225 CO 0.65 0.00 0.96 -0.69 0.24 0.00 0.00 174.94 176.10 3dr4 s VAL 226 N -4.09 4.77 0.00 8.37 1.01 -1.26 -4.59 120.40 124.60 3dr4 s VAL 226 Ca 0.37 1.88 0.00 0.00 0.00 0.00 0.00 61.98 64.24 3dr4 s VAL 226 Cb 0.06 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.19 3dr4 s VAL 226 CO 0.13 -0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.76 3dr4 n GLY 227 N 3.35 6.27 3.28 4.51 0.00 -1.25 -4.81 105.19 116.53 3dr4 n GLY 227 Ca 0.09 -1.99 -0.15 0.00 0.00 0.00 0.00 46.02 43.96 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 0.02 1.41 -0.77 1.61 0.08 0.38 -4.81 117.98 115.89 3dr4 s PHE 228 Ca 0.00 -1.22 -0.05 0.00 0.12 0.00 0.00 56.93 55.78 3dr4 s PHE 228 Cb 0.00 -0.79 0.20 0.00 -0.57 0.00 0.00 43.02 41.85 3dr4 s PHE 228 CO 0.00 -0.41 0.64 1.21 -0.10 0.00 0.00 175.22 176.57 3dr4 s ASN 229 N -3.26 5.86 -0.13 1.36 3.84 -1.26 -0.10 114.94 121.24 3dr4 s ASN 229 Ca 0.37 -3.14 0.16 0.00 0.21 0.00 0.00 52.86 50.46 3dr4 s ASN 229 Cb 0.07 -1.96 0.29 0.00 -0.55 0.00 0.00 41.25 39.11 3dr4 s ASN 229 CO 0.12 -0.34 1.15 -1.22 -2.79 0.00 0.00 177.10 174.02 3dr4 n TYR 230 N 3.16 0.00 -2.35 0.43 4.01 -1.12 -4.96 117.16 116.33 3dr4 n TYR 230 Ca 0.14 -0.99 -0.33 0.00 -0.16 0.00 0.00 57.90 56.56 3dr4 n TYR 230 Cb 0.39 -0.16 -0.02 0.00 -0.31 0.00 0.00 39.34 39.25 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 -2.65 3.63 0.48 -0.72 0.52 -1.26 -1.55 118.95 117.41 3dr4 s ARG 231 Ca 0.30 1.27 -0.13 0.00 -0.52 0.00 0.00 55.73 56.66 3dr4 s ARG 231 Cb 0.27 -2.07 -0.07 0.00 0.52 0.00 0.00 34.95 33.60 3dr4 s ARG 231 CO 0.01 -0.56 0.90 1.41 0.02 0.00 0.00 175.30 177.08 3dr4 s MET 232 N -3.60 3.83 0.49 3.54 -2.45 -1.26 -3.90 119.30 115.96 3dr4 s MET 232 Ca 0.65 0.71 -0.00 0.00 -1.25 0.00 0.00 55.69 55.80 3dr4 s MET 232 Cb -0.16 -2.24 0.01 0.00 1.25 0.00 0.00 34.83 33.69 3dr4 s MET 232 CO 0.27 -0.21 0.73 0.95 1.05 0.00 0.00 175.02 177.81 3dr4 s THR 233 N -2.59 3.66 0.38 10.11 -4.23 -1.26 -4.26 115.64 117.45 3dr4 s THR 233 Ca 0.55 -0.46 0.09 0.00 -1.18 0.00 0.00 61.69 60.69 3dr4 s THR 233 Cb -0.10 -3.37 0.16 0.00 1.34 0.00 0.00 72.50 70.52 3dr4 s THR 233 CO 0.34 -0.28 1.91 -1.13 -0.54 0.00 0.00 174.62 174.92 3dr4 h ASN 234 N 0.24 0.27 -0.32 3.99 -1.24 -0.38 -1.72 115.58 116.43 3dr4 h ASN 234 Ca -0.45 -0.06 -0.17 0.00 0.71 0.00 0.00 56.30 56.34 3dr4 h ASN 234 Cb 1.26 -0.07 -0.00 0.00 0.73 0.00 0.00 38.32 40.24 3dr4 h ASN 234 CO 0.57 0.42 -0.44 0.40 -1.29 0.00 0.00 177.43 177.08 3dr4 h ILE 235 N 0.28 1.27 -0.41 2.57 2.04 -1.80 -0.66 117.51 120.80 3dr4 h ILE 235 Ca 0.06 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.29 3dr4 h ILE 235 Cb 0.37 1.47 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 3dr4 h ILE 235 CO 0.02 0.54 0.23 1.56 0.00 0.00 0.00 178.15 180.49 3dr4 h GLN 236 N 0.71 0.56 -0.68 2.37 4.20 -1.72 -1.73 115.11 118.83 3dr4 h GLN 236 Ca 0.04 -0.06 -0.05 0.00 0.06 0.00 0.00 58.65 58.64 3dr4 h GLN 236 Cb 1.04 -0.11 -0.03 0.00 0.30 0.00 0.00 27.48 28.67 3dr4 h GLN 236 CO 0.10 0.45 0.24 0.00 -0.67 0.00 0.00 178.83 178.95 3dr4 h ALA 237 N 1.08 1.14 -0.16 3.87 0.00 -1.22 -0.19 119.26 123.79 3dr4 h ALA 237 Ca 0.14 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3dr4 h ALA 237 Cb 0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3dr4 h ALA 237 CO -0.02 0.60 0.10 0.00 0.00 0.00 0.00 179.25 179.93 3dr4 h ALA 238 N 1.27 0.20 -0.65 0.00 0.00 -0.78 0.34 119.26 119.63 3dr4 h ALA 238 Ca 0.22 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.08 3dr4 h ALA 238 Cb 0.24 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 3dr4 h ALA 238 CO -0.01 -0.31 0.27 0.82 0.00 0.00 0.00 179.25 180.02 3dr4 h ILE 239 N 0.20 1.24 -0.54 0.00 2.04 -1.00 -1.92 117.51 117.53 3dr4 h ILE 239 Ca 0.06 -0.73 -0.03 0.00 1.00 0.00 0.00 64.86 65.16 3dr4 h ILE 239 Cb -0.01 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 3dr4 h ILE 239 CO -0.01 0.29 0.24 1.23 0.00 0.00 0.00 178.15 179.90 3dr4 h GLY 240 N 0.92 0.85 0.97 5.37 0.00 -0.50 -0.52 103.07 110.15 3dr4 h GLY 240 Ca 0.22 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 3dr4 h GLY 240 CO -0.02 0.42 0.12 -2.00 0.00 0.00 0.00 176.54 175.06 3dr4 h LEU 241 N 0.73 0.24 -0.85 3.11 5.85 -0.16 0.12 115.31 124.34 3dr4 h LEU 241 Ca 0.18 -0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.90 3dr4 h LEU 241 Cb 0.16 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 3dr4 h LEU 241 CO -0.02 0.22 0.53 0.00 -0.34 0.00 0.00 178.44 178.83 3dr4 h ALA 242 N 1.03 1.15 -0.13 1.25 0.00 -1.12 -0.96 119.26 120.47 3dr4 h ALA 242 Ca 0.07 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3dr4 h ALA 242 Cb 0.02 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3dr4 h ALA 242 CO -0.01 0.31 0.05 1.96 0.00 0.00 0.00 179.25 181.56 3dr4 h GLN 243 N 1.00 0.20 -0.33 0.00 1.08 -0.68 -2.98 115.11 113.41 3dr4 h GLN 243 Ca 0.36 -0.04 -0.02 0.00 -1.45 0.00 0.00 58.65 57.50 3dr4 h GLN 243 Cb 0.10 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 27.48 3dr4 h GLN 243 CO -0.15 0.30 0.11 1.25 -0.95 0.00 0.00 178.83 179.38 3dr4 h LEU 244 N 0.06 0.42 -2.00 1.46 5.85 -0.52 -0.27 115.31 120.31 3dr4 h LEU 244 Ca 0.04 -0.04 0.17 0.00 0.84 0.00 0.00 57.88 58.89 3dr4 h LEU 244 Cb 0.17 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 3dr4 h LEU 244 CO -0.00 0.40 0.41 -0.33 -0.34 0.00 0.00 178.44 178.58 3dr4 h GLU 245 N 0.46 0.00 -0.10 1.25 5.08 -1.02 -1.74 114.58 118.52 3dr4 h GLU 245 Ca 0.11 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.44 3dr4 h GLU 245 Cb 0.13 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.36 3dr4 h GLU 245 CO -0.01 0.00 -0.18 0.54 -1.00 0.00 0.00 179.01 178.36 3dr4 n ARG 246 N -4.36 1.71 -0.29 2.33 1.74 -0.17 -4.75 116.66 112.87 3dr4 n ARG 246 Ca 0.11 -2.97 0.09 0.00 -0.77 0.00 0.00 57.85 54.30 3dr4 n ARG 246 Cb 0.65 -1.65 0.31 0.00 -1.02 0.00 0.00 32.46 30.76 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 0.76 0.91 -0.24 1.55 3.04 -0.72 0.51 116.25 122.07 3dr4 h VAL 247 Ca 0.04 -0.29 -0.09 0.00 -1.01 0.00 0.00 66.70 65.35 3dr4 h VAL 247 Cb 1.18 -0.00 -0.01 0.00 -2.01 0.00 0.00 31.29 30.45 3dr4 h VAL 247 CO 0.10 0.15 -0.25 0.44 -1.01 0.00 0.00 177.57 177.00 3dr4 h ASP 248 N 0.84 0.45 -0.34 3.17 3.32 -1.85 0.16 116.42 122.17 3dr4 h ASP 248 Ca 0.44 -0.15 -0.13 0.00 0.02 0.00 0.00 57.03 57.21 3dr4 h ASP 248 Cb 0.53 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 3dr4 h ASP 248 CO -0.20 0.70 -0.28 -0.33 -1.72 0.00 0.00 179.24 177.41 3dr4 h GLU 249 N 0.40 0.79 -0.51 3.56 3.07 -1.60 0.31 114.58 120.59 3dr4 h GLU 249 Ca 0.06 -0.39 0.03 0.00 -0.50 0.00 0.00 59.36 58.56 3dr4 h GLU 249 Cb 0.66 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.53 3dr4 h GLU 249 CO 0.05 1.02 0.29 0.45 -1.40 0.00 0.00 179.01 179.42 3dr4 h HIS 250 N 0.57 0.54 -0.56 4.33 3.86 -0.48 0.57 115.15 123.97 3dr4 h HIS 250 Ca 0.06 0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.19 3dr4 h HIS 250 Cb 0.85 -0.17 -0.02 0.00 1.06 0.00 0.00 27.41 29.13 3dr4 h HIS 250 CO 0.07 0.29 -0.03 -0.07 0.86 0.00 0.00 177.93 179.05 3dr4 h LEU 251 N 0.57 1.00 -1.18 2.43 3.38 -0.36 -2.84 115.31 118.30 3dr4 h LEU 251 Ca 0.21 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 3dr4 h LEU 251 Cb 0.06 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 3dr4 h LEU 251 CO -0.12 1.08 0.25 0.00 0.09 0.00 0.00 178.44 179.74 3dr4 h ALA 252 N 0.96 1.36 -0.43 1.53 0.00 -0.29 -1.22 119.26 121.16 3dr4 h ALA 252 Ca 0.16 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 3dr4 h ALA 252 Cb 0.58 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 3dr4 h ALA 252 CO 0.03 0.49 -0.06 0.00 0.00 0.00 0.00 179.25 179.71 3dr4 h ALA 253 N 1.46 1.08 -0.08 0.00 0.00 -0.72 -1.93 119.26 119.07 3dr4 h ALA 253 Ca 0.20 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 3dr4 h ALA 253 Cb 0.13 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3dr4 h ALA 253 CO -0.02 0.57 -0.55 0.00 0.00 0.00 0.00 179.25 179.25 3dr4 h ARG 254 N 0.69 0.23 -0.29 0.00 3.08 -1.04 -2.29 114.38 114.77 3dr4 h ARG 254 Ca 0.13 -0.14 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 3dr4 h ARG 254 Cb 0.51 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 3dr4 h ARG 254 CO 0.03 0.72 0.06 0.93 -1.07 0.00 0.00 179.97 180.64 3dr4 h GLU 255 N 0.18 0.41 -0.33 0.04 5.08 -0.88 0.69 114.58 119.77 3dr4 h GLU 255 Ca 0.00 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.20 3dr4 h GLU 255 Cb 1.02 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 3dr4 h GLU 255 CO 0.08 0.39 -0.17 -0.09 -1.00 0.00 0.00 179.01 178.23 3dr4 h ARG 256 N 0.41 0.70 -0.33 2.33 2.43 -1.10 0.27 114.38 119.09 3dr4 h ARG 256 Ca 0.10 -0.31 -0.00 0.00 -0.81 0.00 0.00 59.98 58.95 3dr4 h ARG 256 Cb 0.17 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.69 3dr4 h ARG 256 CO -0.00 0.91 0.19 0.28 -1.51 0.00 0.00 179.97 179.84 3dr4 h VAL 257 N 0.48 1.13 -0.75 0.20 2.07 -0.90 -1.43 116.25 117.04 3dr4 h VAL 257 Ca 0.07 -0.31 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 3dr4 h VAL 257 Cb 0.70 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 3dr4 h VAL 257 CO 0.05 0.13 0.32 0.58 0.02 0.00 0.00 177.57 178.67 3dr4 h VAL 258 N 0.42 1.25 -0.71 2.57 2.07 -0.80 -1.39 116.25 119.67 3dr4 h VAL 258 Ca 0.12 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.89 3dr4 h VAL 258 Cb 0.04 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 30.12 3dr4 h VAL 258 CO -0.02 0.31 0.47 1.23 0.02 0.00 0.00 177.57 179.58 3dr4 h GLY 259 N 1.07 1.00 0.99 2.17 0.00 -0.63 0.12 103.07 107.79 3dr4 h GLY 259 Ca 0.25 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 3dr4 h GLY 259 CO -0.03 0.36 0.25 1.49 0.00 0.00 0.00 176.54 178.61 3dr4 h TRP 260 N 0.95 0.52 -0.20 5.60 6.55 -0.67 0.66 115.95 129.35 3dr4 h TRP 260 Ca 0.26 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.11 3dr4 h TRP 260 Cb -0.10 -0.17 -0.01 0.00 -0.86 0.00 0.00 29.16 28.02 3dr4 h TRP 260 CO -0.03 0.35 0.13 1.88 -1.05 0.00 0.00 178.44 179.73 3dr4 h TYR 261 N 0.53 0.25 -0.42 0.49 0.05 -0.65 -2.66 116.97 114.56 3dr4 h TYR 261 Ca 0.14 0.01 -0.04 0.00 0.05 0.00 0.00 58.73 58.89 3dr4 h TYR 261 Cb -0.02 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.61 3dr4 h TYR 261 CO -0.04 0.16 0.08 0.93 -1.05 0.00 0.00 178.16 178.23 3dr4 h GLU 262 N 0.27 0.63 -0.00 4.88 4.39 -0.48 -1.45 114.58 122.82 3dr4 h GLU 262 Ca 0.07 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.65 3dr4 h GLU 262 Cb -0.03 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.52 3dr4 h GLU 262 CO -0.02 0.60 -0.17 0.00 -1.16 0.00 0.00 179.01 178.26 3dr4 n GLN 263 N -4.30 0.34 0.00 2.33 10.64 0.20 -3.63 117.38 122.95 3dr4 n GLN 263 Ca 0.03 -0.11 0.07 0.00 -1.83 0.00 0.00 57.00 55.15 3dr4 n GLN 263 Cb 0.22 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.10 3dr4 n GLN 263 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 3dr4 n LYS 264 N -1.23 1.78 0.27 2.61 5.02 -0.85 -4.78 118.16 120.98 3dr4 n LYS 264 Ca 0.10 -0.76 0.14 0.00 -2.02 0.00 0.00 58.31 55.77 3dr4 n LYS 264 Cb 0.31 -1.22 0.74 0.00 -0.02 0.00 0.00 35.03 34.84 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 1.62 0.00 -2.23 -0.35 5.85 -1.35 -2.73 115.31 116.12 3dr4 h LEU 265 Ca 0.00 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.77 3dr4 h LEU 265 Cb 0.49 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 3dr4 h LEU 265 CO 0.00 0.11 0.17 0.00 -0.34 0.00 0.00 178.44 178.38 3dr4 h ALA 266 N 1.89 1.82 -0.18 1.25 0.00 -1.86 0.52 119.26 122.71 3dr4 h ALA 266 Ca -0.00 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.96 3dr4 h ALA 266 Cb 0.36 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3dr4 h ALA 266 CO 0.01 -0.25 0.21 -0.09 0.00 0.00 0.00 179.25 179.13 3dr4 h ARG 267 N 0.00 0.00 0.00 0.00 2.43 -1.87 -1.30 114.38 113.64 3dr4 h ARG 267 Ca 0.08 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 3dr4 h ARG 267 Cb 0.42 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 3dr4 h ARG 267 CO -0.00 0.00 -1.16 1.28 -1.51 0.00 0.00 179.97 178.58 3dr4 n LEU 268 N -3.73 0.57 0.00 3.80 4.77 0.18 -4.96 117.00 117.64 3dr4 n LEU 268 Ca 0.02 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 3dr4 n LEU 268 Cb 0.33 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3dr4 n LEU 268 CO 0.26 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 3dr4 n GLY 269 N 1.33 1.20 0.00 -0.72 0.00 -0.49 -2.22 105.19 104.28 3dr4 n GLY 269 Ca 0.01 -0.58 0.03 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.68 0.00 0.13 1.61 6.94 -1.26 -3.50 115.26 116.49 3dr4 n ASN 270 Ca 0.00 -1.48 0.12 0.00 -0.02 0.00 0.00 54.58 53.20 3dr4 n ASN 270 Cb 0.00 0.00 0.48 0.00 -2.36 0.00 0.00 39.78 37.90 3dr4 n ASN 270 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3dr4 n ARG 271 N -0.61 0.19 -4.07 -3.83 1.74 -0.94 -4.49 116.66 104.64 3dr4 n ARG 271 Ca 0.05 0.42 -0.07 0.00 -0.77 0.00 0.00 57.85 57.47 3dr4 n ARG 271 Cb 0.02 -1.86 -0.10 0.00 -1.02 0.00 0.00 32.46 29.50 3dr4 n ARG 271 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 3dr4 s VAL 272 N -3.30 0.20 -0.18 1.55 -7.23 -1.23 -1.43 120.40 108.78 3dr4 s VAL 272 Ca 0.04 -1.76 -0.01 0.00 -1.81 0.00 0.00 61.98 58.45 3dr4 s VAL 272 Cb 0.09 -1.55 0.00 0.00 0.56 0.00 0.00 36.38 35.48 3dr4 s VAL 272 CO 0.39 -0.91 -0.14 -0.89 -0.31 0.00 0.00 175.10 173.24 3dr4 s THR 273 N -3.93 2.64 0.67 5.32 2.01 0.24 -4.86 115.64 117.73 3dr4 s THR 273 Ca 0.08 -0.76 -0.13 0.00 0.31 0.00 0.00 61.69 61.20 3dr4 s THR 273 Cb 0.08 -2.14 0.00 0.00 0.01 0.00 0.00 72.50 70.45 3dr4 s THR 273 CO -0.09 0.50 1.08 -1.59 -0.69 0.00 0.00 174.62 173.83 3dr4 s LYS 274 N 1.14 2.87 0.02 4.92 -2.85 -1.26 -1.27 119.74 123.30 3dr4 s LYS 274 Ca 0.01 1.16 -0.30 0.00 -1.00 0.00 0.00 55.97 55.84 3dr4 s LYS 274 Cb -0.14 -1.97 -0.08 0.00 -2.06 0.00 0.00 37.83 33.58 3dr4 s LYS 274 CO -0.05 -1.17 1.79 -1.25 0.10 0.00 0.00 175.35 174.77 3dr4 s PRO 275 N -4.53 4.17 0.31 1.78 0.04 -1.22 -4.88 135.00 130.66 3dr4 s PRO 275 Ca 0.62 2.41 -0.29 0.00 0.04 0.00 0.00 61.00 63.78 3dr4 s PRO 275 Cb -0.17 -3.95 -0.10 0.00 0.04 0.00 0.00 34.50 30.33 3dr4 s PRO 275 CO 0.47 -0.87 1.21 -1.58 0.04 0.00 0.00 177.00 176.27 3dr4 s HIS 276 N 3.83 3.29 -0.32 0.56 2.46 -1.26 -5.01 115.29 118.85 3dr4 s HIS 276 Ca 0.80 1.55 -0.06 0.00 0.47 0.00 0.00 55.06 57.82 3dr4 s HIS 276 Cb -0.39 -3.49 0.03 0.00 -0.13 0.00 0.00 32.58 28.60 3dr4 s HIS 276 CO 0.35 -1.24 0.08 0.08 -2.47 0.00 0.00 174.74 171.54 3dr4 s VAL 277 N -1.16 3.66 0.43 0.89 1.01 -1.26 -4.76 120.40 119.21 3dr4 s VAL 277 Ca 0.47 -1.08 -0.25 0.00 0.00 0.00 0.00 61.98 61.11 3dr4 s VAL 277 Cb -0.36 -3.03 -0.08 0.00 0.00 0.00 0.00 36.38 32.91 3dr4 s VAL 277 CO 0.47 -0.10 1.29 0.00 0.00 0.00 0.00 175.10 176.76 3dr4 s ALA 278 N 1.39 3.16 -0.40 5.51 0.00 -1.26 -4.92 121.76 125.25 3dr4 s ALA 278 Ca -0.01 1.21 0.03 0.00 0.00 0.00 0.00 51.96 53.19 3dr4 s ALA 278 Cb -0.19 -3.48 0.29 0.00 0.00 0.00 0.00 23.12 19.74 3dr4 s ALA 278 CO 0.02 -0.88 1.20 1.28 0.00 0.00 0.00 175.76 177.38 3dr4 n LEU 279 N -0.11 3.78 -0.10 0.00 4.77 -1.26 -4.31 117.00 119.76 3dr4 n LEU 279 Ca 0.05 -1.95 0.13 0.00 -0.03 0.00 0.00 56.01 54.21 3dr4 n LEU 279 Cb 0.44 -0.61 0.37 0.00 -2.33 0.00 0.00 43.42 41.30 3dr4 n LEU 279 CO 0.54 0.58 0.62 0.35 -1.33 0.00 0.00 177.39 178.15 3dr4 n THR 280 N 0.02 0.00 -3.68 -5.08 -2.24 -1.26 -5.00 114.28 97.04 3dr4 n THR 280 Ca 0.18 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 3dr4 n THR 280 Cb 0.82 0.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 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 1.41 -1.17 3.72 3.38 0.00 -1.25 0.14 105.19 111.43 3dr4 n GLY 281 Ca 0.09 -1.06 -0.42 0.00 0.00 0.00 0.00 46.02 44.63 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 -1.36 4.50 -0.34 1.61 3.52 -1.11 -4.82 118.95 120.95 3dr4 s ARG 282 Ca 0.00 1.66 -0.16 0.00 -0.13 0.00 0.00 55.73 57.11 3dr4 s ARG 282 Cb 0.00 -3.36 -0.01 0.00 -1.56 0.00 0.00 34.95 30.02 3dr4 s ARG 282 CO 0.00 -0.13 0.39 -1.58 -0.81 0.00 0.00 175.30 173.17 3dr4 s HIS 283 N 0.77 3.21 -1.83 5.12 5.65 -1.26 -2.57 115.29 124.38 3dr4 s HIS 283 Ca 0.55 0.02 0.29 0.00 0.25 0.00 0.00 55.06 56.17 3dr4 s HIS 283 Cb -0.27 -2.71 1.31 0.00 -1.18 0.00 0.00 32.58 29.73 3dr4 s HIS 283 CO 0.30 -0.45 1.90 1.33 -0.65 0.00 0.00 174.74 177.18 3dr4 n VAL 284 N 5.27 0.00 -3.65 0.89 0.24 -0.11 -4.98 118.33 115.99 3dr4 n VAL 284 Ca -0.08 -0.08 -0.26 0.00 -2.04 0.00 0.00 64.34 61.87 3dr4 n VAL 284 Cb 0.49 -0.08 0.04 0.00 -1.47 0.00 0.00 33.84 32.83 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 -0.80 -1.96 -0.27 6.34 3.72 -1.23 -4.85 117.46 118.40 3dr4 n PHE 285 Ca 0.17 0.62 -0.02 0.00 -0.05 0.00 0.00 57.45 58.17 3dr4 n PHE 285 Cb 0.26 -3.77 0.16 0.00 -0.94 0.00 0.00 39.48 35.18 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 -1.77 1.10 -3.70 1.38 7.01 -1.45 -3.41 115.95 115.12 3dr4 h TRP 286 Ca -0.64 -0.01 -0.22 0.00 2.11 0.00 0.00 58.89 60.12 3dr4 h TRP 286 Cb 1.35 -0.36 -0.27 0.00 -2.10 0.00 0.00 29.16 27.78 3dr4 h TRP 286 CO 0.37 0.75 -0.69 -1.64 -2.79 0.00 0.00 178.44 174.44 3dr4 s MET 287 N -5.79 0.05 -0.41 2.65 -1.94 -1.20 -4.79 119.30 107.87 3dr4 s MET 287 Ca -0.12 -0.01 -0.21 0.00 -1.71 0.00 0.00 55.69 53.64 3dr4 s MET 287 Cb 0.17 0.02 0.02 0.00 2.01 0.00 0.00 34.83 37.05 3dr4 s MET 287 CO 0.81 -0.01 0.67 -0.47 -0.01 0.00 0.00 175.02 176.01 3dr4 s TYR 288 N -0.09 3.08 -0.18 -0.03 5.04 -1.26 -4.87 117.35 119.04 3dr4 s TYR 288 Ca -0.01 0.14 -0.01 0.00 -2.44 0.00 0.00 57.07 54.75 3dr4 s TYR 288 Cb -0.01 -3.33 0.00 0.00 0.35 0.00 0.00 41.96 38.98 3dr4 s TYR 288 CO -0.00 -0.80 -0.14 0.99 -1.34 0.00 0.00 175.55 174.26 3dr4 s THR 289 N 2.86 2.65 0.32 4.34 2.01 -1.26 -0.77 115.64 125.80 3dr4 s THR 289 Ca 0.25 -0.75 0.07 0.00 0.31 0.00 0.00 61.69 61.57 3dr4 s THR 289 Cb -0.14 -2.15 -0.03 0.00 0.01 0.00 0.00 72.50 70.20 3dr4 s THR 289 CO 0.18 0.50 0.31 0.68 -0.69 0.00 0.00 174.62 175.59 3dr4 s VAL 290 N 1.17 3.74 -0.16 3.82 -7.23 -0.02 -3.43 120.40 118.29 3dr4 s VAL 290 Ca 0.01 -1.32 -0.01 0.00 -1.81 0.00 0.00 61.98 58.86 3dr4 s VAL 290 Cb -0.14 -3.25 -0.01 0.00 0.56 0.00 0.00 36.38 33.54 3dr4 s VAL 290 CO -0.06 -0.19 -0.13 -0.13 -0.31 0.00 0.00 175.10 174.28 3dr4 s ARG 291 N -4.00 3.30 0.31 4.82 0.52 -0.40 -1.16 118.95 122.34 3dr4 s ARG 291 Ca 0.40 -0.71 -0.27 0.00 -0.52 0.00 0.00 55.73 54.64 3dr4 s ARG 291 Cb -0.07 -2.69 -0.09 0.00 0.52 0.00 0.00 34.95 32.62 3dr4 s ARG 291 CO 0.27 0.04 0.99 -0.51 0.02 0.00 0.00 175.30 176.11 3dr4 s LEU 292 N 0.78 4.40 0.20 2.53 1.43 -0.37 0.81 118.68 128.47 3dr4 s LEU 292 Ca -0.05 1.97 -0.32 0.00 -1.03 0.00 0.00 54.13 54.71 3dr4 s LEU 292 Cb -0.15 -3.90 -0.11 0.00 0.03 0.00 0.00 46.19 42.06 3dr4 s LEU 292 CO 0.01 -0.11 1.64 -0.83 0.23 0.00 0.00 176.35 177.29 3dr4 s GLY 293 N -1.39 1.48 0.58 -3.19 0.00 -0.52 -4.86 107.32 99.42 3dr4 s GLY 293 Ca 0.49 1.50 0.35 0.00 0.00 0.00 0.00 44.72 47.06 3dr4 s GLY 293 CO 0.29 2.73 2.15 0.83 0.00 0.00 0.00 173.10 179.10 3dr4 h GLU 294 N 6.50 0.00 0.00 2.90 5.08 -1.92 -0.87 114.58 126.28 3dr4 h GLU 294 Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 3dr4 h GLU 294 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.45 3dr4 h GLU 294 CO 0.92 0.05 0.00 0.41 -1.00 0.00 0.00 179.01 179.38 3dr4 n GLY 295 N -0.61 -0.75 3.84 -3.84 0.00 -1.26 -4.78 105.19 97.79 3dr4 n GLY 295 Ca -0.02 0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 3dr4 n GLY 295 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dr4 s LEU 296 N -3.50 3.78 0.03 0.99 1.43 -0.33 -5.00 118.68 116.08 3dr4 s LEU 296 Ca 0.01 1.49 -0.04 0.00 -1.03 0.00 0.00 54.13 54.57 3dr4 s LEU 296 Cb 0.04 -4.39 -0.28 0.00 0.03 0.00 0.00 46.19 41.59 3dr4 s LEU 296 CO 0.13 -0.46 0.94 -1.28 0.23 0.00 0.00 176.35 175.92 3dr4 h SER 297 N 1.36 0.41 -4.40 2.29 0.87 -1.82 -3.46 113.55 108.80 3dr4 h SER 297 Ca -0.47 -0.52 -0.46 0.00 -1.23 0.00 0.00 61.79 59.10 3dr4 h SER 297 Cb 1.18 -0.13 0.12 0.00 -0.44 0.00 0.00 62.40 63.13 3dr4 h SER 297 CO 0.62 1.42 0.35 0.28 -0.53 0.00 0.00 176.83 178.97 3dr4 s THR 298 N -2.63 2.00 0.29 2.23 -1.32 -1.26 -5.08 115.64 109.87 3dr4 s THR 298 Ca -0.07 0.00 0.09 0.00 -1.21 0.00 0.00 61.69 60.49 3dr4 s THR 298 Cb 0.07 -2.86 -0.04 0.00 -1.51 0.00 0.00 72.50 68.16 3dr4 s THR 298 CO 0.86 0.00 0.07 0.42 -2.21 0.00 0.00 174.62 173.77 3dr4 s THR 299 N -3.41 3.43 0.21 5.08 -4.23 -1.26 -5.00 115.64 110.46 3dr4 s THR 299 Ca 0.63 -1.77 -0.09 0.00 -1.18 0.00 0.00 61.69 59.27 3dr4 s THR 299 Cb -0.13 -2.96 0.14 0.00 1.34 0.00 0.00 72.50 70.89 3dr4 s THR 299 CO 0.51 -0.31 1.79 -0.09 -0.54 0.00 0.00 174.62 175.99 3dr4 h ARG 300 N 1.72 0.59 -0.41 3.99 1.12 -1.93 0.21 114.38 119.67 3dr4 h ARG 300 Ca -0.45 -0.04 -0.07 0.00 -1.11 0.00 0.00 59.98 58.32 3dr4 h ARG 300 Cb 1.25 -0.13 -0.02 0.00 -0.01 0.00 0.00 29.97 31.06 3dr4 h ARG 300 CO 0.61 0.39 -0.05 -0.44 -3.11 0.00 0.00 179.97 177.38 3dr4 h ASP 301 N 0.61 0.66 -0.45 -3.80 3.32 -1.95 -1.93 116.42 112.87 3dr4 h ASP 301 Ca 0.30 -0.16 -0.07 0.00 0.02 0.00 0.00 57.03 57.11 3dr4 h ASP 301 Cb 0.23 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 3dr4 h ASP 301 CO -0.21 0.76 -0.00 -0.61 -1.72 0.00 0.00 179.24 177.46 3dr4 h GLN 302 N 0.63 0.80 -0.62 3.56 5.75 -1.18 -2.57 115.11 121.48 3dr4 h GLN 302 Ca 0.12 -0.26 0.09 0.00 -0.15 0.00 0.00 58.65 58.45 3dr4 h GLN 302 Cb 0.47 -0.07 -0.07 0.00 1.07 0.00 0.00 27.48 28.88 3dr4 h GLN 302 CO 0.02 0.86 0.26 0.28 -2.65 0.00 0.00 178.83 177.60 3dr4 h VAL 303 N 0.64 0.81 -0.71 2.39 2.07 -0.39 0.72 116.25 121.78 3dr4 h VAL 303 Ca 0.13 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.51 3dr4 h VAL 303 Cb 0.50 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.54 3dr4 h VAL 303 CO 0.02 0.08 0.47 0.40 0.02 0.00 0.00 177.57 178.57 3dr4 h ILE 304 N 0.46 1.15 -0.16 4.57 2.04 -1.15 0.14 117.51 124.57 3dr4 h ILE 304 Ca 0.31 -0.32 -0.05 0.00 1.00 0.00 0.00 64.86 65.80 3dr4 h ILE 304 Cb 0.35 0.15 -0.00 0.00 -0.74 0.00 0.00 36.82 36.57 3dr4 h ILE 304 CO -0.28 0.17 -0.11 0.11 0.00 0.00 0.00 178.15 178.04 3dr4 h LYS 305 N 0.92 0.35 -0.74 2.37 1.57 -0.38 -1.21 116.57 119.45 3dr4 h LYS 305 Ca 0.27 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.85 3dr4 h LYS 305 Cb -0.05 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 3dr4 h LYS 305 CO -0.07 0.70 0.35 -0.44 -0.57 0.00 0.00 179.45 179.42 3dr4 h ASP 306 N 0.01 0.97 -0.26 0.86 3.32 0.86 -1.01 116.42 121.18 3dr4 h ASP 306 Ca 0.03 -0.14 -0.08 0.00 0.02 0.00 0.00 57.03 56.86 3dr4 h ASP 306 Cb 0.61 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 3dr4 h ASP 306 CO 0.03 0.83 -0.10 -0.07 -1.72 0.00 0.00 179.24 178.21 3dr4 h LEU 307 N 1.04 0.64 -0.61 1.55 3.38 -0.70 -1.76 115.31 118.84 3dr4 h LEU 307 Ca 0.25 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 3dr4 h LEU 307 Cb 0.13 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3dr4 h LEU 307 CO -0.03 0.77 0.37 -0.78 0.09 0.00 0.00 178.44 178.87 3dr4 h ASP 308 N 0.60 0.73 0.10 -0.43 3.58 -0.73 0.40 116.42 120.67 3dr4 h ASP 308 Ca 0.11 -0.05 -0.02 0.00 0.42 0.00 0.00 57.03 57.49 3dr4 h ASP 308 Cb 0.53 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 41.39 3dr4 h ASP 308 CO 0.03 0.57 -0.07 0.00 -2.88 0.00 0.00 179.24 176.89 3dr4 h ALA 309 N 1.19 1.71 -0.09 -0.78 0.00 -0.71 0.20 119.26 120.79 3dr4 h ALA 309 Ca 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3dr4 h ALA 309 Cb -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3dr4 h ALA 309 CO -0.04 0.09 0.00 1.28 0.00 0.00 0.00 179.25 180.58 3dr4 n LEU 310 N -4.21 0.82 0.00 0.00 4.77 0.31 -4.87 117.00 113.82 3dr4 n LEU 310 Ca -0.03 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 3dr4 n LEU 310 Cb 0.16 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 3dr4 n LEU 310 CO 0.33 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.17 3dr4 n GLY 311 N 0.94 0.68 3.01 -0.72 0.00 0.70 -5.00 105.19 104.81 3dr4 n GLY 311 Ca 0.14 -0.72 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.00 1.62 0.52 -0.61 1.01 0.11 -0.94 121.20 120.92 3dr4 s ILE 312 Ca 0.00 -0.85 -0.19 0.00 0.00 0.00 0.00 60.65 59.61 3dr4 s ILE 312 Cb 0.00 -1.62 -0.07 0.00 0.01 0.00 0.00 42.46 40.78 3dr4 s ILE 312 CO 0.00 0.30 1.06 -0.70 0.00 0.00 0.00 174.94 175.60 3dr4 s GLU 313 N 1.43 3.61 0.26 2.79 2.12 0.03 -2.97 118.70 125.98 3dr4 s GLU 313 Ca 0.02 1.39 -0.21 0.00 0.36 0.00 0.00 54.97 56.52 3dr4 s GLU 313 Cb -0.15 -2.06 0.03 0.00 0.26 0.00 0.00 34.13 32.21 3dr4 s GLU 313 CO -0.09 -0.59 0.77 -1.54 -0.54 0.00 0.00 175.26 173.26 3dr4 s SER 314 N -2.07 -0.22 0.04 -1.70 1.04 -1.26 -4.25 113.70 105.27 3dr4 s SER 314 Ca 0.68 -0.61 0.01 0.00 0.48 0.00 0.00 55.95 56.51 3dr4 s SER 314 Cb -0.18 0.69 -0.03 0.00 0.10 0.00 0.00 66.02 66.61 3dr4 s SER 314 CO 0.24 -1.29 -0.06 -0.13 0.98 0.00 0.00 173.24 172.99 3dr4 s ARG 315 N -3.66 0.49 0.39 4.02 1.81 -1.06 -5.01 118.95 115.92 3dr4 s ARG 315 Ca 0.12 -0.81 -0.17 0.00 -1.72 0.00 0.00 55.73 53.14 3dr4 s ARG 315 Cb -0.05 -0.10 -0.10 0.00 -0.45 0.00 0.00 34.95 34.26 3dr4 s ARG 315 CO 0.06 -0.01 0.85 -1.25 -0.68 0.00 0.00 175.30 174.27 3dr4 s PRO 316 N -2.00 4.08 0.60 3.54 0.04 -1.26 -0.04 135.00 139.95 3dr4 s PRO 316 Ca -0.08 0.86 -0.19 0.00 0.04 0.00 0.00 61.00 61.63 3dr4 s PRO 316 Cb -0.07 -2.30 -0.03 0.00 0.04 0.00 0.00 34.50 32.14 3dr4 s PRO 316 CO -0.02 0.04 1.25 0.08 0.04 0.00 0.00 177.00 178.39 3dr4 s VAL 317 N -2.14 2.42 0.54 -0.36 1.01 -0.70 -4.73 120.40 116.45 3dr4 s VAL 317 Ca 0.58 0.27 -0.20 0.00 0.00 0.00 0.00 61.98 62.63 3dr4 s VAL 317 Cb -0.10 -3.11 -0.08 0.00 0.00 0.00 0.00 36.38 33.09 3dr4 s VAL 317 CO 0.17 -0.05 0.74 0.49 0.00 0.00 0.00 175.10 176.46 3dr4 n PHE 318 N -1.57 0.11 -2.49 5.22 3.72 -1.26 -4.76 117.46 116.43 3dr4 n PHE 318 Ca 0.14 0.47 -0.42 0.00 -0.05 0.00 0.00 57.45 57.59 3dr4 n PHE 318 Cb 0.49 -2.06 -0.03 0.00 -0.94 0.00 0.00 39.48 36.94 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 -1.56 3.44 0.53 1.38 3.76 -1.26 -4.33 115.29 117.26 3dr4 s HIS 319 Ca 0.70 1.37 -0.22 0.00 -0.15 0.00 0.00 55.06 56.75 3dr4 s HIS 319 Cb -0.47 -3.36 -0.05 0.00 1.11 0.00 0.00 32.58 29.81 3dr4 s HIS 319 CO 0.53 -1.01 1.34 -2.30 -0.85 0.00 0.00 174.74 172.44 3dr4 n PRO 320 N 4.16 1.71 -0.28 8.40 -0.02 -1.26 -4.77 135.00 142.94 3dr4 n PRO 320 Ca 0.09 0.63 0.10 0.00 -2.02 0.00 0.00 63.50 62.29 3dr4 n PRO 320 Cb 0.47 -2.54 0.24 0.00 -0.02 0.00 0.00 33.50 31.65 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 1.49 0.16 0.00 -0.52 2.86 -1.02 -2.17 114.93 115.74 3dr4 h MET 321 Ca -0.50 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.13 3dr4 h MET 321 Cb 1.30 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.93 3dr4 h MET 321 CO 0.57 0.10 0.00 -2.39 1.06 0.00 0.00 176.91 176.26 3dr4 n HIS 322 N -5.28 0.00 1.02 -0.22 1.44 -1.26 -2.13 115.22 108.79 3dr4 n HIS 322 Ca 0.18 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 56.00 3dr4 n HIS 322 Cb 0.60 -0.45 0.01 0.00 0.12 0.00 0.00 29.99 30.26 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 -1.45 0.00 -3.76 0.61 -5.35 -0.82 -3.92 119.36 104.67 3dr4 n ILE 323 Ca 0.04 -0.08 -0.29 0.00 -0.27 0.00 0.00 62.75 62.14 3dr4 n ILE 323 Cb 0.15 0.92 -0.04 0.00 -1.74 0.00 0.00 39.64 38.92 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 -2.81 3.52 0.25 6.28 -1.94 -0.91 -4.89 119.30 118.81 3dr4 s MET 324 Ca 0.13 -0.31 -0.05 0.00 -1.71 0.00 0.00 55.69 53.74 3dr4 s MET 324 Cb 0.17 -2.90 0.48 0.00 2.01 0.00 0.00 34.83 34.59 3dr4 s MET 324 CO 0.73 0.48 1.66 -1.35 -0.01 0.00 0.00 175.02 176.53 3dr4 h PRO 325 N 2.49 0.19 0.00 2.03 0.11 -1.92 0.29 132.00 135.18 3dr4 h PRO 325 Ca -0.47 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.61 3dr4 h PRO 325 Cb 1.18 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3dr4 h PRO 325 CO 0.71 0.12 -0.08 -1.35 -0.21 0.00 0.00 178.00 177.19 3dr4 h PRO 326 N 0.19 0.00 0.00 1.05 0.11 -1.95 -3.21 132.00 128.19 3dr4 h PRO 326 Ca 0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.54 3dr4 h PRO 326 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 3dr4 h PRO 326 CO -0.58 0.08 -0.11 0.66 -0.21 0.00 0.00 178.00 177.84 3dr4 n TYR 327 N -3.53 0.00 0.24 0.65 4.01 -0.55 -4.70 117.16 113.28 3dr4 n TYR 327 Ca -0.02 -0.42 0.07 0.00 -0.16 0.00 0.00 57.90 57.38 3dr4 n TYR 327 Cb 0.21 -0.07 0.58 0.00 -0.31 0.00 0.00 39.34 39.76 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 1.68 0.00 -0.72 0.00 -0.99 0.11 119.26 119.34 3dr4 h ALA 328 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3dr4 h ALA 328 Cb 0.95 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3dr4 h ALA 328 CO 0.00 0.17 0.00 -2.39 0.00 0.00 0.00 179.25 177.03 3dr4 n HIS 329 N -4.23 0.00 0.02 0.00 1.44 -1.26 -1.87 115.22 109.31 3dr4 n HIS 329 Ca -0.02 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.77 3dr4 n HIS 329 Cb 0.21 -0.19 0.18 0.00 0.12 0.00 0.00 29.99 30.31 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 -1.19 3.05 -4.76 2.39 4.77 0.37 -5.02 117.00 116.62 3dr4 n LEU 330 Ca 0.09 -1.70 -0.40 0.00 -0.03 0.00 0.00 56.01 53.97 3dr4 n LEU 330 Cb 0.10 -0.24 0.02 0.00 -2.33 0.00 0.00 43.42 40.97 3dr4 n LEU 330 CO 0.11 0.71 1.06 0.00 -1.33 0.00 0.00 177.39 177.94 3dr4 s ALA 331 N -1.11 3.19 0.32 -1.18 0.00 -0.78 -4.73 121.76 117.46 3dr4 s ALA 331 Ca 0.29 1.45 0.03 0.00 0.00 0.00 0.00 51.96 53.74 3dr4 s ALA 331 Cb 0.16 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 3dr4 s ALA 331 CO 0.22 -1.22 0.13 0.95 0.00 0.00 0.00 175.76 175.84 3dr4 s THR 332 N -1.21 0.50 -2.17 0.00 -4.23 -1.26 -5.04 115.64 102.23 3dr4 s THR 332 Ca 0.62 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 59.33 3dr4 s THR 332 Cb -0.43 -2.54 0.48 0.00 1.34 0.00 0.00 72.50 71.35 3dr4 s THR 332 CO 0.55 0.00 1.60 -0.90 -0.54 0.00 0.00 174.62 175.34 3dr4 n ASP 333 N -0.89 1.03 -2.46 3.99 5.68 -1.26 -4.09 116.55 118.55 3dr4 n ASP 333 Ca -0.01 -1.61 -0.21 0.00 -0.50 0.00 0.00 54.79 52.47 3dr4 n ASP 333 Cb 0.65 -0.07 0.01 0.00 -1.14 0.00 0.00 41.12 40.58 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 -0.10 3.83 -0.81 -1.12 2.03 -1.26 -4.61 116.55 114.52 3dr4 n ASP 334 Ca 0.15 -3.39 0.06 0.00 0.52 0.00 0.00 54.79 52.13 3dr4 n ASP 334 Cb 0.23 -0.45 0.16 0.00 -0.72 0.00 0.00 41.12 40.33 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 -0.44 2.27 -0.06 -2.67 4.77 -1.26 -4.17 117.00 115.44 3dr4 n LEU 335 Ca 0.31 -3.41 -0.01 0.00 -0.03 0.00 0.00 56.01 52.87 3dr4 n LEU 335 Cb 0.76 -0.39 0.26 0.00 -2.33 0.00 0.00 43.42 41.72 3dr4 n LEU 335 CO 0.31 1.17 0.98 0.11 -1.33 0.00 0.00 177.39 178.63 3dr4 h LYS 336 N 0.98 0.67 -0.18 3.23 1.57 -1.90 -2.16 116.57 118.77 3dr4 h LYS 336 Ca -0.06 -0.13 -0.20 0.00 -1.87 0.00 0.00 60.65 58.40 3dr4 h LYS 336 Cb 1.22 -0.11 0.01 0.00 0.08 0.00 0.00 32.23 33.44 3dr4 h LYS 336 CO 0.02 0.62 -0.65 0.82 -0.57 0.00 0.00 179.45 179.70 3dr4 h ILE 337 N 0.65 1.29 -0.14 1.86 1.08 -1.90 -1.40 117.51 118.95 3dr4 h ILE 337 Ca 0.15 -1.86 0.04 0.00 -0.39 0.00 0.00 64.86 62.80 3dr4 h ILE 337 Cb 0.27 1.91 -0.04 0.00 -3.07 0.00 0.00 36.82 35.89 3dr4 h ILE 337 CO -0.00 0.59 -0.12 0.00 -0.69 0.00 0.00 178.15 177.92 3dr4 h ALA 338 N 0.57 -0.03 -0.71 1.87 0.00 -1.81 0.44 119.26 119.60 3dr4 h ALA 338 Ca -0.03 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.94 3dr4 h ALA 338 Cb 1.27 0.26 -0.04 0.00 0.00 0.00 0.00 17.79 19.29 3dr4 h ALA 338 CO 0.14 -0.57 0.47 0.93 0.00 0.00 0.00 179.25 180.21 3dr4 h GLU 339 N -0.15 0.94 -0.63 0.00 5.08 -1.22 -0.92 114.58 117.69 3dr4 h GLU 339 Ca 0.09 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 3dr4 h GLU 339 Cb 0.28 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 3dr4 h GLU 339 CO -0.22 0.63 0.30 0.00 -1.00 0.00 0.00 179.01 178.72 3dr4 h ALA 340 N 1.25 0.82 -0.51 3.43 0.00 -0.28 -0.71 119.26 123.27 3dr4 h ALA 340 Ca 0.26 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3dr4 h ALA 340 Cb -0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 3dr4 h ALA 340 CO -0.06 0.39 0.01 0.00 0.00 0.00 0.00 179.25 179.59 3dr4 h GLY 342 N 0.99 0.00 0.86 0.00 0.00 -0.68 0.16 103.07 104.40 3dr4 h GLY 342 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 47.28 3dr4 h GLY 342 CO 0.02 0.00 -0.83 -2.08 0.00 0.00 0.00 176.54 173.65 3dr4 h VAL 343 N 0.00 1.42 -0.01 4.60 2.07 -0.53 -3.39 116.25 120.41 3dr4 h VAL 343 Ca -0.00 -2.33 0.00 0.00 0.82 0.00 0.00 66.70 65.19 3dr4 h VAL 343 Cb 0.60 2.83 0.00 0.00 -1.52 0.00 0.00 31.29 33.19 3dr4 h VAL 343 CO 0.04 0.68 -0.12 -0.90 0.02 0.00 0.00 177.57 177.29 3dr4 n ASP 344 N -4.08 1.89 -4.76 0.57 5.68 -0.63 -4.52 116.55 110.69 3dr4 n ASP 344 Ca -0.12 -1.44 -0.39 0.00 -0.50 0.00 0.00 54.79 52.34 3dr4 n ASP 344 Cb 0.80 0.20 -0.06 0.00 -1.14 0.00 0.00 41.12 40.92 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 -1.41 2.97 -0.04 6.12 0.00 0.04 -1.23 107.32 113.77 3dr4 s GLY 345 Ca 0.14 0.56 -0.02 0.00 0.00 0.00 0.00 44.72 45.41 3dr4 s GLY 345 CO 0.25 1.07 0.07 -2.27 0.00 0.00 0.00 173.10 172.22 3dr4 s LEU 346 N -1.55 0.24 -0.12 0.66 2.96 -0.31 -1.71 118.68 118.84 3dr4 s LEU 346 Ca 0.45 0.10 -0.22 0.00 -0.22 0.00 0.00 54.13 54.23 3dr4 s LEU 346 Cb -0.23 -0.09 -0.03 0.00 0.50 0.00 0.00 46.19 46.34 3dr4 s LEU 346 CO 0.28 -0.23 0.68 0.20 -1.32 0.00 0.00 176.35 175.95 3dr4 s ASN 347 N 2.04 6.87 0.31 3.68 0.01 0.94 -0.84 114.94 127.95 3dr4 s ASN 347 Ca 0.03 1.06 0.01 0.00 -0.71 0.00 0.00 52.86 53.24 3dr4 s ASN 347 Cb -0.12 -2.39 -0.03 0.00 0.41 0.00 0.00 41.25 39.12 3dr4 s ASN 347 CO -0.03 -0.18 0.50 -0.76 -1.51 0.00 0.00 177.10 175.12 3dr4 s LEU 348 N 1.25 4.08 -0.00 0.60 1.43 0.05 -2.58 118.68 123.52 3dr4 s LEU 348 Ca 0.34 0.40 -0.37 0.00 -1.03 0.00 0.00 54.13 53.47 3dr4 s LEU 348 Cb -0.17 -3.24 -0.16 0.00 0.03 0.00 0.00 46.19 42.66 3dr4 s LEU 348 CO 0.14 -0.23 1.50 -2.65 0.23 0.00 0.00 176.35 175.34 3dr4 n PRO 349 N -1.59 1.34 -3.36 1.29 -0.02 -1.26 -4.16 135.00 127.24 3dr4 n PRO 349 Ca -0.05 0.49 -0.12 0.00 -2.02 0.00 0.00 63.50 61.79 3dr4 n PRO 349 Cb 0.56 -2.17 -0.08 0.00 -0.02 0.00 0.00 33.50 31.79 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 1.49 -0.54 -0.00 3.45 2.01 -0.53 -4.81 115.64 116.71 3dr4 s THR 350 Ca 0.88 -0.24 -0.29 0.00 0.31 0.00 0.00 61.69 62.34 3dr4 s THR 350 Cb -0.93 -0.89 0.10 0.00 0.01 0.00 0.00 72.50 70.79 3dr4 s THR 350 CO 0.50 -0.26 0.99 -1.38 -0.69 0.00 0.00 174.62 173.78 3dr4 s HIS 351 N 2.48 -0.24 0.58 4.92 -3.43 -1.26 -4.60 115.29 113.74 3dr4 s HIS 351 Ca 0.10 0.08 0.34 0.00 -0.80 0.00 0.00 55.06 54.78 3dr4 s HIS 351 Cb -0.14 0.56 1.93 0.00 -1.43 0.00 0.00 32.58 33.50 3dr4 s HIS 351 CO -0.24 -0.53 2.26 0.00 -2.00 0.00 0.00 174.74 174.23 3dr4 h ALA 352 N 2.00 1.35 -0.43 -1.38 0.00 -1.87 -2.66 119.26 116.27 3dr4 h ALA 352 Ca -0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3dr4 h ALA 352 Cb 1.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3dr4 h ALA 352 CO 0.28 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.96 3dr4 n GLY 353 N -1.15 1.32 3.74 0.00 0.00 -1.26 -4.91 105.19 102.93 3dr4 n GLY 353 Ca -0.03 -0.59 -0.40 0.00 0.00 0.00 0.00 46.02 45.00 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 -1.22 4.59 0.49 0.99 1.43 -1.01 -5.05 118.68 118.90 3dr4 s LEU 354 Ca 0.36 1.95 0.08 0.00 -1.03 0.00 0.00 54.13 55.50 3dr4 s LEU 354 Cb 0.19 -3.61 0.04 0.00 0.03 0.00 0.00 46.19 42.85 3dr4 s LEU 354 CO 0.26 0.04 0.63 0.42 0.23 0.00 0.00 176.35 177.93 3dr4 s THR 355 N -0.80 2.51 0.27 5.49 -4.23 -1.26 -4.91 115.64 112.71 3dr4 s THR 355 Ca 0.44 -1.07 -0.04 0.00 -1.18 0.00 0.00 61.69 59.83 3dr4 s THR 355 Cb -0.26 -2.59 0.25 0.00 1.34 0.00 0.00 72.50 71.24 3dr4 s THR 355 CO 0.33 0.00 1.93 -0.08 -0.54 0.00 0.00 174.62 176.26 3dr4 h GLU 356 N 0.50 1.17 -0.65 3.99 4.81 -1.98 -0.76 114.58 121.67 3dr4 h GLU 356 Ca -0.36 -0.09 -0.02 0.00 -0.13 0.00 0.00 59.36 58.77 3dr4 h GLU 356 Cb 1.28 -0.25 -0.03 0.00 0.63 0.00 0.00 28.75 30.38 3dr4 h GLU 356 CO 0.46 0.80 0.33 0.00 -0.73 0.00 0.00 179.01 179.87 3dr4 h ALA 357 N 1.41 1.37 -0.59 2.92 0.00 -1.99 0.35 119.26 122.73 3dr4 h ALA 357 Ca 0.32 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 3dr4 h ALA 357 Cb -0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 3dr4 h ALA 357 CO -0.06 0.51 0.18 -0.44 0.00 0.00 0.00 179.25 179.43 3dr4 h ASP 358 N 0.91 0.86 -0.17 0.00 3.32 -1.56 -1.83 116.42 117.95 3dr4 h ASP 358 Ca 0.23 -0.21 -0.11 0.00 0.02 0.00 0.00 57.03 56.95 3dr4 h ASP 358 Cb 0.06 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 3dr4 h ASP 358 CO -0.03 0.84 -0.28 0.40 -1.72 0.00 0.00 179.24 178.45 3dr4 h ILE 359 N 0.83 1.28 -0.77 0.35 1.08 -0.27 -0.77 117.51 119.24 3dr4 h ILE 359 Ca 0.19 -1.38 -0.01 0.00 -0.39 0.00 0.00 64.86 63.27 3dr4 h ILE 359 Cb 0.29 1.34 -0.04 0.00 -3.07 0.00 0.00 36.82 35.34 3dr4 h ILE 359 CO -0.01 0.45 0.46 0.44 -0.69 0.00 0.00 178.15 178.80 3dr4 h ASP 360 N 0.56 0.93 -0.72 1.72 3.32 -0.05 -1.43 116.42 120.74 3dr4 h ASP 360 Ca 0.07 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.03 3dr4 h ASP 360 Cb 0.76 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 40.04 3dr4 h ASP 360 CO 0.06 0.73 0.37 -0.09 -1.72 0.00 0.00 179.24 178.60 3dr4 h ARG 361 N 1.06 1.03 -0.80 3.56 2.43 -0.90 0.14 114.38 120.89 3dr4 h ARG 361 Ca 0.28 -0.14 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 3dr4 h ARG 361 Cb -0.02 -0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 29.30 3dr4 h ARG 361 CO -0.05 0.78 0.38 0.28 -1.51 0.00 0.00 179.97 179.85 3dr4 h VAL 362 N 1.00 1.25 -0.41 0.20 2.07 -0.80 0.21 116.25 119.79 3dr4 h VAL 362 Ca 0.25 -0.71 -0.13 0.00 0.82 0.00 0.00 66.70 66.93 3dr4 h VAL 362 Cb 0.08 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 3dr4 h VAL 362 CO -0.04 0.30 -0.26 0.40 0.02 0.00 0.00 177.57 177.99 3dr4 h ILE 363 N 1.13 1.28 -0.55 4.57 1.08 -0.88 0.42 117.51 124.56 3dr4 h ILE 363 Ca 0.27 -1.42 -0.04 0.00 -0.39 0.00 0.00 64.86 63.28 3dr4 h ILE 363 Cb 0.12 1.30 -0.02 0.00 -3.07 0.00 0.00 36.82 35.15 3dr4 h ILE 363 CO -0.03 0.48 0.17 0.00 -0.69 0.00 0.00 178.15 178.07 3dr4 h ALA 364 N 0.81 0.72 -0.39 1.87 0.00 -0.52 0.24 119.26 121.98 3dr4 h ALA 364 Ca 0.08 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 54.81 3dr4 h ALA 364 Cb 0.84 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 3dr4 h ALA 364 CO 0.07 0.38 0.26 0.00 0.00 0.00 0.00 179.25 179.96 3dr4 h ALA 365 N 1.03 0.49 -0.33 0.00 0.00 -0.37 -2.20 119.26 117.90 3dr4 h ALA 365 Ca 0.18 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 3dr4 h ALA 365 Cb 0.28 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3dr4 h ALA 365 CO -0.01 -0.05 -0.15 -0.07 0.00 0.00 0.00 179.25 178.97 3dr4 h LEU 366 N 0.52 0.57 -0.67 0.00 3.38 -0.50 -0.85 115.31 117.77 3dr4 h LEU 366 Ca 0.14 -0.17 0.09 0.00 0.09 0.00 0.00 57.88 58.04 3dr4 h LEU 366 Cb -0.05 -0.15 -0.07 0.00 0.09 0.00 0.00 40.66 40.47 3dr4 h LEU 366 CO -0.03 0.75 0.31 -0.78 0.09 0.00 0.00 178.44 178.77 3dr4 h ASP 367 N 0.53 0.38 -0.06 -0.43 3.58 0.02 0.15 116.42 120.59 3dr4 h ASP 367 Ca 0.09 0.07 -0.05 0.00 0.42 0.00 0.00 57.03 57.56 3dr4 h ASP 367 Cb 0.57 0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.63 3dr4 h ASP 367 CO 0.04 0.22 -0.16 -0.61 -2.88 0.00 0.00 179.24 175.85 3dr4 h GLN 368 N 0.53 0.21 0.00 0.28 4.15 -1.11 -3.35 115.11 115.83 3dr4 h GLN 368 Ca 0.33 -0.15 -0.02 0.00 0.77 0.00 0.00 58.65 59.58 3dr4 h GLN 368 Cb 0.36 0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.07 3dr4 h GLN 368 CO -0.28 0.76 -0.10 -0.39 -1.93 0.00 0.00 178.83 176.89 3dr4 h VAL 369 N -0.30 0.18 -1.87 2.39 -1.51 -0.79 -3.40 116.25 110.95 3dr4 h VAL 369 Ca -0.00 -1.13 -0.66 0.00 -1.23 0.00 0.00 66.70 63.68 3dr4 h VAL 369 Cb 0.76 1.98 -0.15 0.00 -2.13 0.00 0.00 31.29 31.75 3dr4 h VAL 369 CO 0.03 0.10 1.16 -0.76 -1.23 0.00 0.00 177.57 176.87 3dr4 s LEU 370 N -6.29 4.45 0.00 4.19 1.43 0.01 -4.91 118.68 117.56 3dr4 s LEU 370 Ca 0.05 -1.91 0.00 0.00 -1.03 0.00 0.00 54.13 51.24 3dr4 s LEU 370 Cb 0.06 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.82 3dr4 s LEU 370 CO 0.66 -1.21 0.50 0.52 0.23 0.00 0.00 176.35 177.05