#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dlb s THR 7 N 0.00 0.11 -0.14 -0.18 -1.32 0.13 -4.93 115.64 109.31 3dlb s THR 7 Ca 0.00 -1.09 -0.08 0.00 -1.21 0.00 0.00 61.69 59.31 3dlb s THR 7 Cb 0.00 -1.39 -0.04 0.00 -1.51 0.00 0.00 72.50 69.55 3dlb s THR 7 CO 0.00 -0.52 0.13 -0.70 -2.21 0.00 0.00 174.62 171.32 3dlb s GLU 8 N -3.87 3.66 0.14 7.08 2.56 -1.26 -0.10 118.70 126.92 3dlb s GLU 8 Ca 0.07 -0.16 0.01 0.00 0.00 0.00 0.00 54.97 54.88 3dlb s GLU 8 Cb 0.04 -3.25 -0.04 0.00 2.00 0.00 0.00 34.13 32.87 3dlb s GLU 8 CO -0.09 0.63 -0.01 0.14 -0.56 0.00 0.00 175.26 175.37 3dlb s VAL 9 N -0.60 0.60 -0.16 3.70 -7.23 -0.53 -3.69 120.40 112.50 3dlb s VAL 9 Ca 0.13 -1.95 -0.05 0.00 -1.81 0.00 0.00 61.98 58.29 3dlb s VAL 9 Cb -0.12 -1.97 -0.03 0.00 0.56 0.00 0.00 36.38 34.82 3dlb s VAL 9 CO 0.02 -0.60 0.00 -0.36 -0.31 0.00 0.00 175.10 173.85 3dlb s PHE 10 N -3.70 3.12 0.04 2.82 2.99 0.17 -0.92 117.98 122.51 3dlb s PHE 10 Ca 0.20 -0.12 0.00 0.00 0.00 0.00 0.00 56.93 57.02 3dlb s PHE 10 Cb 0.06 -1.98 -0.04 0.00 0.00 0.00 0.00 43.02 41.06 3dlb s PHE 10 CO 0.01 0.08 0.15 -0.51 -0.00 0.00 0.00 175.22 174.95 3dlb s LEU 11 N 0.24 4.13 0.00 -0.37 1.43 -0.83 -0.60 118.68 122.68 3dlb s LEU 11 Ca -0.00 0.18 -0.03 0.00 -1.03 0.00 0.00 54.13 53.25 3dlb s LEU 11 Cb -0.13 -2.66 -0.15 0.00 0.03 0.00 0.00 46.19 43.28 3dlb s LEU 11 CO 0.02 0.20 2.57 -0.46 0.23 0.00 0.00 176.35 178.91 3dlb n ASN 12 N 0.58 4.13 -4.60 2.29 6.94 -1.08 -4.34 115.26 119.19 3dlb n ASN 12 Ca -0.08 -2.22 -0.27 0.00 -0.02 0.00 0.00 54.58 51.98 3dlb n ASN 12 Cb 0.52 -1.05 -0.11 0.00 -2.36 0.00 0.00 39.78 36.78 3dlb n ASN 12 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 3dlb s ARG 13 N 1.15 1.93 -0.24 -3.83 0.52 -1.26 -2.22 118.95 115.00 3dlb s ARG 13 Ca 0.38 -2.06 -0.05 0.00 -0.52 0.00 0.00 55.73 53.49 3dlb s ARG 13 Cb 0.18 -1.67 0.13 0.00 0.52 0.00 0.00 34.95 34.11 3dlb s ARG 13 CO 0.00 0.00 0.46 -0.06 0.02 0.00 0.00 175.30 175.72 3dlb s PHE 14 N -2.68 -1.00 0.39 -0.53 0.40 0.10 -3.13 117.98 111.53 3dlb s PHE 14 Ca 0.34 1.38 -0.26 0.00 -0.60 0.00 0.00 56.93 57.79 3dlb s PHE 14 Cb 0.08 0.29 -0.09 0.00 0.51 0.00 0.00 43.02 43.81 3dlb s PHE 14 CO 0.18 -0.66 1.27 0.00 0.70 0.00 0.00 175.22 176.71 3dlb s ALA 15 N 2.66 3.27 0.00 5.36 0.00 -0.42 -0.84 121.76 131.79 3dlb s ALA 15 Ca 0.07 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.21 3dlb s ALA 15 Cb -0.14 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.52 3dlb s ALA 15 CO -0.16 -0.73 0.00 1.28 0.00 0.00 0.00 175.76 176.15 3dlb n LEU 16 N 0.23 0.00 -4.65 0.00 4.77 -0.96 -1.65 117.00 114.74 3dlb n LEU 16 Ca 0.03 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.71 3dlb n LEU 16 Cb 0.44 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.70 3dlb n LEU 16 CO 0.55 0.00 0.65 0.00 -1.33 0.00 0.00 177.39 177.27 3dlb s ARG 17 N -1.53 0.82 0.63 3.23 1.70 -0.88 -4.27 118.95 118.65 3dlb s ARG 17 Ca 0.00 1.34 -0.12 0.00 -0.47 0.00 0.00 55.73 56.49 3dlb s ARG 17 Cb 0.00 -1.72 -0.03 0.00 -0.57 0.00 0.00 34.95 32.63 3dlb s ARG 17 CO 0.00 -2.70 1.04 -2.14 -1.08 0.00 0.00 175.30 170.42 3dlb s PRO 18 N -4.66 3.38 0.26 3.89 0.02 -1.26 -1.78 135.00 134.85 3dlb s PRO 18 Ca 0.66 0.88 -0.29 0.00 0.02 0.00 0.00 61.00 62.27 3dlb s PRO 18 Cb -0.22 -2.05 -0.09 0.00 0.02 0.00 0.00 34.50 32.16 3dlb s PRO 18 CO 0.59 -0.75 1.01 -0.51 -0.33 0.00 0.00 177.00 177.01 3dlb s LEU 19 N -5.15 4.58 0.92 -5.54 1.02 -0.41 -4.84 118.68 109.27 3dlb s LEU 19 Ca 0.57 2.08 -0.13 0.00 0.02 0.00 0.00 54.13 56.67 3dlb s LEU 19 Cb -0.12 -3.65 0.14 0.00 0.02 0.00 0.00 46.19 42.58 3dlb s LEU 19 CO 0.51 0.01 1.16 0.54 0.02 0.00 0.00 176.35 178.58 3dlb s ASN 20 N -1.08 3.45 0.55 2.29 2.20 -1.26 -4.84 114.94 116.25 3dlb s ASN 20 Ca 0.43 0.86 0.25 0.00 -0.94 0.00 0.00 52.86 53.47 3dlb s ASN 20 Cb -0.28 -1.37 1.57 0.00 -2.00 0.00 0.00 41.25 39.18 3dlb s ASN 20 CO 0.35 -2.58 2.18 1.55 -2.94 0.00 0.00 177.10 175.66 3dlb h PRO 21 N -1.52 0.00 -0.09 3.55 0.13 -1.98 -2.32 132.00 129.78 3dlb h PRO 21 Ca -0.49 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.55 3dlb h PRO 21 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 3dlb h PRO 21 CO 0.59 0.04 -0.29 0.93 -0.23 0.00 0.00 178.00 179.04 3dlb h GLU 22 N 0.00 0.35 0.00 0.86 3.07 -1.92 -3.03 114.58 113.92 3dlb h GLU 22 Ca -0.00 -0.26 -0.02 0.00 -0.50 0.00 0.00 59.36 58.58 3dlb h GLU 22 Cb 0.10 0.05 -0.00 0.00 -0.84 0.00 0.00 28.75 28.05 3dlb h GLU 22 CO 0.01 0.89 -0.09 0.93 -1.40 0.00 0.00 179.01 179.34 3dlb h GLU 23 N -0.11 0.00 -0.01 2.33 5.08 -1.82 -0.27 114.58 119.78 3dlb h GLU 23 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3dlb h GLU 23 Cb 0.92 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.17 3dlb h GLU 23 CO 0.06 0.09 -0.02 1.28 -1.00 0.00 0.00 179.01 179.42 3dlb n LEU 24 N -3.48 1.18 -2.86 1.33 4.77 -0.91 -4.10 117.00 112.93 3dlb n LEU 24 Ca -0.02 -0.38 -0.18 0.00 -0.03 0.00 0.00 56.01 55.41 3dlb n LEU 24 Cb 0.24 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.30 3dlb n LEU 24 CO 0.29 0.20 -0.07 -1.14 -1.33 0.00 0.00 177.39 175.34 3dlb n ARG 25 N -0.12 1.75 -0.71 3.23 0.63 -0.11 -2.06 116.66 119.27 3dlb n ARG 25 Ca 0.19 -3.73 -0.32 0.00 -0.92 0.00 0.00 57.85 53.07 3dlb n ARG 25 Cb 0.31 -1.71 0.15 0.00 0.45 0.00 0.00 32.46 31.67 3dlb n ARG 25 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 3dlb n PRO 26 N -0.04 -0.71 -2.85 -0.14 -0.04 -1.18 -4.08 135.00 125.96 3dlb n PRO 26 Ca 0.22 -0.16 -0.34 0.00 -0.04 0.00 0.00 63.50 63.18 3dlb n PRO 26 Cb 0.68 -2.02 -0.07 0.00 -0.04 0.00 0.00 33.50 32.05 3dlb n PRO 26 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 3dlb s TRP 27 N -2.45 3.44 0.17 0.54 0.52 0.57 -0.94 118.94 120.79 3dlb s TRP 27 Ca 0.61 1.61 0.10 0.00 0.02 0.00 0.00 56.10 58.44 3dlb s TRP 27 Cb -0.21 -2.83 -0.04 0.00 -1.15 0.00 0.00 33.47 29.24 3dlb s TRP 27 CO 0.64 0.02 -0.16 0.50 0.02 0.00 0.00 176.95 177.97 3dlb s ARG 28 N -2.78 1.82 -0.03 4.98 3.52 -1.25 0.96 118.95 126.16 3dlb s ARG 28 Ca 0.57 -1.33 -0.03 0.00 -0.13 0.00 0.00 55.73 54.81 3dlb s ARG 28 Cb -0.12 -2.05 0.01 0.00 -1.56 0.00 0.00 34.95 31.23 3dlb s ARG 28 CO 0.17 0.43 0.09 -0.51 -0.81 0.00 0.00 175.30 174.67 3dlb s LEU 29 N -2.61 1.59 0.32 -0.88 1.02 -0.27 -3.27 118.68 114.57 3dlb s LEU 29 Ca 0.22 0.18 -0.01 0.00 0.02 0.00 0.00 54.13 54.54 3dlb s LEU 29 Cb -0.09 0.30 -0.04 0.00 0.02 0.00 0.00 46.19 46.38 3dlb s LEU 29 CO 0.12 -0.04 0.54 -1.61 0.02 0.00 0.00 176.35 175.38 3dlb s GLU 30 N 0.14 3.53 0.05 1.70 2.02 -0.18 -0.22 118.70 125.75 3dlb s GLU 30 Ca -0.01 -0.24 0.05 0.00 0.02 0.00 0.00 54.97 54.79 3dlb s GLU 30 Cb -0.02 -2.67 -0.02 0.00 0.10 0.00 0.00 34.13 31.52 3dlb s GLU 30 CO -0.00 0.19 -0.14 0.08 0.02 0.00 0.00 175.26 175.41 3dlb s VAL 31 N -2.22 1.07 -0.05 2.63 1.01 -1.26 -0.95 120.40 120.63 3dlb s VAL 31 Ca 0.41 -1.08 0.02 0.00 0.00 0.00 0.00 61.98 61.33 3dlb s VAL 31 Cb -0.10 -0.99 0.01 0.00 0.00 0.00 0.00 36.38 35.30 3dlb s VAL 31 CO 0.34 -0.08 -0.10 -0.69 0.00 0.00 0.00 175.10 174.57 3dlb s VAL 32 N -0.99 0.91 0.20 2.92 1.01 -0.87 -5.00 120.40 118.58 3dlb s VAL 32 Ca -0.00 -0.37 0.09 0.00 0.00 0.00 0.00 61.98 61.70 3dlb s VAL 32 Cb -0.08 -0.84 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 3dlb s VAL 32 CO 0.01 0.30 -0.09 -0.76 0.00 0.00 0.00 175.10 174.56 3dlb s LEU 33 N 0.55 2.96 -0.16 3.92 1.43 -1.26 -2.12 118.68 123.99 3dlb s LEU 33 Ca -0.10 -0.63 -0.06 0.00 -1.03 0.00 0.00 54.13 52.31 3dlb s LEU 33 Cb -0.13 -1.61 0.08 0.00 0.03 0.00 0.00 46.19 44.55 3dlb s LEU 33 CO 0.02 0.08 0.35 -0.62 0.23 0.00 0.00 176.35 176.41 3dlb s ASP 34 N -3.01 -0.04 0.75 2.29 3.68 -0.39 -4.21 116.67 115.75 3dlb s ASP 34 Ca 0.26 0.81 -0.11 0.00 2.13 0.00 0.00 52.55 55.63 3dlb s ASP 34 Cb -0.08 1.00 0.04 0.00 -1.45 0.00 0.00 42.92 42.44 3dlb s ASP 34 CO 0.16 -0.23 1.09 -2.84 0.13 0.00 0.00 175.17 173.48 3dlb s PRO 35 N 2.38 2.47 0.22 4.34 0.02 -1.26 -0.52 135.00 142.65 3dlb s PRO 35 Ca -0.02 0.67 -0.30 0.00 0.02 0.00 0.00 61.00 61.37 3dlb s PRO 35 Cb -0.12 -1.96 -0.09 0.00 0.02 0.00 0.00 34.50 32.35 3dlb s PRO 35 CO -0.11 -1.36 1.39 -2.14 -0.33 0.00 0.00 177.00 174.45 3dlb s PRO 36 N -5.18 4.32 0.66 5.54 0.02 -1.26 -4.94 135.00 134.17 3dlb s PRO 36 Ca 0.59 2.20 0.01 0.00 0.02 0.00 0.00 61.00 63.82 3dlb s PRO 36 Cb -0.13 -3.15 0.10 0.00 0.02 0.00 0.00 34.50 31.34 3dlb s PRO 36 CO 0.54 -0.36 0.92 -1.25 -0.33 0.00 0.00 177.00 176.52 3dlb s PRO 37 N -0.16 1.94 0.41 5.54 0.04 -1.26 -5.03 135.00 136.47 3dlb s PRO 37 Ca 0.59 -1.13 -0.26 0.00 0.04 0.00 0.00 61.00 60.24 3dlb s PRO 37 Cb -0.40 -2.41 -0.09 0.00 0.04 0.00 0.00 34.50 31.64 3dlb s PRO 37 CO 0.40 -1.21 1.37 0.20 0.04 0.00 0.00 177.00 177.80 3dlb s GLY 38 N -4.66 2.93 0.61 0.56 0.00 -1.26 -4.84 107.32 100.66 3dlb s GLY 38 Ca 0.64 1.36 0.29 0.00 0.00 0.00 0.00 44.72 47.02 3dlb s GLY 38 CO 0.42 1.98 1.98 -0.09 0.00 0.00 0.00 173.10 177.39 3dlb h ARG 39 N 2.70 0.00 0.00 2.90 2.43 -2.02 0.21 114.38 120.60 3dlb h ARG 39 Ca -0.50 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.67 3dlb h ARG 39 Cb 1.25 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.80 3dlb h ARG 39 CO 0.63 0.00 0.00 0.39 -1.51 0.00 0.00 179.97 179.48 3dlb n GLU 40 N -3.52 0.23 0.00 0.20 4.71 -1.26 -3.32 120.64 117.68 3dlb n GLU 40 Ca 0.03 0.30 0.11 0.00 -0.01 0.00 0.00 57.16 57.59 3dlb n GLU 40 Cb 0.48 -1.83 -0.13 0.00 -1.01 0.00 0.00 31.44 28.95 3dlb n GLU 40 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3dlb n GLU 41 N -2.24 0.52 -0.17 3.49 1.02 0.73 -4.62 120.64 119.37 3dlb n GLU 41 Ca 0.04 -0.13 -0.07 0.00 -0.02 0.00 0.00 57.16 56.98 3dlb n GLU 41 Cb 0.34 -1.55 -0.02 0.00 -0.02 0.00 0.00 31.44 30.20 3dlb n GLU 41 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3dlb h VAL 42 N 0.00 0.14 -0.46 2.62 2.07 -1.53 -2.58 116.25 116.51 3dlb h VAL 42 Ca 0.00 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 3dlb h VAL 42 Cb 0.90 0.14 -0.03 0.00 -1.52 0.00 0.00 31.29 30.79 3dlb h VAL 42 CO 0.00 0.00 0.29 1.88 0.02 0.00 0.00 177.57 179.76 3dlb h TYR 43 N -0.23 0.56 -0.33 1.57 -1.99 -1.82 -0.89 116.97 113.84 3dlb h TYR 43 Ca 0.19 0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.91 3dlb h TYR 43 Cb 0.56 -0.19 -0.02 0.00 2.00 0.00 0.00 36.73 39.09 3dlb h TYR 43 CO -0.64 0.34 0.11 -1.35 -0.00 0.00 0.00 178.16 176.63 3dlb h PRO 44 N 0.60 0.46 -0.19 4.88 0.11 -1.80 -2.62 132.00 133.44 3dlb h PRO 44 Ca 0.17 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 66.19 3dlb h PRO 44 Cb -0.05 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 30.97 3dlb h PRO 44 CO -0.05 0.40 -0.03 -0.07 -0.21 0.00 0.00 178.00 178.05 3dlb h LEU 45 N 0.46 0.36 -1.08 2.35 4.07 -1.00 -2.51 115.31 117.97 3dlb h LEU 45 Ca 0.11 -0.34 0.05 0.00 0.08 0.00 0.00 57.88 57.78 3dlb h LEU 45 Cb 0.13 -0.10 -0.06 0.00 1.08 0.00 0.00 40.66 41.71 3dlb h LEU 45 CO -0.01 0.62 0.62 -0.07 -1.08 0.00 0.00 178.44 178.52 3dlb h LEU 46 N 0.09 1.01 -0.86 1.67 3.38 -1.02 0.54 115.31 120.12 3dlb h LEU 46 Ca 0.05 -0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.08 3dlb h LEU 46 Cb 0.45 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 40.91 3dlb h LEU 46 CO 0.01 0.68 0.54 0.00 0.09 0.00 0.00 178.44 179.76 3dlb h ALA 47 N 1.46 1.18 -0.37 1.53 0.00 -1.36 0.54 119.26 122.24 3dlb h ALA 47 Ca 0.39 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 55.17 3dlb h ALA 47 Cb 0.07 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3dlb h ALA 47 CO -0.13 0.29 -0.25 0.37 0.00 0.00 0.00 179.25 179.53 3dlb h GLN 48 N 0.98 0.75 0.00 0.00 4.15 -0.02 -2.40 115.11 118.58 3dlb h GLN 48 Ca 0.37 -0.31 -0.03 0.00 0.77 0.00 0.00 58.65 59.45 3dlb h GLN 48 Cb 0.16 -0.03 -0.00 0.00 0.21 0.00 0.00 27.48 27.82 3dlb h GLN 48 CO -0.17 0.92 -0.15 0.28 -1.93 0.00 0.00 178.83 177.78 3dlb h VAL 49 N 0.65 1.10 -0.55 2.39 2.07 0.25 -1.32 116.25 120.85 3dlb h VAL 49 Ca 0.09 -0.53 -0.09 0.00 0.82 0.00 0.00 66.70 66.99 3dlb h VAL 49 Cb 0.76 1.29 -0.02 0.00 -1.52 0.00 0.00 31.29 31.80 3dlb h VAL 49 CO 0.06 0.15 -0.00 0.00 0.02 0.00 0.00 177.57 177.80 3dlb h ALA 50 N 1.85 0.96 -0.25 1.67 0.00 0.46 -1.27 119.26 122.68 3dlb h ALA 50 Ca -0.00 -0.29 -0.17 0.00 0.00 0.00 0.00 54.91 54.45 3dlb h ALA 50 Cb 0.28 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3dlb h ALA 50 CO 0.02 0.63 -0.50 0.00 0.00 0.00 0.00 179.25 179.40 3dlb h ARG 51 N 0.87 0.79 -0.67 0.00 2.47 -1.15 -3.14 114.38 113.55 3dlb h ARG 51 Ca 0.16 -0.51 0.03 0.00 -1.26 0.00 0.00 59.98 58.40 3dlb h ARG 51 Cb 0.52 0.06 -0.04 0.00 -1.65 0.00 0.00 29.97 28.86 3dlb h ARG 51 CO 0.03 1.14 0.42 0.00 0.56 0.00 0.00 179.97 182.11 3dlb h ARG 52 N 0.54 0.79 -7.34 0.04 2.47 -1.07 -3.42 114.38 106.39 3dlb h ARG 52 Ca 0.01 -0.05 -0.40 0.00 -1.26 0.00 0.00 59.98 58.28 3dlb h ARG 52 Cb 1.11 -0.18 0.20 0.00 -1.65 0.00 0.00 29.97 29.45 3dlb h ARG 52 CO 0.11 0.53 0.08 0.00 0.56 0.00 0.00 179.97 181.25 3dlb s ALA 53 N -6.12 0.35 0.44 0.04 0.00 -0.50 -4.59 121.76 111.38 3dlb s ALA 53 Ca -0.13 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 50.84 3dlb s ALA 53 Cb 0.15 -2.87 0.00 0.00 0.00 0.00 0.00 23.12 20.40 3dlb s ALA 53 CO 0.76 -3.84 0.00 0.41 0.00 0.00 0.00 175.76 173.09 3dlb n GLY 54 N -0.54 -1.43 3.46 0.00 0.00 -1.26 -4.63 105.19 100.79 3dlb n GLY 54 Ca 0.14 -0.47 -0.27 0.00 0.00 0.00 0.00 46.02 45.42 3dlb n GLY 54 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dlb s GLY 55 N -0.18 1.73 -0.82 -0.02 0.00 -1.26 -4.61 107.32 102.15 3dlb s GLY 55 Ca 0.00 -1.62 -0.03 0.00 0.00 0.00 0.00 44.72 43.06 3dlb s GLY 55 CO 0.00 -1.65 0.71 -0.62 0.00 0.00 0.00 173.10 171.53 3dlb n VAL 56 N 0.15 -2.80 -4.42 1.40 0.31 -1.26 -4.41 118.33 107.31 3dlb n VAL 56 Ca -0.12 -0.15 -0.20 0.00 -0.01 0.00 0.00 64.34 63.87 3dlb n VAL 56 Cb 0.56 -3.56 -0.14 0.00 -0.91 0.00 0.00 33.84 29.79 3dlb n VAL 56 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 3dlb s THR 57 N -3.22 0.89 0.19 2.52 -1.32 -1.26 -1.29 115.64 112.15 3dlb s THR 57 Ca 0.21 -0.62 -0.06 0.00 -1.21 0.00 0.00 61.69 60.01 3dlb s THR 57 Cb -0.09 -0.77 -0.02 0.00 -1.51 0.00 0.00 72.50 70.10 3dlb s THR 57 CO 0.47 0.15 0.24 0.54 -2.21 0.00 0.00 174.62 173.81 3dlb s VAL 58 N -0.45 0.03 0.15 5.08 0.11 0.16 -4.77 120.40 120.70 3dlb s VAL 58 Ca 0.03 -1.71 -0.30 0.00 -2.93 0.00 0.00 61.98 57.07 3dlb s VAL 58 Cb -0.05 -2.22 -0.07 0.00 -1.53 0.00 0.00 36.38 32.50 3dlb s VAL 58 CO 0.00 -0.13 1.15 -0.60 -3.33 0.00 0.00 175.10 172.20 3dlb s ARG 59 N -4.07 4.52 -0.07 1.54 3.52 -1.26 0.48 118.95 123.61 3dlb s ARG 59 Ca 0.28 1.78 -0.02 0.00 -0.13 0.00 0.00 55.73 57.64 3dlb s ARG 59 Cb 0.04 -3.29 0.03 0.00 -1.56 0.00 0.00 34.95 30.18 3dlb s ARG 59 CO 0.07 -0.07 0.04 1.41 -0.81 0.00 0.00 175.30 175.94 3dlb s MET 60 N 0.07 0.22 7.25 5.12 -2.45 -0.53 -4.71 119.30 124.28 3dlb s MET 60 Ca 0.53 0.22 0.00 0.00 -1.25 0.00 0.00 55.69 55.19 3dlb s MET 60 Cb -0.30 -0.83 0.00 0.00 1.25 0.00 0.00 34.83 34.94 3dlb s MET 60 CO 0.34 -0.35 0.00 0.41 1.05 0.00 0.00 175.02 176.46 3dlb n GLY 61 N 5.23 3.50 1.32 2.11 0.00 -1.26 0.76 105.19 116.84 3dlb n GLY 61 Ca -0.05 -0.10 -0.04 0.00 0.00 0.00 0.00 46.02 45.82 3dlb n GLY 61 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dlb n ASP 62 N 4.46 3.14 0.00 1.61 5.68 -1.26 -4.93 116.55 125.25 3dlb n ASP 62 Ca 0.00 -3.55 0.00 0.00 -0.50 0.00 0.00 54.79 50.74 3dlb n ASP 62 Cb 0.00 -0.65 0.00 0.00 -1.14 0.00 0.00 41.12 39.33 3dlb n ASP 62 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dlb n GLY 63 N -0.92 5.19 3.27 6.12 0.00 0.23 -4.52 105.19 114.55 3dlb n GLY 63 Ca 0.35 -1.58 -0.15 0.00 0.00 0.00 0.00 46.02 44.65 3dlb n GLY 63 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dlb s LEU 64 N 0.00 2.04 -0.03 0.99 1.43 0.70 -1.45 118.68 122.36 3dlb s LEU 64 Ca 0.00 -1.22 0.01 0.00 -1.03 0.00 0.00 54.13 51.89 3dlb s LEU 64 Cb 0.00 -0.07 0.02 0.00 0.03 0.00 0.00 46.19 46.16 3dlb s LEU 64 CO 0.00 -0.59 -0.02 0.00 0.23 0.00 0.00 176.35 175.97 3dlb s ALA 65 N -3.64 0.41 -0.00 4.21 0.00 0.18 -1.11 121.76 121.81 3dlb s ALA 65 Ca 0.27 0.02 0.02 0.00 0.00 0.00 0.00 51.96 52.27 3dlb s ALA 65 Cb 0.06 -0.28 -0.00 0.00 0.00 0.00 0.00 23.12 22.90 3dlb s ALA 65 CO 0.06 -0.01 -0.05 0.45 0.00 0.00 0.00 175.76 176.21 3dlb s SER 66 N 0.69 0.60 0.12 0.00 0.15 0.27 0.35 113.70 115.89 3dlb s SER 66 Ca -0.08 -0.09 0.23 0.00 0.70 0.00 0.00 55.95 56.71 3dlb s SER 66 Cb -0.11 -0.07 0.05 0.00 -1.71 0.00 0.00 66.02 64.19 3dlb s SER 66 CO -0.01 0.06 1.04 0.79 1.20 0.00 0.00 173.24 176.33 3dlb n TRP 67 N 2.96 0.60 -3.79 3.44 8.01 -0.41 -0.32 117.44 127.94 3dlb n TRP 67 Ca -0.13 0.18 -0.32 0.00 -1.31 0.00 0.00 57.50 55.92 3dlb n TRP 67 Cb 0.58 -0.71 -0.05 0.00 -2.01 0.00 0.00 31.31 29.12 3dlb n TRP 67 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.69 175.14 3dlb s SER 68 N -4.66 6.44 0.37 -0.99 1.04 -1.24 -4.95 113.70 109.71 3dlb s SER 68 Ca 0.01 0.46 -0.24 0.00 0.48 0.00 0.00 55.95 56.66 3dlb s SER 68 Cb 0.12 -2.04 -0.14 0.00 0.10 0.00 0.00 66.02 64.06 3dlb s SER 68 CO 0.79 0.14 0.52 -2.65 0.98 0.00 0.00 173.24 173.02 3dlb n PRO 69 N 0.38 0.48 -0.34 4.02 -0.02 -1.26 -4.88 135.00 133.37 3dlb n PRO 69 Ca -0.05 0.17 0.07 0.00 -2.02 0.00 0.00 63.50 61.67 3dlb n PRO 69 Cb 0.52 -1.38 0.23 0.00 -0.02 0.00 0.00 33.50 32.85 3dlb n PRO 69 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3dlb h PRO 70 N 0.89 0.86 0.00 0.52 0.11 -1.97 -2.32 132.00 130.10 3dlb h PRO 70 Ca -0.38 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3dlb h PRO 70 Cb 1.41 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3dlb h PRO 70 CO 0.53 0.57 0.00 0.39 -0.21 0.00 0.00 178.00 179.28 3dlb n GLU 71 N -4.69 0.59 -0.00 1.05 4.71 -1.26 -2.61 120.64 118.43 3dlb n GLU 71 Ca 0.18 0.00 0.04 0.00 -0.01 0.00 0.00 57.16 57.37 3dlb n GLU 71 Cb 0.38 -1.02 -0.05 0.00 -1.01 0.00 0.00 31.44 29.73 3dlb n GLU 71 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 3dlb n VAL 72 N -0.52 0.00 -3.18 2.62 0.31 -0.87 -5.01 118.33 111.67 3dlb n VAL 72 Ca 0.01 -0.26 -0.35 0.00 -0.01 0.00 0.00 64.34 63.73 3dlb n VAL 72 Cb 0.00 0.69 -0.06 0.00 -0.91 0.00 0.00 33.84 33.56 3dlb n VAL 72 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3dlb s LEU 73 N -2.89 4.29 -0.74 7.52 1.43 -1.07 -4.39 118.68 122.83 3dlb s LEU 73 Ca 0.00 1.30 -0.25 0.00 -1.03 0.00 0.00 54.13 54.15 3dlb s LEU 73 Cb 0.05 -3.59 0.05 0.00 0.03 0.00 0.00 46.19 42.73 3dlb s LEU 73 CO 0.30 0.01 1.17 -0.69 0.23 0.00 0.00 176.35 177.37 3dlb s VAL 74 N -1.60 4.01 -1.56 -1.59 1.01 -1.26 -4.68 120.40 114.73 3dlb s VAL 74 Ca 0.44 -0.07 0.17 0.00 0.00 0.00 0.00 61.98 62.52 3dlb s VAL 74 Cb -0.15 -4.84 0.35 0.00 0.00 0.00 0.00 36.38 31.75 3dlb s VAL 74 CO 0.20 -1.70 1.50 0.18 0.00 0.00 0.00 175.10 175.28 3dlb n LEU 75 N 8.58 0.00 -3.81 3.92 4.77 -1.26 -4.32 117.00 124.88 3dlb n LEU 75 Ca 0.04 0.22 -0.09 0.00 -0.03 0.00 0.00 56.01 56.14 3dlb n LEU 75 Cb 0.48 -0.22 -0.07 0.00 -2.33 0.00 0.00 43.42 41.28 3dlb n LEU 75 CO 0.67 -0.09 -0.04 -1.61 -1.33 0.00 0.00 177.39 174.99 3dlb s GLU 76 N -2.44 0.88 0.00 3.23 8.01 -1.26 -1.57 118.70 125.55 3dlb s GLU 76 Ca 0.19 -0.86 0.00 0.00 0.01 0.00 0.00 54.97 54.30 3dlb s GLU 76 Cb 0.12 0.37 0.00 0.00 -4.31 0.00 0.00 34.13 30.30 3dlb s GLU 76 CO 0.25 -0.29 0.00 0.41 0.01 0.00 0.00 175.26 175.64 3dlb n GLY 77 N -0.02 0.15 3.18 -1.39 0.00 -1.17 -5.00 105.19 100.93 3dlb n GLY 77 Ca -0.16 -1.50 -0.11 0.00 0.00 0.00 0.00 46.02 44.26 3dlb n GLY 77 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dlb s THR 78 N -2.93 0.53 -0.02 2.61 -4.23 -1.26 -1.26 115.64 109.08 3dlb s THR 78 Ca 0.00 -1.93 -0.03 0.00 -1.18 0.00 0.00 61.69 58.55 3dlb s THR 78 Cb 0.00 -1.86 0.00 0.00 1.34 0.00 0.00 72.50 71.98 3dlb s THR 78 CO 0.00 -0.70 0.07 -1.48 -0.54 0.00 0.00 174.62 171.98 3dlb s LEU 79 N -3.07 1.75 -0.09 4.79 -0.00 -0.17 -4.95 118.68 116.94 3dlb s LEU 79 Ca 0.17 0.01 -0.01 0.00 -0.00 0.00 0.00 54.13 54.30 3dlb s LEU 79 Cb 0.06 0.31 -0.03 0.00 -0.00 0.00 0.00 46.19 46.53 3dlb s LEU 79 CO -0.02 -0.12 -0.04 0.00 -0.00 0.00 0.00 176.35 176.17 3dlb s ALA 80 N -0.40 3.07 -0.07 1.48 0.00 -1.26 -0.81 121.76 123.77 3dlb s ALA 80 Ca -0.05 -0.85 -0.03 0.00 0.00 0.00 0.00 51.96 51.04 3dlb s ALA 80 Cb -0.03 -1.38 0.04 0.00 0.00 0.00 0.00 23.12 21.75 3dlb s ALA 80 CO 0.00 0.49 0.13 0.50 0.00 0.00 0.00 175.76 176.88 3dlb s ARG 81 N -0.55 0.01 -1.50 0.00 3.52 0.19 -4.85 118.95 115.77 3dlb s ARG 81 Ca 0.09 0.49 -0.12 0.00 -0.13 0.00 0.00 55.73 56.05 3dlb s ARG 81 Cb -0.12 -0.33 0.07 0.00 -1.56 0.00 0.00 34.95 33.02 3dlb s ARG 81 CO 0.02 -0.30 0.99 -1.33 -0.81 0.00 0.00 175.30 173.87 3dlb n MET 82 N 5.20 -5.74 0.00 5.12 2.81 -1.26 -1.55 117.12 121.70 3dlb n MET 82 Ca -0.07 0.62 0.00 0.00 -1.81 0.00 0.00 57.70 56.45 3dlb n MET 82 Cb 0.50 -5.51 0.00 0.00 -0.71 0.00 0.00 33.22 27.50 3dlb n MET 82 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3dlb n GLY 83 N -1.72 2.82 3.90 3.03 0.00 -1.26 -5.01 105.19 106.96 3dlb n GLY 83 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 3dlb n GLY 83 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dlb s GLN 84 N -0.13 3.60 -0.06 1.61 -1.52 -0.59 -5.07 119.66 117.49 3dlb s GLN 84 Ca 0.00 -0.13 0.05 0.00 -1.95 0.00 0.00 55.36 53.32 3dlb s GLN 84 Cb 0.00 -2.86 -0.00 0.00 -0.22 0.00 0.00 33.01 29.93 3dlb s GLN 84 CO 0.00 0.47 -0.21 -0.08 -0.25 0.00 0.00 175.29 175.22 3dlb s THR 85 N -1.67 1.74 0.08 -0.19 -1.32 -1.26 0.58 115.64 113.59 3dlb s THR 85 Ca 0.40 -0.87 0.09 0.00 -1.21 0.00 0.00 61.69 60.10 3dlb s THR 85 Cb -0.12 -1.49 -0.03 0.00 -1.51 0.00 0.00 72.50 69.34 3dlb s THR 85 CO 0.25 0.49 -0.24 -0.31 -2.21 0.00 0.00 174.62 172.60 3dlb s TYR 86 N 0.10 2.11 -0.15 9.09 1.51 0.01 -4.66 117.35 125.36 3dlb s TYR 86 Ca -0.08 -0.40 -0.10 0.00 -1.01 0.00 0.00 57.07 55.48 3dlb s TYR 86 Cb -0.14 -1.21 -0.05 0.00 -0.11 0.00 0.00 41.96 40.45 3dlb s TYR 86 CO 0.04 0.19 0.18 0.00 -1.11 0.00 0.00 175.55 174.85 3dlb s ALA 87 N -0.93 3.75 0.29 3.71 0.00 0.33 -1.00 121.76 127.91 3dlb s ALA 87 Ca 0.10 -0.59 0.10 0.00 0.00 0.00 0.00 51.96 51.57 3dlb s ALA 87 Cb -0.10 -2.15 -0.06 0.00 0.00 0.00 0.00 23.12 20.82 3dlb s ALA 87 CO 0.03 0.35 -0.14 1.52 0.00 0.00 0.00 175.76 177.53 3dlb s TYR 88 N -0.27 2.21 -0.19 0.00 1.13 -0.39 -1.26 117.35 118.57 3dlb s TYR 88 Ca 0.13 -0.47 -0.10 0.00 -1.41 0.00 0.00 57.07 55.23 3dlb s TYR 88 Cb -0.12 -1.11 0.07 0.00 -1.10 0.00 0.00 41.96 39.69 3dlb s TYR 88 CO 0.03 0.57 0.46 0.50 -2.51 0.00 0.00 175.55 174.59 3dlb s ARG 89 N -3.59 0.43 0.06 -3.49 3.52 -0.90 -3.04 118.95 111.94 3dlb s ARG 89 Ca 0.30 0.91 -0.01 0.00 -0.13 0.00 0.00 55.73 56.79 3dlb s ARG 89 Cb -0.01 0.08 -0.04 0.00 -1.56 0.00 0.00 34.95 33.42 3dlb s ARG 89 CO 0.14 -0.17 0.24 -0.51 -0.81 0.00 0.00 175.30 174.18 3dlb s LEU 90 N 1.68 4.35 -0.19 -0.88 1.43 -0.61 -2.06 118.68 122.40 3dlb s LEU 90 Ca -0.08 0.34 -0.02 0.00 -1.03 0.00 0.00 54.13 53.34 3dlb s LEU 90 Cb -0.09 -2.97 0.06 0.00 0.03 0.00 0.00 46.19 43.22 3dlb s LEU 90 CO -0.14 0.16 0.01 -0.31 0.23 0.00 0.00 176.35 176.31 3dlb s TYR 91 N -1.51 1.27 0.58 0.29 1.51 -0.12 -4.93 117.35 114.44 3dlb s TYR 91 Ca 0.35 -0.96 -0.19 0.00 -1.01 0.00 0.00 57.07 55.26 3dlb s TYR 91 Cb -0.13 -1.12 -0.04 0.00 -0.11 0.00 0.00 41.96 40.56 3dlb s TYR 91 CO 0.26 -0.61 1.21 -2.14 -1.11 0.00 0.00 175.55 173.16 3dlb s PRO 92 N 1.78 3.03 0.00 -1.71 0.02 -1.26 -1.01 135.00 135.85 3dlb s PRO 92 Ca -0.01 1.84 0.00 0.00 0.02 0.00 0.00 61.00 62.85 3dlb s PRO 92 Cb -0.17 -1.97 0.00 0.00 0.02 0.00 0.00 34.50 32.38 3dlb s PRO 92 CO -0.07 -1.16 0.81 1.63 -0.33 0.00 0.00 177.00 177.87 3dlb n LYS 93 N -1.50 0.00 -0.37 5.54 4.76 -1.20 -4.89 118.16 120.50 3dlb n LYS 93 Ca 0.13 -0.70 0.00 0.00 -2.87 0.00 0.00 58.31 54.88 3dlb n LYS 93 Cb 0.49 -0.37 -0.00 0.00 -1.84 0.00 0.00 35.03 33.31 3dlb n LYS 93 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3dlb n GLY 94 N 0.00 -3.06 3.32 0.72 0.00 -1.26 -4.92 105.19 99.99 3dlb n GLY 94 Ca 0.00 -1.21 -0.40 0.00 0.00 0.00 0.00 46.02 44.41 3dlb n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dlb n ARG 95 N -1.85 0.15 -3.93 1.61 1.74 -1.26 -3.94 116.66 109.16 3dlb n ARG 95 Ca -0.00 0.06 -0.15 0.00 -0.77 0.00 0.00 57.85 56.98 3dlb n ARG 95 Cb 0.12 -1.17 -0.15 0.00 -1.02 0.00 0.00 32.46 30.24 3dlb n ARG 95 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 3dlb s ARG 96 N -1.25 0.20 0.28 5.56 3.52 -0.12 -4.88 118.95 122.26 3dlb s ARG 96 Ca 0.60 0.02 -0.22 0.00 -0.13 0.00 0.00 55.73 56.01 3dlb s ARG 96 Cb -0.54 -0.31 -0.09 0.00 -1.56 0.00 0.00 34.95 32.45 3dlb s ARG 96 CO 0.62 -0.06 0.82 -1.25 -0.81 0.00 0.00 175.30 174.62 3dlb s PRO 97 N 0.55 4.35 -0.00 5.12 0.04 -1.26 -3.11 135.00 140.69 3dlb s PRO 97 Ca -0.05 1.03 0.03 0.00 0.04 0.00 0.00 61.00 62.06 3dlb s PRO 97 Cb -0.08 -2.76 -0.01 0.00 0.04 0.00 0.00 34.50 31.69 3dlb s PRO 97 CO -0.01 0.30 -0.11 -0.51 0.04 0.00 0.00 177.00 176.71 3dlb s LEU 98 N -2.18 2.04 -0.20 -3.56 1.02 -0.87 -5.01 118.68 109.92 3dlb s LEU 98 Ca 0.48 -0.23 -0.15 0.00 0.02 0.00 0.00 54.13 54.26 3dlb s LEU 98 Cb -0.16 -0.56 -0.04 0.00 0.02 0.00 0.00 46.19 45.45 3dlb s LEU 98 CO 0.21 0.12 0.34 -1.81 0.02 0.00 0.00 176.35 175.23 3dlb s ASP 99 N -0.36 6.39 0.00 2.29 1.11 -1.26 -4.88 116.67 119.96 3dlb s ASP 99 Ca 0.04 0.46 0.00 0.00 0.18 0.00 0.00 52.55 53.23 3dlb s ASP 99 Cb -0.05 -2.20 0.00 0.00 1.07 0.00 0.00 42.92 41.74 3dlb s ASP 99 CO -0.00 -0.01 0.26 -2.65 1.18 0.00 0.00 175.17 173.95 3dlb n PRO 100 N 4.21 0.45 0.00 8.23 -0.02 -1.26 -2.75 135.00 143.86 3dlb n PRO 100 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 3dlb n PRO 100 Cb 0.51 -1.19 0.00 0.00 -0.02 0.00 0.00 33.50 32.81 3dlb n PRO 100 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3dlb n LYS 101 N 0.14 0.65 -3.54 -0.52 4.01 -1.26 -4.27 118.16 113.36 3dlb n LYS 101 Ca 0.00 -0.72 -0.29 0.00 -0.51 0.00 0.00 58.31 56.79 3dlb n LYS 101 Cb 0.09 -0.81 -0.08 0.00 -0.51 0.00 0.00 35.03 33.72 3dlb n LYS 101 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 3dlb n ASP 102 N -0.16 3.79 0.00 4.39 4.64 -1.11 -5.00 116.55 123.11 3dlb n ASP 102 Ca 0.00 -3.36 0.00 0.00 -1.38 0.00 0.00 54.79 50.05 3dlb n ASP 102 Cb 0.22 -0.77 0.00 0.00 -1.04 0.00 0.00 41.12 39.54 3dlb n ASP 102 CO 0.00 0.00 0.00 -0.81 -0.82 0.00 0.00 177.20 175.57 3dlb n PRO 103 N 1.29 0.00 0.14 -0.67 -0.04 -1.26 -1.12 135.00 133.34 3dlb n PRO 103 Ca 0.26 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.56 3dlb n PRO 103 Cb 0.38 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.75 3dlb n PRO 103 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 3dlb h GLY 104 N 0.00 -1.19 2.00 0.55 0.00 -1.94 -1.84 103.07 100.65 3dlb h GLY 104 Ca 0.00 0.63 -0.01 0.00 0.00 0.00 0.00 47.33 47.95 3dlb h GLY 104 CO 0.00 -0.30 -0.03 0.83 0.00 0.00 0.00 176.54 177.04 3dlb h GLU 105 N -0.77 0.00 -0.00 4.80 5.08 -1.37 0.16 114.58 122.47 3dlb h GLU 105 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 3dlb h GLU 105 Cb 0.74 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.99 3dlb h GLU 105 CO -0.23 0.03 -0.36 -2.13 -1.00 0.00 0.00 179.01 175.33 3dlb n ARG 106 N -3.80 0.27 0.03 2.33 0.63 -0.95 -2.68 116.66 112.49 3dlb n ARG 106 Ca -0.03 -0.14 -0.04 0.00 -0.92 0.00 0.00 57.85 56.72 3dlb n ARG 106 Cb 0.12 -1.50 0.17 0.00 0.45 0.00 0.00 32.46 31.71 3dlb n ARG 106 CO 0.00 0.00 0.00 0.77 -2.51 0.00 0.00 177.63 175.89 3dlb h SER 107 N 0.34 0.45 -0.08 6.15 0.02 0.14 -0.86 113.55 119.72 3dlb h SER 107 Ca 0.00 -0.18 -0.04 0.00 -0.84 0.00 0.00 61.79 60.73 3dlb h SER 107 Cb 0.49 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 62.90 3dlb h SER 107 CO 0.00 0.78 -0.10 0.58 -1.14 0.00 0.00 176.83 176.95 3dlb h VAL 108 N 0.37 1.39 -0.94 2.27 2.07 -1.50 -0.93 116.25 118.98 3dlb h VAL 108 Ca 0.04 -1.32 0.03 0.00 0.82 0.00 0.00 66.70 66.27 3dlb h VAL 108 Cb 0.81 2.09 -0.05 0.00 -1.52 0.00 0.00 31.29 32.61 3dlb h VAL 108 CO 0.07 0.37 0.62 -0.07 0.02 0.00 0.00 177.57 178.57 3dlb h LEU 109 N -0.25 1.03 -0.60 2.57 3.38 -1.34 0.46 115.31 120.58 3dlb h LEU 109 Ca 0.01 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.83 3dlb h LEU 109 Cb 0.65 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3dlb h LEU 109 CO 0.02 0.72 -0.36 0.28 0.09 0.00 0.00 178.44 179.19 3dlb h SER 110 N 1.21 0.75 -0.31 -0.43 0.02 -1.12 0.52 113.55 114.19 3dlb h SER 110 Ca 0.37 -0.32 -0.00 0.00 -0.84 0.00 0.00 61.79 60.99 3dlb h SER 110 Cb -0.03 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 3dlb h SER 110 CO -0.11 1.03 0.17 0.00 -1.14 0.00 0.00 176.83 176.79 3dlb h ALA 111 N 1.00 0.39 0.44 3.77 0.00 0.25 0.42 119.26 125.54 3dlb h ALA 111 Ca 0.06 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3dlb h ALA 111 Cb 0.89 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3dlb h ALA 111 CO 0.08 -0.09 -0.31 -0.07 0.00 0.00 0.00 179.25 178.86 3dlb h LEU 112 N 0.38 -0.80 -0.77 0.00 3.38 0.15 0.69 115.31 118.33 3dlb h LEU 112 Ca 0.11 0.06 0.18 0.00 0.09 0.00 0.00 57.88 58.32 3dlb h LEU 112 Cb 0.05 0.25 -0.13 0.00 0.09 0.00 0.00 40.66 40.92 3dlb h LEU 112 CO -0.02 -0.47 0.11 0.00 0.09 0.00 0.00 178.44 178.15 3dlb h ALA 113 N -0.25 0.95 -0.18 1.53 0.00 0.44 0.05 119.26 121.79 3dlb h ALA 113 Ca -0.04 0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 3dlb h ALA 113 Cb 0.62 0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 3dlb h ALA 113 CO 0.02 -0.40 -0.40 -0.09 0.00 0.00 0.00 179.25 178.38 3dlb h ARG 114 N 0.18 0.42 -0.26 0.00 2.43 0.39 -2.40 114.38 115.14 3dlb h ARG 114 Ca 0.44 -0.20 -0.14 0.00 -0.81 0.00 0.00 59.98 59.27 3dlb h ARG 114 Cb 0.80 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.35 3dlb h ARG 114 CO -0.61 0.75 -0.40 -0.09 -1.51 0.00 0.00 179.97 178.11 3dlb h ARG 115 N 0.35 0.72 0.10 0.20 9.65 0.40 -3.13 114.38 122.67 3dlb h ARG 115 Ca 0.03 -0.43 0.02 0.00 -1.10 0.00 0.00 59.98 58.50 3dlb h ARG 115 Cb 0.85 0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 29.43 3dlb h ARG 115 CO 0.07 1.06 -0.40 1.25 2.80 0.00 0.00 179.97 184.75 3dlb h LEU 116 N 0.45 -1.17 -0.78 3.80 5.85 -0.85 -0.28 115.31 122.33 3dlb h LEU 116 Ca 0.02 0.13 0.15 0.00 0.84 0.00 0.00 57.88 59.03 3dlb h LEU 116 Cb 0.99 0.44 -0.15 0.00 0.37 0.00 0.00 40.66 42.32 3dlb h LEU 116 CO 0.09 -0.47 -0.20 0.25 -0.34 0.00 0.00 178.44 177.78 3dlb h LEU 117 N -0.62 -0.73 -0.65 2.25 5.85 -1.45 0.48 115.31 120.45 3dlb h LEU 117 Ca 0.03 0.23 0.03 0.00 0.84 0.00 0.00 57.88 59.01 3dlb h LEU 117 Cb 0.65 0.48 -0.04 0.00 0.37 0.00 0.00 40.66 42.13 3dlb h LEU 117 CO -0.24 -0.26 0.40 1.56 -0.34 0.00 0.00 178.44 179.56 3dlb h GLN 118 N -0.00 0.75 -0.76 1.25 4.20 -1.19 0.92 115.11 120.28 3dlb h GLN 118 Ca 0.37 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 59.02 3dlb h GLN 118 Cb 0.57 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 28.14 3dlb h GLN 118 CO -0.80 0.50 0.41 0.93 -0.67 0.00 0.00 178.83 179.20 3dlb h GLU 119 N 0.78 1.07 -0.06 1.46 5.08 0.14 -1.74 114.58 121.30 3dlb h GLU 119 Ca 0.26 -0.13 -0.17 0.00 -1.00 0.00 0.00 59.36 58.33 3dlb h GLU 119 Cb 0.04 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 3dlb h GLU 119 CO -0.11 0.80 -0.69 0.00 -1.00 0.00 0.00 179.01 178.01 3dlb h ARG 120 N 1.06 0.27 0.00 2.33 3.08 0.65 -3.08 114.38 118.69 3dlb h ARG 120 Ca 0.27 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 3dlb h ARG 120 Cb 0.05 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 3dlb h ARG 120 CO -0.04 0.85 -0.07 -0.07 -1.07 0.00 0.00 179.97 179.57 3dlb h LEU 121 N 0.19 0.00 0.32 3.04 4.07 0.13 -3.15 115.31 119.91 3dlb h LEU 121 Ca -0.02 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 3dlb h LEU 121 Cb 1.24 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.98 3dlb h LEU 121 CO 0.11 0.07 -0.15 -0.09 -1.08 0.00 0.00 178.44 177.30 3dlb h ARG 122 N 0.00 -0.41 -0.96 1.13 2.43 -1.24 -3.26 114.38 112.08 3dlb h ARG 122 Ca -0.00 0.03 0.21 0.00 -0.81 0.00 0.00 59.98 59.41 3dlb h ARG 122 Cb 0.39 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 29.96 3dlb h ARG 122 CO 0.01 -0.08 0.62 0.00 -1.51 0.00 0.00 179.97 179.00 3dlb h ARG 123 N -0.80 0.50 -6.56 0.20 3.08 -1.66 -3.42 114.38 105.72 3dlb h ARG 123 Ca -0.04 -0.03 -0.59 0.00 0.07 0.00 0.00 59.98 59.39 3dlb h ARG 123 Cb 0.52 -0.11 0.08 0.00 0.08 0.00 0.00 29.97 30.53 3dlb h ARG 123 CO 0.07 0.33 0.60 1.47 -1.07 0.00 0.00 179.97 181.38 3dlb n LEU 124 N -4.60 2.99 -4.69 3.04 -0.00 -1.23 -4.97 117.00 107.53 3dlb n LEU 124 Ca 0.21 1.14 -0.30 0.00 -0.00 0.00 0.00 56.01 57.06 3dlb n LEU 124 Cb 0.69 -1.41 -0.09 0.00 -0.00 0.00 0.00 43.42 42.60 3dlb n LEU 124 CO 0.27 -0.53 -0.27 -0.70 -0.00 0.00 0.00 177.39 176.16 3dlb s GLU 125 N -0.30 2.08 -0.18 1.47 2.12 -1.26 -4.67 118.70 117.96 3dlb s GLU 125 Ca 0.69 -2.25 0.00 0.00 0.36 0.00 0.00 54.97 53.78 3dlb s GLU 125 Cb -0.67 -1.60 0.00 0.00 0.26 0.00 0.00 34.13 32.13 3dlb s GLU 125 CO 0.49 -0.21 0.00 0.41 -0.54 0.00 0.00 175.26 175.41 3dlb n GLY 126 N -1.12 0.42 3.29 -1.50 0.00 -1.26 -4.95 105.19 100.07 3dlb n GLY 126 Ca -0.12 -0.10 -0.13 0.00 0.00 0.00 0.00 46.02 45.66 3dlb n GLY 126 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dlb s VAL 127 N -1.68 0.01 -0.12 1.61 1.01 -1.26 -4.99 120.40 114.98 3dlb s VAL 127 Ca 0.00 -0.11 -0.06 0.00 0.00 0.00 0.00 61.98 61.81 3dlb s VAL 127 Cb 0.00 -0.59 -0.04 0.00 0.00 0.00 0.00 36.38 35.75 3dlb s VAL 127 CO 0.00 -0.06 0.09 0.86 0.00 0.00 0.00 175.10 175.99 3dlb s TRP 128 N -0.21 3.44 -0.18 5.22 -0.00 -1.25 -4.95 118.94 121.02 3dlb s TRP 128 Ca -0.04 0.40 0.01 0.00 -0.00 0.00 0.00 56.10 56.47 3dlb s TRP 128 Cb -0.03 -1.91 0.03 0.00 -0.00 0.00 0.00 33.47 31.55 3dlb s TRP 128 CO 0.02 0.61 -0.15 0.08 -0.00 0.00 0.00 176.95 177.50 3dlb s VAL 129 N -0.84 1.81 -0.64 5.86 1.01 -1.26 -2.73 120.40 123.61 3dlb s VAL 129 Ca 0.13 -0.89 -0.10 0.00 0.00 0.00 0.00 61.98 61.13 3dlb s VAL 129 Cb -0.12 -1.72 0.17 0.00 0.00 0.00 0.00 36.38 34.70 3dlb s VAL 129 CO 0.03 0.40 0.53 -1.83 0.00 0.00 0.00 175.10 174.23 3dlb s GLU 130 N 1.37 2.92 2.41 2.72 -1.05 -0.59 -4.90 118.70 121.58 3dlb s GLU 130 Ca 0.03 -2.22 0.00 0.00 -0.15 0.00 0.00 54.97 52.63 3dlb s GLU 130 Cb -0.14 -4.07 0.00 0.00 -0.44 0.00 0.00 34.13 29.48 3dlb s GLU 130 CO -0.11 -1.23 0.00 0.41 0.95 0.00 0.00 175.26 175.28 3dlb n GLY 131 N 4.21 1.91 0.00 -3.83 0.00 -1.26 -2.64 105.19 103.59 3dlb n GLY 131 Ca 0.03 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3dlb n GLY 131 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dlb n LEU 132 N 0.00 0.38 -4.53 0.99 4.77 -1.26 -4.79 117.00 112.55 3dlb n LEU 132 Ca 0.00 -0.54 -0.43 0.00 -0.03 0.00 0.00 56.01 55.01 3dlb n LEU 132 Cb 0.00 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.03 3dlb n LEU 132 CO 0.00 0.10 0.47 0.00 -1.33 0.00 0.00 177.39 176.63 3dlb s ALA 133 N -0.33 3.33 0.36 -1.18 0.00 -1.08 -2.10 121.76 120.76 3dlb s ALA 133 Ca 0.00 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 50.89 3dlb s ALA 133 Cb 0.00 -3.38 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 3dlb s ALA 133 CO 0.00 -1.82 0.56 0.08 0.00 0.00 0.00 175.76 174.58 3dlb s VAL 134 N 3.04 4.85 -0.15 0.00 1.01 -0.96 -1.54 120.40 126.66 3dlb s VAL 134 Ca 0.26 -0.52 -0.04 0.00 0.00 0.00 0.00 61.98 61.69 3dlb s VAL 134 Cb -0.13 -3.77 0.07 0.00 0.00 0.00 0.00 36.38 32.55 3dlb s VAL 134 CO 0.20 -0.49 0.23 -0.31 0.00 0.00 0.00 175.10 174.74 3dlb s TYR 135 N -2.34 -0.34 0.00 5.22 2.02 -1.10 -2.23 117.35 118.57 3dlb s TYR 135 Ca 0.42 0.66 0.00 0.00 -0.37 0.00 0.00 57.07 57.77 3dlb s TYR 135 Cb -0.10 -0.19 0.00 0.00 -0.40 0.00 0.00 41.96 41.28 3dlb s TYR 135 CO 0.36 -0.43 0.00 -2.13 -1.57 0.00 0.00 175.55 171.78 3dlb n ARG 136 N 5.34 0.00 -2.29 -0.62 3.00 0.06 -3.82 116.66 118.32 3dlb n ARG 136 Ca -0.05 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.39 3dlb n ARG 136 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 32.46 32.92 3dlb n ARG 136 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 3dlb s ARG 137 N 0.04 4.47 -0.16 -0.14 3.52 -1.22 -4.79 118.95 120.69 3dlb s ARG 137 Ca 0.00 2.00 -0.24 0.00 -0.13 0.00 0.00 55.73 57.35 3dlb s ARG 137 Cb 0.00 -3.16 -0.02 0.00 -1.56 0.00 0.00 34.95 30.21 3dlb s ARG 137 CO 0.00 -0.06 0.79 -1.83 -0.81 0.00 0.00 175.30 173.38 3dlb s GLU 138 N -1.03 4.31 0.35 5.12 4.04 -1.26 0.88 118.70 131.11 3dlb s GLU 138 Ca 0.50 0.94 0.22 0.00 0.04 0.00 0.00 54.97 56.68 3dlb s GLU 138 Cb -0.35 -3.56 0.22 0.00 0.02 0.00 0.00 34.13 30.46 3dlb s GLU 138 CO 0.43 -0.26 1.41 0.45 -1.84 0.00 0.00 175.26 175.46 3dlb h HIS 139 N 7.27 0.00 -1.78 4.83 3.86 -0.11 -3.46 115.15 125.76 3dlb h HIS 139 Ca -0.31 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.90 3dlb h HIS 139 Cb 1.14 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.61 3dlb h HIS 139 CO 0.71 0.02 0.00 0.00 0.86 0.00 0.00 177.93 179.52 3dlb n ALA 140 N -2.13 0.00 -3.65 2.45 0.00 -0.52 -4.94 120.51 111.72 3dlb n ALA 140 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.46 3dlb n ALA 140 Cb 0.55 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.93 3dlb n ALA 140 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3dlb s ARG 141 N -1.34 0.17 0.21 0.00 0.52 -1.25 -4.33 118.95 112.93 3dlb s ARG 141 Ca 0.00 0.27 -0.10 0.00 -0.52 0.00 0.00 55.73 55.38 3dlb s ARG 141 Cb 0.00 0.05 0.04 0.00 0.52 0.00 0.00 34.95 35.56 3dlb s ARG 141 CO 0.00 -0.03 0.52 0.41 0.02 0.00 0.00 175.30 176.22 3dlb n GLY 142 N 2.89 1.26 3.41 -3.53 0.00 0.18 -4.94 105.19 104.47 3dlb n GLY 142 Ca -0.16 -1.14 -0.38 0.00 0.00 0.00 0.00 46.02 44.34 3dlb n GLY 142 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3dlb n PRO 143 N -0.35 2.48 0.00 1.61 -0.04 -1.26 -3.68 135.00 133.75 3dlb n PRO 143 Ca -0.05 -2.78 0.00 0.00 -0.04 0.00 0.00 63.50 60.63 3dlb n PRO 143 Cb 0.36 -3.48 0.00 0.00 -0.04 0.00 0.00 33.50 30.34 3dlb n PRO 143 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3dlb n GLY 144 N 5.24 3.09 3.80 0.55 0.00 -1.26 -4.96 105.19 111.65 3dlb n GLY 144 Ca 0.48 -1.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.02 3dlb n GLY 144 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3dlb s TRP 145 N -0.01 3.43 -0.45 1.61 -2.14 -1.24 -1.06 118.94 119.08 3dlb s TRP 145 Ca 0.00 0.39 0.07 0.00 2.66 0.00 0.00 56.10 59.22 3dlb s TRP 145 Cb 0.00 -1.90 0.24 0.00 -3.10 0.00 0.00 33.47 28.71 3dlb s TRP 145 CO 0.00 0.61 0.74 -2.13 -2.66 0.00 0.00 176.95 173.51 3dlb n ARG 146 N 2.15 0.75 -1.51 3.25 0.63 -1.06 0.50 116.66 121.38 3dlb n ARG 146 Ca -0.19 -2.32 -0.49 0.00 -0.92 0.00 0.00 57.85 53.92 3dlb n ARG 146 Cb 0.54 -1.37 -0.06 0.00 0.45 0.00 0.00 32.46 32.02 3dlb n ARG 146 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 3dlb n VAL 147 N 1.58 0.26 -3.53 5.15 0.31 -1.26 -4.38 118.33 116.47 3dlb n VAL 147 Ca 0.14 -0.27 -0.23 0.00 -0.01 0.00 0.00 64.34 63.97 3dlb n VAL 147 Cb 0.59 -1.81 -0.01 0.00 -0.91 0.00 0.00 33.84 31.70 3dlb n VAL 147 CO 0.00 0.00 0.00 -1.48 -1.32 0.00 0.00 176.83 174.03 3dlb s LEU 148 N 7.01 4.08 -0.06 7.52 -0.00 -1.16 0.59 118.68 136.66 3dlb s LEU 148 Ca 1.06 0.30 0.04 0.00 -0.00 0.00 0.00 54.13 55.54 3dlb s LEU 148 Cb -0.76 -3.15 -0.02 0.00 -0.00 0.00 0.00 46.19 42.26 3dlb s LEU 148 CO 0.48 -0.26 -0.19 -0.83 -0.00 0.00 0.00 176.35 175.55 3dlb s GLY 149 N -4.04 1.43 0.00 -3.48 0.00 0.25 -3.32 107.32 98.17 3dlb s GLY 149 Ca 0.39 -1.01 0.00 0.00 0.00 0.00 0.00 44.72 44.10 3dlb s GLY 149 CO 0.34 -0.70 0.00 0.61 0.00 0.00 0.00 173.10 173.35 3dlb n GLY 150 N 2.62 1.77 3.33 0.20 0.00 -0.46 -0.76 105.19 111.88 3dlb n GLY 150 Ca -0.17 -0.34 -0.15 0.00 0.00 0.00 0.00 46.02 45.36 3dlb n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dlb s ALA 151 N -1.00 -1.10 -0.06 4.61 0.00 -0.95 0.21 121.76 123.47 3dlb s ALA 151 Ca 0.00 0.64 -0.24 0.00 0.00 0.00 0.00 51.96 52.36 3dlb s ALA 151 Cb 0.00 0.06 -0.03 0.00 0.00 0.00 0.00 23.12 23.14 3dlb s ALA 151 CO 0.00 -0.30 0.75 0.14 0.00 0.00 0.00 175.76 176.35 3dlb s VAL 152 N -1.30 5.01 0.49 0.00 -7.23 -0.88 -2.25 120.40 114.24 3dlb s VAL 152 Ca -0.13 1.54 0.06 0.00 -1.81 0.00 0.00 61.98 61.64 3dlb s VAL 152 Cb -0.04 -4.09 -0.00 0.00 0.56 0.00 0.00 36.38 32.82 3dlb s VAL 152 CO 0.06 0.23 0.28 -0.76 -0.31 0.00 0.00 175.10 174.59 3dlb s LEU 153 N 0.90 2.84 -0.25 1.32 1.43 -0.89 -2.76 118.68 121.27 3dlb s LEU 153 Ca 0.40 -1.20 -0.27 0.00 -1.03 0.00 0.00 54.13 52.02 3dlb s LEU 153 Cb -0.18 -1.29 0.14 0.00 0.03 0.00 0.00 46.19 44.90 3dlb s LEU 153 CO 0.19 -0.85 1.13 -0.62 0.23 0.00 0.00 176.35 176.43 3dlb s ASP 154 N -4.09 -0.30 -0.01 2.29 2.15 -1.13 -4.81 116.67 110.76 3dlb s ASP 154 Ca 0.34 0.48 0.01 0.00 0.43 0.00 0.00 52.55 53.80 3dlb s ASP 154 Cb 0.00 0.45 0.00 0.00 -0.30 0.00 0.00 42.92 43.07 3dlb s ASP 154 CO 0.20 -0.18 -0.03 -0.22 -0.17 0.00 0.00 175.17 174.77 3dlb s LEU 155 N -0.40 1.89 0.00 -1.34 2.96 -1.26 -1.16 118.68 119.38 3dlb s LEU 155 Ca 0.03 -0.06 0.00 0.00 -0.22 0.00 0.00 54.13 53.88 3dlb s LEU 155 Cb -0.03 -0.18 0.00 0.00 0.50 0.00 0.00 46.19 46.48 3dlb s LEU 155 CO -0.06 0.02 0.00 -2.67 -1.32 0.00 0.00 176.35 172.33 3dlb n TRP 156 N 3.15 -0.36 -5.00 5.38 4.27 -0.99 -2.97 117.44 120.92 3dlb n TRP 156 Ca -0.15 0.00 -0.30 0.00 -3.89 0.00 0.00 57.50 53.16 3dlb n TRP 156 Cb 0.58 0.00 -0.15 0.00 -1.36 0.00 0.00 31.31 30.38 3dlb n TRP 156 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 3dlb s VAL 157 N -2.48 2.10 0.49 -1.67 1.01 -1.26 -2.10 120.40 116.48 3dlb s VAL 157 Ca 0.00 -1.31 0.00 0.00 0.00 0.00 0.00 61.98 60.67 3dlb s VAL 157 Cb 0.00 -1.78 0.01 0.00 0.00 0.00 0.00 36.38 34.61 3dlb s VAL 157 CO 0.00 0.41 0.71 -0.94 0.00 0.00 0.00 175.10 175.29 3dlb s SER 158 N -1.08 5.65 0.57 3.32 1.04 -0.37 -4.91 113.70 117.92 3dlb s SER 158 Ca 0.11 0.21 0.37 0.00 0.48 0.00 0.00 55.95 57.13 3dlb s SER 158 Cb -0.10 -1.34 1.83 0.00 0.10 0.00 0.00 66.02 66.52 3dlb s SER 158 CO 0.01 -0.85 2.13 -2.24 0.98 0.00 0.00 173.24 173.27 3dlb h ASP 159 N 0.27 0.00 -0.46 7.02 2.03 -1.91 -0.87 116.42 122.51 3dlb h ASP 159 Ca -0.45 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 55.79 3dlb h ASP 159 Cb 1.27 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.75 3dlb h ASP 159 CO 0.56 0.00 0.04 0.28 -1.03 0.00 0.00 179.24 179.09 3dlb h SER 160 N 0.00 0.76 0.00 4.15 0.02 -1.93 -3.42 113.55 113.13 3dlb h SER 160 Ca 0.00 -0.28 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 3dlb h SER 160 Cb 0.22 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.56 3dlb h SER 160 CO 0.00 0.86 0.00 0.61 -1.14 0.00 0.00 176.83 177.16 3dlb n GLY 161 N -0.45 1.95 3.52 -3.77 0.00 -0.33 -4.97 105.19 101.15 3dlb n GLY 161 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3dlb n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dlb s ALA 162 N -2.00 2.72 0.67 4.61 0.00 -1.26 -1.29 121.76 125.22 3dlb s ALA 162 Ca 0.00 -2.13 -0.12 0.00 0.00 0.00 0.00 51.96 49.70 3dlb s ALA 162 Cb 0.00 0.45 -0.00 0.00 0.00 0.00 0.00 23.12 23.57 3dlb s ALA 162 CO 0.00 -0.23 1.06 -0.06 0.00 0.00 0.00 175.76 176.53 3dlb s PHE 163 N -3.05 3.01 -0.19 0.00 0.40 -0.73 -1.24 117.98 116.18 3dlb s PHE 163 Ca 0.35 1.47 -0.05 0.00 -0.60 0.00 0.00 56.93 58.10 3dlb s PHE 163 Cb 0.09 -2.94 0.09 0.00 0.51 0.00 0.00 43.02 40.77 3dlb s PHE 163 CO 0.16 -1.26 0.34 -1.17 0.70 0.00 0.00 175.22 173.99 3dlb s LEU 164 N -5.24 -0.48 -0.15 -0.37 2.96 -0.89 -2.26 118.68 112.25 3dlb s LEU 164 Ca 0.60 0.56 -0.07 0.00 -0.22 0.00 0.00 54.13 55.00 3dlb s LEU 164 Cb -0.15 0.99 -0.04 0.00 0.50 0.00 0.00 46.19 47.48 3dlb s LEU 164 CO 0.49 -0.26 0.09 -0.22 -1.32 0.00 0.00 176.35 175.13 3dlb s LEU 165 N 2.51 4.05 -0.08 -0.68 2.96 -0.02 -2.35 118.68 125.07 3dlb s LEU 165 Ca 0.04 0.25 0.01 0.00 -0.22 0.00 0.00 54.13 54.21 3dlb s LEU 165 Cb -0.13 -2.00 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 3dlb s LEU 165 CO -0.12 0.29 -0.09 -0.70 -1.32 0.00 0.00 176.35 174.41 3dlb s GLU 166 N -0.29 2.86 -0.01 1.98 2.12 -0.31 0.01 118.70 125.07 3dlb s GLU 166 Ca 0.10 -0.59 0.00 0.00 0.36 0.00 0.00 54.97 54.84 3dlb s GLU 166 Cb -0.12 -2.59 0.01 0.00 0.26 0.00 0.00 34.13 31.70 3dlb s GLU 166 CO 0.01 0.56 -0.01 0.08 -0.54 0.00 0.00 175.26 175.37 3dlb s VAL 167 N -0.54 0.11 -0.27 3.70 1.01 -0.94 -2.85 120.40 120.61 3dlb s VAL 167 Ca 0.08 0.01 -0.02 0.00 0.00 0.00 0.00 61.98 62.05 3dlb s VAL 167 Cb -0.12 -0.14 0.16 0.00 0.00 0.00 0.00 36.38 36.28 3dlb s VAL 167 CO 0.02 0.07 0.48 -0.62 0.00 0.00 0.00 175.10 175.05 3dlb s ASP 168 N 0.35 -0.52 0.05 3.32 2.15 -1.11 -4.84 116.67 116.06 3dlb s ASP 168 Ca -0.03 0.50 -0.33 0.00 0.43 0.00 0.00 52.55 53.12 3dlb s ASP 168 Cb -0.05 1.61 -0.17 0.00 -0.30 0.00 0.00 42.92 44.00 3dlb s ASP 168 CO -0.01 -0.28 0.82 -2.65 -0.17 0.00 0.00 175.17 172.88 3dlb n PRO 169 N 5.39 0.00 -3.97 4.34 -0.02 -1.26 -2.07 135.00 137.41 3dlb n PRO 169 Ca -0.02 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.36 3dlb n PRO 169 Cb 0.51 -1.23 -0.07 0.00 -0.02 0.00 0.00 33.50 32.69 3dlb n PRO 169 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dlb s ALA 170 N -0.27 -0.03 0.00 3.55 0.00 0.56 -4.79 121.76 120.78 3dlb s ALA 170 Ca 0.75 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 51.82 3dlb s ALA 170 Cb -1.06 0.94 0.00 0.00 0.00 0.00 0.00 23.12 23.00 3dlb s ALA 170 CO 0.51 -0.70 0.00 2.48 0.00 0.00 0.00 175.76 178.06 3dlb n TYR 171 N -0.26 -1.44 0.00 0.00 4.11 -1.26 -1.36 117.16 116.95 3dlb n TYR 171 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.84 3dlb n TYR 171 Cb 0.63 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.97 3dlb n TYR 171 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 3dlb n ARG 172 N -0.48 0.00 -2.27 -3.48 1.74 -1.21 -4.80 116.66 106.16 3dlb n ARG 172 Ca 0.00 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.68 3dlb n ARG 172 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.41 3dlb n ARG 172 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3dlb s ILE 173 N 0.00 3.59 -0.16 0.55 1.01 -1.26 -2.99 121.20 121.94 3dlb s ILE 173 Ca 0.00 0.43 -0.11 0.00 0.00 0.00 0.00 60.65 60.97 3dlb s ILE 173 Cb 0.00 -4.31 -0.05 0.00 0.01 0.00 0.00 42.46 38.12 3dlb s ILE 173 CO 0.00 -1.17 0.20 -0.22 0.00 0.00 0.00 174.94 173.75 3dlb s LEU 174 N 7.16 4.27 -0.29 2.97 2.96 -1.26 -4.96 118.68 129.52 3dlb s LEU 174 Ca 0.56 0.41 -0.03 0.00 -0.22 0.00 0.00 54.13 54.84 3dlb s LEU 174 Cb -0.12 -2.20 0.04 0.00 0.50 0.00 0.00 46.19 44.41 3dlb s LEU 174 CO 0.22 0.21 0.01 0.00 -1.32 0.00 0.00 176.35 175.47 3dlb n GLU 176 N 4.69 3.23 -0.08 0.00 -0.58 -0.23 -4.53 120.64 123.16 3dlb n GLU 176 Ca -0.14 -2.61 -0.17 0.00 -0.42 0.00 0.00 57.16 53.82 3dlb n GLU 176 Cb 0.45 -1.75 -0.13 0.00 -0.57 0.00 0.00 31.44 29.44 3dlb n GLU 176 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3dlb h MET 177 N 3.92 0.02 -0.06 3.49 -0.00 -1.93 -3.48 114.93 116.88 3dlb h MET 177 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 59.70 59.67 3dlb h MET 177 Cb 1.22 0.01 0.00 0.00 -0.00 0.00 0.00 31.60 32.83 3dlb h MET 177 CO 0.14 1.01 0.00 0.45 -0.00 0.00 0.00 176.91 178.52 3dlb n SER 178 N -4.52 -0.33 0.00 -0.10 2.88 -1.26 -4.44 113.62 105.85 3dlb n SER 178 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 3dlb n SER 178 Cb 0.57 0.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.07 3dlb n SER 178 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3dlb n LEU 179 N -0.05 0.00 -0.29 2.46 -0.00 -1.09 -0.26 117.00 117.77 3dlb n LEU 179 Ca 0.00 0.55 0.01 0.00 -0.00 0.00 0.00 56.01 56.58 3dlb n LEU 179 Cb 0.00 -0.22 0.08 0.00 -0.00 0.00 0.00 43.42 43.28 3dlb n LEU 179 CO 0.00 -0.22 0.67 -0.33 -0.00 0.00 0.00 177.39 177.51 3dlb h GLU 180 N 0.00 -0.03 0.69 1.96 4.39 -1.83 1.27 114.58 121.04 3dlb h GLU 180 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 3dlb h GLU 180 Cb 0.00 0.01 0.01 0.00 -0.10 0.00 0.00 28.75 28.66 3dlb h GLU 180 CO 0.00 -0.02 -0.33 0.00 -1.16 0.00 0.00 179.01 177.50 3dlb h ALA 181 N 1.64 -0.93 -0.95 3.43 0.00 -1.49 0.74 119.26 121.70 3dlb h ALA 181 Ca 0.37 -0.21 0.07 0.00 0.00 0.00 0.00 54.91 55.13 3dlb h ALA 181 Cb 0.60 0.36 -0.07 0.00 0.00 0.00 0.00 17.79 18.68 3dlb h ALA 181 CO -0.84 -0.99 0.61 2.35 0.00 0.00 0.00 179.25 180.38 3dlb h TRP 182 N -1.01 1.12 0.00 0.00 2.91 0.36 1.56 115.95 120.88 3dlb h TRP 182 Ca -0.10 0.03 0.00 0.00 1.13 0.00 0.00 58.89 59.96 3dlb h TRP 182 Cb 0.73 -0.36 0.00 0.00 -0.51 0.00 0.00 29.16 29.02 3dlb h TRP 182 CO -0.01 0.56 0.00 -0.11 -1.03 0.00 0.00 178.44 177.85 3dlb n LEU 183 N -4.55 0.59 -0.05 0.65 -0.00 0.43 -3.38 117.00 110.69 3dlb n LEU 183 Ca 0.15 0.61 -0.01 0.00 -0.00 0.00 0.00 56.01 56.76 3dlb n LEU 183 Cb 0.20 -0.48 -0.00 0.00 -0.00 0.00 0.00 43.42 43.13 3dlb n LEU 183 CO 0.31 -0.37 -0.06 0.00 -0.00 0.00 0.00 177.39 177.27 3dlb h ALA 184 N 2.42 0.00 0.00 1.96 0.00 0.87 -3.00 119.26 121.51 3dlb h ALA 184 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3dlb h ALA 184 Cb 0.48 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3dlb h ALA 184 CO 0.00 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.34 3dlb n GLN 185 N -4.30 0.68 -1.79 0.00 0.00 0.82 -4.85 117.38 107.93 3dlb n GLN 185 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 57.00 56.99 3dlb n GLN 185 Cb 0.05 -1.16 0.00 0.00 0.00 0.00 0.00 30.24 29.13 3dlb n GLN 185 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3dlb n GLY 186 N 1.21 -0.96 3.36 2.61 0.00 -1.13 -5.04 105.19 105.24 3dlb n GLY 186 Ca 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 3dlb n GLY 186 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3dlb s HIS 187 N -0.10 0.61 -0.16 1.61 3.76 -1.22 -4.97 115.29 114.83 3dlb s HIS 187 Ca 0.00 -0.94 -0.28 0.00 -0.15 0.00 0.00 55.06 53.69 3dlb s HIS 187 Cb 0.00 -0.15 -0.01 0.00 1.11 0.00 0.00 32.58 33.54 3dlb s HIS 187 CO 0.00 -0.76 0.96 -1.25 -0.85 0.00 0.00 174.74 172.84 3dlb s PRO 188 N -4.04 4.34 0.14 8.40 0.04 -1.26 -4.80 135.00 137.83 3dlb s PRO 188 Ca 0.25 1.26 -0.33 0.00 0.04 0.00 0.00 61.00 62.22 3dlb s PRO 188 Cb 0.03 -3.58 -0.17 0.00 0.04 0.00 0.00 34.50 30.82 3dlb s PRO 188 CO 0.06 -0.40 0.88 1.28 0.04 0.00 0.00 177.00 178.85 3dlb n LEU 189 N 5.44 0.06 0.00 -3.56 4.77 -1.26 -4.95 117.00 117.50 3dlb n LEU 189 Ca 0.08 1.14 -0.25 0.00 -0.03 0.00 0.00 56.01 56.95 3dlb n LEU 189 Cb 0.48 -1.04 0.19 0.00 -2.33 0.00 0.00 43.42 40.73 3dlb n LEU 189 CO 0.51 -2.12 0.66 -0.81 -1.33 0.00 0.00 177.39 174.30 3dlb n PRO 190 N 1.33 -1.78 -0.02 3.23 -0.04 -1.26 -5.03 135.00 131.43 3dlb n PRO 190 Ca 0.17 -1.66 -0.21 0.00 -0.04 0.00 0.00 63.50 61.76 3dlb n PRO 190 Cb 0.20 -1.26 -0.13 0.00 -0.04 0.00 0.00 33.50 32.27 3dlb n PRO 190 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 3dlb n LYS 191 N -3.78 0.73 -5.20 0.54 0.00 -1.26 -4.63 118.16 104.55 3dlb n LYS 191 Ca 0.14 0.28 -0.31 0.00 -0.00 0.00 0.00 58.31 58.42 3dlb n LYS 191 Cb 0.50 -1.69 -0.16 0.00 -0.00 0.00 0.00 35.03 33.67 3dlb n LYS 191 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 3dlb s ARG 192 N -2.54 2.49 0.44 -1.58 3.03 -1.26 0.23 118.95 119.76 3dlb s ARG 192 Ca -0.25 -0.86 0.04 0.00 2.03 0.00 0.00 55.73 56.70 3dlb s ARG 192 Cb 0.07 -2.09 -0.05 0.00 -1.03 0.00 0.00 34.95 31.85 3dlb s ARG 192 CO 0.73 0.34 0.02 0.54 -1.13 0.00 0.00 175.30 175.80 3dlb s VAL 193 N -0.09 1.55 0.09 4.99 0.11 0.16 -2.98 120.40 124.23 3dlb s VAL 193 Ca -0.05 -2.00 -0.01 0.00 -2.93 0.00 0.00 61.98 56.99 3dlb s VAL 193 Cb -0.14 -2.64 -0.04 0.00 -1.53 0.00 0.00 36.38 32.03 3dlb s VAL 193 CO 0.04 0.00 0.01 -0.60 -3.33 0.00 0.00 175.10 171.22 3dlb s ARG 194 N -3.79 0.79 0.00 1.54 3.52 0.75 -0.03 118.95 121.72 3dlb s ARG 194 Ca 0.24 -1.34 0.00 0.00 -0.13 0.00 0.00 55.73 54.50 3dlb s ARG 194 Cb 0.06 0.18 0.00 0.00 -1.56 0.00 0.00 34.95 33.64 3dlb s ARG 194 CO 0.12 -0.17 0.00 0.09 -0.81 0.00 0.00 175.30 174.53 3dlb n ASN 195 N -0.00 0.00 -0.01 -2.12 3.02 -1.23 0.68 115.26 115.59 3dlb n ASN 195 Ca -0.10 -0.84 -0.01 0.00 -0.03 0.00 0.00 54.58 53.60 3dlb n ASN 195 Cb 0.62 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.76 3dlb n ASN 195 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3dlb n ALA 196 N -3.00 1.96 0.56 5.41 0.00 -1.11 -4.18 120.51 120.15 3dlb n ALA 196 Ca 0.00 -0.20 0.13 0.00 0.00 0.00 0.00 53.44 53.37 3dlb n ALA 196 Cb 0.00 0.11 0.33 0.00 0.00 0.00 0.00 19.45 19.89 3dlb n ALA 196 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.50 177.60 3dlb h TYR 197 N 0.00 0.00 -0.19 0.00 -0.00 -1.97 -3.49 116.97 111.32 3dlb h TYR 197 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.66 3dlb h TYR 197 Cb 0.99 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.72 3dlb h TYR 197 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 178.16 177.76 3dlb n ASP 198 N -2.34 0.00 -0.47 0.10 3.85 -1.26 -5.07 116.55 111.36 3dlb n ASP 198 Ca 0.05 0.00 0.06 0.00 -0.71 0.00 0.00 54.79 54.19 3dlb n ASP 198 Cb 0.45 0.00 0.05 0.00 -1.35 0.00 0.00 41.12 40.26 3dlb n ASP 198 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 3dlb n ARG 199 N 0.00 0.66 -2.16 0.11 5.12 -1.26 -4.69 116.66 114.45 3dlb n ARG 199 Ca 0.00 -1.19 -0.42 0.00 -1.93 0.00 0.00 57.85 54.31 3dlb n ARG 199 Cb 0.00 -1.22 -0.03 0.00 -1.16 0.00 0.00 32.46 30.05 3dlb n ARG 199 CO 0.00 0.00 0.00 -0.98 -1.93 0.00 0.00 177.63 174.72 3dlb s ARG 200 N -0.99 4.24 0.07 5.56 1.04 -1.26 -4.96 118.95 122.65 3dlb s ARG 200 Ca 0.14 2.02 0.01 0.00 -1.04 0.00 0.00 55.73 56.86 3dlb s ARG 200 Cb 0.10 -3.73 -0.04 0.00 -2.04 0.00 0.00 34.95 29.24 3dlb s ARG 200 CO 0.15 -0.69 0.19 -0.08 -0.04 0.00 0.00 175.30 174.82 3dlb s THR 201 N 3.07 5.19 0.35 4.99 -1.32 -1.26 -3.47 115.64 123.20 3dlb s THR 201 Ca 0.66 -0.50 0.03 0.00 -1.21 0.00 0.00 61.69 60.68 3dlb s THR 201 Cb -0.31 -3.54 -0.04 0.00 -1.51 0.00 0.00 72.50 67.09 3dlb s THR 201 CO 0.26 0.12 0.10 0.26 -2.21 0.00 0.00 174.62 173.15 3dlb s TRP 202 N -1.50 1.81 -0.20 9.09 0.52 0.95 -4.54 118.94 125.08 3dlb s TRP 202 Ca 0.34 -1.15 -0.05 0.00 0.02 0.00 0.00 56.10 55.25 3dlb s TRP 202 Cb -0.13 -1.16 -0.03 0.00 -1.15 0.00 0.00 33.47 31.01 3dlb s TRP 202 CO 0.27 -0.20 0.01 -1.83 0.02 0.00 0.00 176.95 175.22 3dlb s GLU 203 N -3.83 3.67 -0.15 4.98 1.03 -0.35 0.35 118.70 124.41 3dlb s GLU 203 Ca 0.31 -0.49 -0.29 0.00 0.03 0.00 0.00 54.97 54.52 3dlb s GLU 203 Cb 0.06 -3.10 -0.02 0.00 -0.80 0.00 0.00 34.13 30.27 3dlb s GLU 203 CO 0.15 0.05 1.28 -1.17 -1.33 0.00 0.00 175.26 174.24 3dlb s LEU 204 N 0.90 4.20 -0.10 1.83 1.98 0.13 -1.26 118.68 126.37 3dlb s LEU 204 Ca 0.01 1.74 0.08 0.00 -2.89 0.00 0.00 54.13 53.07 3dlb s LEU 204 Cb -0.14 -3.54 -0.24 0.00 0.66 0.00 0.00 46.19 42.93 3dlb s LEU 204 CO 0.02 -0.75 0.44 0.00 -1.89 0.00 0.00 176.35 174.17 3dlb n LEU 205 N 6.46 1.35 0.00 -0.68 -0.00 -0.66 -4.78 117.00 118.69 3dlb n LEU 205 Ca 0.14 0.27 0.00 0.00 -0.00 0.00 0.00 56.01 56.41 3dlb n LEU 205 Cb 0.45 -0.19 0.00 0.00 -0.00 0.00 0.00 43.42 43.68 3dlb n LEU 205 CO 0.56 0.56 0.00 -2.11 -0.00 0.00 0.00 177.39 176.40 3dlb n ARG 206 N -3.13 -2.01 -5.00 1.47 1.85 -0.99 -5.03 116.66 103.83 3dlb n ARG 206 Ca -0.25 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.29 3dlb n ARG 206 Cb 1.06 0.00 -0.14 0.00 -1.05 0.00 0.00 32.46 32.33 3dlb n ARG 206 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 3dlb s LEU 207 N 0.00 2.34 -0.70 2.89 0.20 -1.26 -2.05 118.68 120.10 3dlb s LEU 207 Ca 0.00 -0.43 -0.28 0.00 0.69 0.00 0.00 54.13 54.12 3dlb s LEU 207 Cb 0.00 -1.41 -0.13 0.00 -0.43 0.00 0.00 46.19 44.22 3dlb s LEU 207 CO 0.00 0.30 2.52 0.61 -0.29 0.00 0.00 176.35 179.49 3dlb n GLY 208 N 2.08 -0.09 0.19 7.98 0.00 0.17 -4.73 105.19 110.79 3dlb n GLY 208 Ca -0.16 0.83 0.02 0.00 0.00 0.00 0.00 46.02 46.71 3dlb n GLY 208 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3dlb n GLU 209 N 8.77 1.24 -4.12 1.61 0.28 -1.26 -4.40 120.64 122.77 3dlb n GLU 209 Ca 0.49 -0.38 -0.28 0.00 -0.16 0.00 0.00 57.16 56.83 3dlb n GLU 209 Cb 0.34 -1.09 -0.02 0.00 1.43 0.00 0.00 31.44 32.10 3dlb n GLU 209 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3dlb n GLU 210 N -0.20 0.71 -3.30 3.44 4.71 -1.26 -5.11 120.64 119.64 3dlb n GLU 210 Ca 0.04 -3.52 -0.41 0.00 -0.01 0.00 0.00 57.16 53.26 3dlb n GLU 210 Cb 0.09 0.58 -0.08 0.00 -1.01 0.00 0.00 31.44 31.02 3dlb n GLU 210 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 3dlb s ASP 211 N -4.06 6.26 -1.29 1.62 2.15 -1.26 -4.71 116.67 115.38 3dlb s ASP 211 Ca 0.20 -0.18 -0.09 0.00 0.43 0.00 0.00 52.55 52.91 3dlb s ASP 211 Cb -0.02 -2.24 -0.07 0.00 -0.30 0.00 0.00 42.92 40.29 3dlb s ASP 211 CO 0.13 -0.46 2.51 -0.81 -0.17 0.00 0.00 175.17 176.37 3dlb n PRO 212 N 5.63 2.87 0.00 4.34 -0.04 -1.26 -1.12 135.00 145.42 3dlb n PRO 212 Ca -0.06 -1.93 0.00 0.00 -0.04 0.00 0.00 63.50 61.47 3dlb n PRO 212 Cb 0.49 -2.72 0.00 0.00 -0.04 0.00 0.00 33.50 31.23 3dlb n PRO 212 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 3dlb n LYS 213 N 4.26 0.00 0.00 0.54 2.85 -1.26 -3.96 118.16 120.59 3dlb n LYS 213 Ca 0.61 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.87 3dlb n LYS 213 Cb 0.22 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.60 3dlb n LYS 213 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 3dlb n GLU 214 N 0.00 5.41 -2.91 -1.58 1.02 -0.81 -4.87 120.64 116.90 3dlb n GLU 214 Ca 0.00 -0.10 -0.43 0.00 -0.02 0.00 0.00 57.16 56.62 3dlb n GLU 214 Cb 0.00 -0.59 -0.05 0.00 -0.02 0.00 0.00 31.44 30.78 3dlb n GLU 214 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3dlb s LEU 215 N -1.60 4.13 -0.04 -4.62 2.96 -0.28 -4.99 118.68 114.24 3dlb s LEU 215 Ca 0.00 0.09 -0.11 0.00 -0.22 0.00 0.00 54.13 53.89 3dlb s LEU 215 Cb 0.00 -3.07 -0.05 0.00 0.50 0.00 0.00 46.19 43.57 3dlb s LEU 215 CO 0.00 -0.92 0.29 -2.16 -1.32 0.00 0.00 176.35 172.24 3dlb s PRO 216 N 3.42 3.70 0.97 0.98 0.04 -1.26 -0.17 135.00 142.67 3dlb s PRO 216 Ca 0.33 0.16 -0.15 0.00 0.04 0.00 0.00 61.00 61.38 3dlb s PRO 216 Cb -0.12 -3.19 0.18 0.00 0.04 0.00 0.00 34.50 31.42 3dlb s PRO 216 CO 0.23 0.72 1.23 -0.51 0.04 0.00 0.00 177.00 178.71 3dlb s LEU 217 N -1.15 2.23 0.19 -3.56 2.01 0.70 -4.83 118.68 114.27 3dlb s LEU 217 Ca 0.21 0.54 -0.20 0.00 0.01 0.00 0.00 54.13 54.68 3dlb s LEU 217 Cb -0.15 -2.65 0.13 0.00 0.01 0.00 0.00 46.19 43.53 3dlb s LEU 217 CO 0.10 -2.78 1.59 -0.65 1.01 0.00 0.00 176.35 175.63 3dlb h PRO 218 N -1.67 -0.15 -0.98 1.29 0.11 -1.99 0.29 132.00 128.89 3dlb h PRO 218 Ca -0.46 0.01 0.23 0.00 0.11 0.00 0.00 66.00 65.89 3dlb h PRO 218 Cb 1.28 0.04 -0.08 0.00 0.11 0.00 0.00 31.00 32.34 3dlb h PRO 218 CO 0.46 -0.10 0.63 0.78 -0.21 0.00 0.00 178.00 179.57 3dlb h GLY 219 N -0.16 1.12 0.00 -0.55 0.00 -2.04 -3.43 103.07 98.01 3dlb h GLY 219 Ca 0.23 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.34 3dlb h GLY 219 CO -0.64 -0.06 0.00 0.61 0.00 0.00 0.00 176.54 176.44 3dlb n GLY 220 N -1.48 1.08 3.77 4.60 0.00 0.10 -5.10 105.19 108.16 3dlb n GLY 220 Ca 0.22 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.86 3dlb n GLY 220 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dlb s LEU 221 N 0.00 4.16 0.40 0.99 2.96 -1.25 -4.51 118.68 121.44 3dlb s LEU 221 Ca 0.00 2.32 -0.24 0.00 -0.22 0.00 0.00 54.13 55.99 3dlb s LEU 221 Cb 0.00 -4.07 -0.09 0.00 0.50 0.00 0.00 46.19 42.53 3dlb s LEU 221 CO 0.00 -0.70 1.04 -0.94 -1.32 0.00 0.00 176.35 174.43 3dlb s SER 222 N -1.20 6.78 0.34 3.68 1.04 -1.26 0.25 113.70 123.33 3dlb s SER 222 Ca 0.58 2.02 0.08 0.00 0.48 0.00 0.00 55.95 59.11 3dlb s SER 222 Cb -0.30 -2.58 0.78 0.00 0.10 0.00 0.00 66.02 64.02 3dlb s SER 222 CO 0.37 -0.48 1.85 0.25 0.98 0.00 0.00 173.24 176.22 3dlb h LEU 223 N 2.50 0.70 -0.06 2.42 7.12 -0.88 -0.48 115.31 126.62 3dlb h LEU 223 Ca -0.48 0.05 -0.07 0.00 0.13 0.00 0.00 57.88 57.50 3dlb h LEU 223 Cb 1.21 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 41.26 3dlb h LEU 223 CO 0.62 0.34 -0.25 -0.07 -0.13 0.00 0.00 178.44 178.95 3dlb h LEU 224 N 0.73 0.32 -1.14 2.25 -0.00 -1.83 -3.24 115.31 112.41 3dlb h LEU 224 Ca 0.47 -0.65 0.02 0.00 -0.00 0.00 0.00 57.88 57.73 3dlb h LEU 224 Cb 0.72 -0.09 -0.05 0.00 -0.00 0.00 0.00 40.66 41.24 3dlb h LEU 224 CO -0.23 0.91 0.59 0.44 -0.00 0.00 0.00 178.44 180.15 3dlb h ASP 225 N -0.25 0.99 -0.29 -0.43 3.32 -1.73 0.18 116.42 118.19 3dlb h ASP 225 Ca -0.02 -0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.08 3dlb h ASP 225 Cb 0.90 -0.24 -0.08 0.00 0.22 0.00 0.00 39.33 40.13 3dlb h ASP 225 CO 0.05 0.69 -0.36 0.22 -1.72 0.00 0.00 179.24 178.13 3dlb h TYR 226 N 1.15 -1.00 0.02 4.55 3.20 -1.13 -1.15 116.97 122.61 3dlb h TYR 226 Ca 0.34 0.05 -0.25 0.00 3.14 0.00 0.00 58.73 62.02 3dlb h TYR 226 Cb -0.05 0.48 0.01 0.00 1.54 0.00 0.00 36.73 38.72 3dlb h TYR 226 CO -0.00 -0.41 -1.02 0.45 -1.64 0.00 0.00 178.16 175.54 3dlb h HIS 227 N -0.34 0.79 -0.40 -3.82 3.86 -1.51 -3.33 115.15 110.40 3dlb h HIS 227 Ca 0.13 -0.44 0.05 0.00 -1.16 0.00 0.00 60.37 58.95 3dlb h HIS 227 Cb 0.56 -0.08 -0.05 0.00 1.06 0.00 0.00 27.41 28.90 3dlb h HIS 227 CO -0.51 1.28 0.12 0.00 0.86 0.00 0.00 177.93 179.67 3dlb h ALA 228 N 0.58 0.45 0.00 2.45 0.00 -0.32 -2.33 119.26 120.09 3dlb h ALA 228 Ca -0.11 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3dlb h ALA 228 Cb 1.67 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.51 3dlb h ALA 228 CO 0.19 -0.28 0.00 0.43 0.00 0.00 0.00 179.25 179.59 3dlb n SER 229 N -5.04 0.55 -0.00 0.00 7.64 -0.46 -2.52 113.62 113.78 3dlb n SER 229 Ca 0.02 -1.40 0.01 0.00 1.01 0.00 0.00 58.87 58.51 3dlb n SER 229 Cb 0.16 -0.28 -0.01 0.00 -1.01 0.00 0.00 64.21 63.07 3dlb n SER 229 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 3dlb n LYS 230 N 0.01 1.20 0.00 1.43 5.02 -0.88 -5.00 118.16 119.94 3dlb n LYS 230 Ca 0.00 -0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 3dlb n LYS 230 Cb 0.14 -0.96 0.00 0.00 -0.02 0.00 0.00 35.03 34.19 3dlb n LYS 230 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3dlb n GLY 231 N 2.16 0.73 0.00 0.72 0.00 -1.05 -4.97 105.19 102.79 3dlb n GLY 231 Ca -0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 3dlb n GLY 231 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dlb n ARG 232 N -1.03 0.36 -1.48 1.61 5.12 -1.21 -3.03 116.66 117.00 3dlb n ARG 232 Ca 0.00 0.06 -0.16 0.00 -1.93 0.00 0.00 57.85 55.82 3dlb n ARG 232 Cb 0.00 -1.50 0.09 0.00 -1.16 0.00 0.00 32.46 29.89 3dlb n ARG 232 CO 0.00 0.00 0.00 -0.11 -1.93 0.00 0.00 177.63 175.59 3dlb n LEU 233 N -1.28 4.65 -3.71 0.55 -0.00 -1.26 -4.69 117.00 111.27 3dlb n LEU 233 Ca 0.12 -4.38 -0.42 0.00 -0.00 0.00 0.00 56.01 51.32 3dlb n LEU 233 Cb 0.19 -0.49 -0.00 0.00 -0.00 0.00 0.00 43.42 43.11 3dlb n LEU 233 CO 0.18 1.77 2.71 0.00 -0.00 0.00 0.00 177.39 182.06 3dlb n GLN 234 N -0.88 2.93 -3.09 1.96 0.00 -1.17 -4.17 117.38 112.95 3dlb n GLN 234 Ca 0.39 -2.61 -0.17 0.00 0.00 0.00 0.00 57.00 54.61 3dlb n GLN 234 Cb 0.89 -3.25 0.04 0.00 0.00 0.00 0.00 30.24 27.93 3dlb n GLN 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3dlb n GLY 235 N 4.02 -0.19 1.88 2.61 0.00 -1.26 -4.87 105.19 107.39 3dlb n GLY 235 Ca 0.53 -0.03 -0.18 0.00 0.00 0.00 0.00 46.02 46.34 3dlb n GLY 235 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3dlb n ARG 236 N -3.56 2.16 0.00 1.61 0.63 -1.26 -4.93 116.66 111.32 3dlb n ARG 236 Ca -0.04 -3.12 0.00 0.00 -0.92 0.00 0.00 57.85 53.78 3dlb n ARG 236 Cb 0.57 -2.07 0.00 0.00 0.45 0.00 0.00 32.46 31.41 3dlb n ARG 236 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 3dlb n GLU 237 N -1.12 0.00 0.00 -0.14 2.13 -1.26 -4.71 120.64 115.54 3dlb n GLU 237 Ca 0.51 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.33 3dlb n GLU 237 Cb 1.38 0.00 0.00 0.00 0.27 0.00 0.00 31.44 33.09 3dlb n GLU 237 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3dlb n GLY 238 N -0.90 0.00 2.15 8.31 0.00 -1.26 -4.68 105.19 108.81 3dlb n GLY 238 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 3dlb n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dlb n GLY 239 N 0.00 1.40 3.88 -0.02 0.00 -1.26 -4.13 105.19 105.05 3dlb n GLY 239 Ca 0.00 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 3dlb n GLY 239 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dlb s ARG 240 N -1.69 3.72 0.08 1.61 3.52 -1.26 -4.87 118.95 120.06 3dlb s ARG 240 Ca 0.26 0.11 -0.21 0.00 -0.13 0.00 0.00 55.73 55.77 3dlb s ARG 240 Cb 0.34 -2.79 -0.07 0.00 -1.56 0.00 0.00 34.95 30.87 3dlb s ARG 240 CO -0.10 0.42 0.62 0.08 -0.81 0.00 0.00 175.30 175.51 3dlb s VAL 241 N -1.68 4.68 -0.02 7.11 1.01 -1.26 -1.31 120.40 128.93 3dlb s VAL 241 Ca 0.42 1.33 -0.00 0.00 0.00 0.00 0.00 61.98 63.73 3dlb s VAL 241 Cb -0.12 -3.96 0.03 0.00 0.00 0.00 0.00 36.38 32.33 3dlb s VAL 241 CO 0.22 0.53 0.04 0.00 0.00 0.00 0.00 175.10 175.89 3dlb s ALA 242 N -0.99 0.12 -0.43 5.51 0.00 -0.97 0.43 121.76 125.43 3dlb s ALA 242 Ca 0.31 0.28 -0.25 0.00 0.00 0.00 0.00 51.96 52.30 3dlb s ALA 242 Cb -0.20 -0.34 0.02 0.00 0.00 0.00 0.00 23.12 22.61 3dlb s ALA 242 CO 0.20 -0.20 0.88 -1.58 0.00 0.00 0.00 175.76 175.07 3dlb s TRP 243 N 1.34 2.98 0.46 0.00 0.52 -0.87 -1.19 118.94 122.18 3dlb s TRP 243 Ca -0.06 0.42 0.07 0.00 0.02 0.00 0.00 56.10 56.55 3dlb s TRP 243 Cb -0.13 -3.80 -0.01 0.00 -1.15 0.00 0.00 33.47 28.39 3dlb s TRP 243 CO -0.03 -1.00 0.36 0.14 0.02 0.00 0.00 176.95 176.44 3dlb s VAL 244 N 3.55 2.27 0.02 4.03 -7.23 -0.11 -1.65 120.40 121.28 3dlb s VAL 244 Ca 0.35 -1.45 -0.06 0.00 -1.81 0.00 0.00 61.98 59.01 3dlb s VAL 244 Cb -0.11 -2.72 -0.00 0.00 0.56 0.00 0.00 36.38 34.11 3dlb s VAL 244 CO 0.23 0.00 0.12 0.00 -0.31 0.00 0.00 175.10 175.14 3dlb s ALA 245 N -2.59 -0.21 0.34 1.32 0.00 -0.39 0.42 121.76 120.65 3dlb s ALA 245 Ca 0.43 -0.32 -0.26 0.00 0.00 0.00 0.00 51.96 51.80 3dlb s ALA 245 Cb -0.02 0.17 -0.09 0.00 0.00 0.00 0.00 23.12 23.19 3dlb s ALA 245 CO 0.25 -0.25 1.03 0.34 0.00 0.00 0.00 175.76 177.13 3dlb s ASP 246 N -1.70 7.09 0.48 0.00 -1.08 -1.26 -1.21 116.67 118.98 3dlb s ASP 246 Ca -0.11 2.05 0.22 0.00 -0.52 0.00 0.00 52.55 54.19 3dlb s ASP 246 Cb -0.05 -2.60 1.24 0.00 -1.46 0.00 0.00 42.92 40.05 3dlb s ASP 246 CO -0.01 -0.26 1.92 1.55 0.52 0.00 0.00 175.17 178.90 3dlb h PRO 247 N 3.13 0.21 -6.10 4.34 0.13 -1.93 -3.36 132.00 128.42 3dlb h PRO 247 Ca -0.47 -0.01 -0.60 0.00 -0.87 0.00 0.00 66.00 64.05 3dlb h PRO 247 Cb 1.21 -0.05 -0.05 0.00 0.13 0.00 0.00 31.00 32.24 3dlb h PRO 247 CO 0.65 0.14 -0.17 0.15 -0.23 0.00 0.00 178.00 178.53 3dlb s LYS 248 N -5.21 3.94 -0.70 0.86 3.01 -1.26 -4.61 119.74 115.76 3dlb s LYS 248 Ca -0.07 0.43 -0.09 0.00 -1.01 0.00 0.00 55.97 55.24 3dlb s LYS 248 Cb 0.21 -3.15 0.01 0.00 -1.01 0.00 0.00 37.83 33.89 3dlb s LYS 248 CO 0.76 0.64 0.63 -0.40 0.51 0.00 0.00 175.35 177.49 3dlb n ASP 249 N 1.54 -5.82 0.00 2.83 3.85 -1.26 -4.94 116.55 112.76 3dlb n ASP 249 Ca -0.11 -0.51 0.04 0.00 -0.71 0.00 0.00 54.79 53.50 3dlb n ASP 249 Cb 0.52 -2.70 0.19 0.00 -1.35 0.00 0.00 41.12 37.79 3dlb n ASP 249 CO 0.00 0.00 0.00 -2.65 -1.01 0.00 0.00 177.20 173.54 3dlb n PRO 250 N -1.79 0.01 -0.06 0.11 -0.02 -1.26 -3.89 135.00 128.10 3dlb n PRO 250 Ca -0.18 0.33 -0.06 0.00 -2.02 0.00 0.00 63.50 61.58 3dlb n PRO 250 Cb 0.64 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.57 3dlb n PRO 250 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 3dlb h ARG 251 N 0.00 0.00 -3.46 -0.52 9.65 -1.93 -3.41 114.38 114.71 3dlb h ARG 251 Ca 0.00 0.00 -0.38 0.00 -1.10 0.00 0.00 59.98 58.50 3dlb h ARG 251 Cb 0.14 0.00 -0.05 0.00 -1.39 0.00 0.00 29.97 28.68 3dlb h ARG 251 CO 0.00 0.34 1.04 1.63 2.80 0.00 0.00 179.97 185.78 3dlb n LYS 252 N -4.69 0.00 -3.92 0.20 4.01 -1.25 -4.76 118.16 107.75 3dlb n LYS 252 Ca -0.05 0.00 -0.34 0.00 -0.51 0.00 0.00 58.31 57.40 3dlb n LYS 252 Cb 0.20 -0.97 -0.05 0.00 -0.51 0.00 0.00 35.03 33.70 3dlb n LYS 252 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 3dlb s PRO 253 N 5.15 3.41 -0.02 1.97 0.04 -1.26 -4.52 135.00 139.77 3dlb s PRO 253 Ca 0.84 -0.28 0.05 0.00 0.04 0.00 0.00 61.00 61.66 3dlb s PRO 253 Cb -0.87 -3.11 -0.01 0.00 0.04 0.00 0.00 34.50 30.55 3dlb s PRO 253 CO 0.35 0.71 -0.18 0.96 0.04 0.00 0.00 177.00 178.88 3dlb s ILE 254 N -1.22 1.47 0.53 0.56 -5.25 0.17 -4.99 121.20 112.46 3dlb s ILE 254 Ca 0.23 -0.78 -0.20 0.00 -0.99 0.00 0.00 60.65 58.91 3dlb s ILE 254 Cb -0.12 -1.23 -0.06 0.00 2.95 0.00 0.00 42.46 44.00 3dlb s ILE 254 CO 0.14 0.42 1.17 -2.16 -1.79 0.00 0.00 174.94 172.71 3dlb s PRO 255 N -0.35 3.35 0.00 0.37 0.04 -1.26 -0.93 135.00 136.22 3dlb s PRO 255 Ca 0.05 1.73 0.00 0.00 0.04 0.00 0.00 61.00 62.82 3dlb s PRO 255 Cb -0.08 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.37 3dlb s PRO 255 CO -0.00 -0.88 0.00 1.58 0.04 0.00 0.00 177.00 177.74 3dlb n HIS 256 N -1.16 -0.60 -3.83 0.56 -0.00 -0.33 -4.78 115.22 105.08 3dlb n HIS 256 Ca 0.11 0.00 -0.26 0.00 0.46 0.00 0.00 57.72 58.03 3dlb n HIS 256 Cb 0.50 0.00 -0.17 0.00 -0.12 0.00 0.00 29.99 30.20 3dlb n HIS 256 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 3dlb s LEU 257 N 0.00 1.18 0.36 0.27 1.43 -1.26 -2.28 118.68 118.39 3dlb s LEU 257 Ca 0.00 -0.48 0.11 0.00 -1.03 0.00 0.00 54.13 52.73 3dlb s LEU 257 Cb 0.00 -0.71 0.88 0.00 0.03 0.00 0.00 46.19 46.39 3dlb s LEU 257 CO 0.00 -0.20 1.84 0.71 0.23 0.00 0.00 176.35 178.93 3dlb h THR 258 N 6.36 0.76 0.00 5.49 1.35 -1.49 0.58 112.91 125.97 3dlb h THR 258 Ca -0.22 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.42 3dlb h THR 258 Cb 1.12 0.08 0.00 0.00 -1.73 0.00 0.00 68.15 67.62 3dlb h THR 258 CO 0.35 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 176.34 3dlb n GLY 259 N -1.44 -0.77 0.81 5.82 0.00 -1.25 -1.93 105.19 106.43 3dlb n GLY 259 Ca 0.19 -0.10 0.05 0.00 0.00 0.00 0.00 46.02 46.17 3dlb n GLY 259 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dlb n LEU 260 N -1.18 2.02 0.00 0.99 4.32 0.20 -4.10 117.00 119.25 3dlb n LEU 260 Ca 0.10 -3.10 -0.24 0.00 -0.02 0.00 0.00 56.01 52.76 3dlb n LEU 260 Cb 0.11 -0.33 -0.06 0.00 -1.62 0.00 0.00 43.42 41.52 3dlb n LEU 260 CO 0.13 1.00 -0.16 0.18 -1.22 0.00 0.00 177.39 177.32 3dlb n LEU 261 N -0.61 0.00 -3.65 2.23 4.77 -0.81 -2.74 117.00 116.18 3dlb n LEU 261 Ca 0.14 -2.78 -0.05 0.00 -0.03 0.00 0.00 56.01 53.29 3dlb n LEU 261 Cb 0.82 0.75 -0.06 0.00 -2.33 0.00 0.00 43.42 42.60 3dlb n LEU 261 CO -0.03 -0.42 0.28 -0.69 -1.33 0.00 0.00 177.39 175.19 3dlb s VAL 262 N -2.83 -0.46 1.38 4.08 1.01 0.21 -2.69 120.40 121.11 3dlb s VAL 262 Ca 0.13 0.02 -0.22 0.00 0.00 0.00 0.00 61.98 61.90 3dlb s VAL 262 Cb 0.01 -0.96 0.35 0.00 0.00 0.00 0.00 36.38 35.78 3dlb s VAL 262 CO 0.09 0.01 0.97 -2.84 0.00 0.00 0.00 175.10 173.33 3dlb s PRO 263 N 2.21 -2.64 -0.04 2.72 0.02 -1.26 -0.18 135.00 135.83 3dlb s PRO 263 Ca -0.08 0.05 -0.02 0.00 0.02 0.00 0.00 61.00 60.97 3dlb s PRO 263 Cb -0.09 -1.42 -0.01 0.00 0.02 0.00 0.00 34.50 33.00 3dlb s PRO 263 CO -0.19 -4.67 0.14 -0.24 -0.33 0.00 0.00 177.00 171.71 3dlb h VAL 264 N -3.27 0.00 -2.47 3.83 3.04 -1.89 -3.42 116.25 112.08 3dlb h VAL 264 Ca -0.43 -0.44 -0.59 0.00 -1.01 0.00 0.00 66.70 64.23 3dlb h VAL 264 Cb 1.33 0.00 -0.38 0.00 -2.01 0.00 0.00 31.29 30.22 3dlb h VAL 264 CO 0.28 0.00 -0.92 -0.83 -1.01 0.00 0.00 177.57 175.09 3dlb s GLY 275 N -2.63 1.13 0.16 3.17 0.00 -1.26 -4.94 107.32 102.95 3dlb s GLY 275 Ca -0.01 -2.29 0.01 0.00 0.00 0.00 0.00 44.72 42.43 3dlb s GLY 275 CO 0.03 2.08 0.02 -1.35 0.00 0.00 0.00 173.10 173.88 3dlb s SER 276 N 0.36 0.90 -0.41 1.64 1.04 -1.26 -5.17 113.70 110.81 3dlb s SER 276 Ca 0.27 -1.18 0.08 0.00 0.48 0.00 0.00 55.95 55.60 3dlb s SER 276 Cb -0.06 0.18 0.26 0.00 0.10 0.00 0.00 66.02 66.50 3dlb s SER 276 CO -0.13 -0.62 0.63 -0.11 0.98 0.00 0.00 173.24 173.99 3dlb n LEU 277 N -0.19 -0.38 -1.40 2.42 7.94 -1.26 -4.99 117.00 119.15 3dlb n LEU 277 Ca -0.06 -4.45 0.00 0.00 -1.11 0.00 0.00 56.01 50.39 3dlb n LEU 277 Cb 0.63 0.69 0.00 0.00 0.53 0.00 0.00 43.42 45.28 3dlb n LEU 277 CO 0.33 2.08 0.55 0.00 -1.11 0.00 0.00 177.39 179.24 3dlb n ALA 278 N 1.30 2.81 0.00 1.96 0.00 -1.26 -4.73 120.51 120.59 3dlb n ALA 278 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.63 3dlb n ALA 278 Cb 0.57 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.83 3dlb n ALA 278 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3dlb n LEU 279 N 1.27 0.00 -3.64 0.00 7.94 -1.26 -4.49 117.00 116.81 3dlb n LEU 279 Ca 0.00 0.00 -0.07 0.00 -1.11 0.00 0.00 56.01 54.83 3dlb n LEU 279 Cb 0.34 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.22 3dlb n LEU 279 CO 0.00 0.00 0.73 -0.55 -1.11 0.00 0.00 177.39 176.46 3dlb s SER 280 N -1.04 -0.46 0.80 1.96 0.15 -1.26 -5.08 113.70 108.77 3dlb s SER 280 Ca 0.00 0.83 -0.12 0.00 0.70 0.00 0.00 55.95 57.36 3dlb s SER 280 Cb 0.00 0.95 0.07 0.00 -1.71 0.00 0.00 66.02 65.33 3dlb s SER 280 CO 0.00 -0.14 1.14 -1.48 1.20 0.00 0.00 173.24 173.96 3dlb s LEU 281 N 0.58 2.53 0.00 3.45 -0.00 -1.26 -5.08 118.68 118.90 3dlb s LEU 281 Ca -0.01 1.00 0.00 0.00 -0.00 0.00 0.00 54.13 55.12 3dlb s LEU 281 Cb -0.05 -3.56 0.00 0.00 -0.00 0.00 0.00 46.19 42.58 3dlb s LEU 281 CO -0.09 -1.88 0.00 -2.65 -0.00 0.00 0.00 176.35 171.72 3dlb n PRO 282 N -3.34 -0.56 0.03 1.48 -0.02 -1.26 -4.63 135.00 126.71 3dlb n PRO 282 Ca 0.07 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.50 3dlb n PRO 282 Cb 0.59 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 34.03 3dlb n PRO 282 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 3dlb h TRP 283 N -1.31 -0.17 -0.97 6.00 5.08 -1.98 -2.90 115.95 119.71 3dlb h TRP 283 Ca 0.00 -0.00 0.12 0.00 1.08 0.00 0.00 58.89 60.09 3dlb h TRP 283 Cb 0.00 0.06 -0.08 0.00 -3.00 0.00 0.00 29.16 26.14 3dlb h TRP 283 CO 0.00 0.03 0.61 0.93 -1.28 0.00 0.00 178.44 178.74 3dlb h GLU 284 N -1.02 0.90 -0.31 0.12 5.08 -1.98 -0.04 114.58 117.32 3dlb h GLU 284 Ca -0.02 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.19 3dlb h GLU 284 Cb 0.28 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3dlb h GLU 284 CO 0.03 0.60 -0.17 1.49 -1.00 0.00 0.00 179.01 179.95 3dlb h GLU 285 N 0.93 0.66 -0.42 2.33 4.57 -1.94 -2.91 114.58 117.80 3dlb h GLU 285 Ca 0.48 -0.30 -0.14 0.00 -1.18 0.00 0.00 59.36 58.22 3dlb h GLU 285 Cb 0.52 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.08 3dlb h GLU 285 CO -0.24 0.89 -0.28 -0.09 -1.18 0.00 0.00 179.01 178.11 3dlb h ARG 286 N 0.42 0.90 0.00 1.92 2.43 -1.13 -0.65 114.38 118.26 3dlb h ARG 286 Ca 0.07 -0.41 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 3dlb h ARG 286 Cb 0.71 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 3dlb h ARG 286 CO 0.05 1.06 0.00 2.89 -1.51 0.00 0.00 179.97 182.46 3dlb n ARG 287 N -4.09 0.21 -0.10 0.20 1.85 -0.10 -0.97 116.66 113.66 3dlb n ARG 287 Ca -0.01 0.41 -0.21 0.00 -1.00 0.00 0.00 57.85 57.04 3dlb n ARG 287 Cb 0.48 -1.88 -0.12 0.00 -1.05 0.00 0.00 32.46 29.89 3dlb n ARG 287 CO 0.00 0.00 0.00 -0.09 -0.01 0.00 0.00 177.63 177.53 3dlb h ARG 288 N 0.00 0.01 -0.07 2.89 1.12 -1.29 -2.94 114.38 114.10 3dlb h ARG 288 Ca 0.00 -0.01 0.02 0.00 -1.11 0.00 0.00 59.98 58.88 3dlb h ARG 288 Cb 0.41 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.37 3dlb h ARG 288 CO 0.00 1.00 0.06 -0.09 -3.11 0.00 0.00 179.97 177.84 3dlb h ARG 289 N -0.98 0.00 0.07 0.20 9.65 -0.94 -1.56 114.38 120.82 3dlb h ARG 289 Ca -0.32 0.00 -0.15 0.00 -1.10 0.00 0.00 59.98 58.41 3dlb h ARG 289 Cb 1.29 0.00 0.02 0.00 -1.39 0.00 0.00 29.97 29.88 3dlb h ARG 289 CO -0.19 0.00 -0.64 0.00 2.80 0.00 0.00 179.97 181.94 3dlb h THR 290 N 0.00 1.50 0.00 0.20 1.03 -1.17 -3.04 112.91 111.43 3dlb h THR 290 Ca 0.03 -2.31 -0.00 0.00 -0.01 0.00 0.00 66.41 64.13 3dlb h THR 290 Cb 0.16 2.95 -0.00 0.00 -1.07 0.00 0.00 68.15 70.19 3dlb h THR 290 CO -0.00 0.65 -0.01 0.03 -0.01 0.00 0.00 175.52 176.19 3dlb h ARG 291 N -0.32 0.00 0.14 0.00 -0.00 -1.19 -2.54 114.38 110.47 3dlb h ARG 291 Ca -0.10 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.37 3dlb h ARG 291 Cb 1.43 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.40 3dlb h ARG 291 CO 0.12 0.01 -0.07 0.93 0.00 0.00 0.00 179.97 180.96 3dlb h GLU 292 N 0.00 -0.18 -1.08 0.04 5.08 -1.29 -3.26 114.58 113.89 3dlb h GLU 292 Ca -0.00 0.01 0.30 0.00 -1.00 0.00 0.00 59.36 58.67 3dlb h GLU 292 Cb 0.09 0.04 -0.07 0.00 0.50 0.00 0.00 28.75 29.31 3dlb h GLU 292 CO 0.00 -0.12 0.74 0.82 -1.00 0.00 0.00 179.01 179.45 3dlb h ILE 293 N -0.50 0.48 -0.18 3.13 2.04 -1.40 1.10 117.51 122.18 3dlb h ILE 293 Ca -0.02 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.77 3dlb h ILE 293 Cb 0.14 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.47 3dlb h ILE 293 CO 0.03 0.04 0.11 0.00 0.00 0.00 0.00 178.15 178.33 3dlb h ALA 294 N 1.54 1.86 0.14 1.87 0.00 -1.55 1.03 119.26 124.16 3dlb h ALA 294 Ca 0.57 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 55.26 3dlb h ALA 294 Cb 1.82 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 19.55 3dlb h ALA 294 CO -0.16 0.13 -0.91 0.77 0.00 0.00 0.00 179.25 179.07 3dlb h SER 295 N 0.24 0.47 -0.09 0.00 0.02 0.12 -2.66 113.55 111.66 3dlb h SER 295 Ca 0.07 -0.94 -0.01 0.00 -0.84 0.00 0.00 61.79 60.07 3dlb h SER 295 Cb -0.02 -0.15 -0.00 0.00 0.14 0.00 0.00 62.40 62.36 3dlb h SER 295 CO -0.01 1.43 0.02 -0.25 -1.14 0.00 0.00 176.83 176.88 3dlb h TRP 296 N -0.35 0.14 0.00 3.45 2.91 -0.42 -2.96 115.95 118.72 3dlb h TRP 296 Ca -0.17 -0.02 -0.06 0.00 1.13 0.00 0.00 58.89 59.78 3dlb h TRP 296 Cb 1.68 -0.04 -0.01 0.00 -0.51 0.00 0.00 29.16 30.28 3dlb h TRP 296 CO 0.19 0.30 -0.27 0.97 -1.03 0.00 0.00 178.44 178.60 3dlb h ILE 297 N -0.06 0.66 0.00 2.65 2.10 0.93 -1.85 117.51 121.94 3dlb h ILE 297 Ca 0.03 -1.22 0.00 0.00 1.08 0.00 0.00 64.86 64.75 3dlb h ILE 297 Cb 0.23 1.80 0.00 0.00 -1.09 0.00 0.00 36.82 37.75 3dlb h ILE 297 CO -0.00 0.26 0.00 0.61 -1.08 0.00 0.00 178.15 177.94 3dlb n GLY 298 N 0.14 -0.67 0.12 8.18 0.00 -1.00 -2.54 105.19 109.42 3dlb n GLY 298 Ca -0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 46.02 45.89 3dlb n GLY 298 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3dlb h ARG 299 N 0.00 -0.17 -0.00 1.61 0.11 -1.33 -3.26 114.38 111.34 3dlb h ARG 299 Ca 0.00 0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.09 3dlb h ARG 299 Cb 0.10 0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.22 3dlb h ARG 299 CO 0.00 0.07 -0.07 0.54 0.10 0.00 0.00 179.97 180.61 3dlb n ARG 300 N -4.88 0.66 0.08 0.08 1.74 -1.17 -3.65 116.66 109.53 3dlb n ARG 300 Ca -0.04 -0.17 -0.18 0.00 -0.77 0.00 0.00 57.85 56.68 3dlb n ARG 300 Cb 0.16 -1.50 -0.14 0.00 -1.02 0.00 0.00 32.46 29.96 3dlb n ARG 300 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3dlb h LEU 301 N 0.42 0.48 -1.26 0.55 3.38 -1.61 -3.48 115.31 113.78 3dlb h LEU 301 Ca 0.00 -0.61 -0.48 0.00 0.09 0.00 0.00 57.88 56.88 3dlb h LEU 301 Cb 0.32 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 3dlb h LEU 301 CO 0.00 1.49 -0.80 0.61 0.09 0.00 0.00 178.44 179.83 3dlb n GLY 302 N 1.66 -0.42 2.61 0.83 0.00 -1.23 -4.88 105.19 103.77 3dlb n GLY 302 Ca -0.15 0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 3dlb n GLY 302 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dlb n LEU 303 N -4.53 3.64 0.00 0.99 4.32 -1.26 -5.08 117.00 115.08 3dlb n LEU 303 Ca -0.06 -5.09 0.00 0.00 -0.02 0.00 0.00 56.01 50.84 3dlb n LEU 303 Cb 0.57 -0.20 0.00 0.00 -1.62 0.00 0.00 43.42 42.17 3dlb n LEU 303 CO 0.76 2.17 0.00 0.61 -1.22 0.00 0.00 177.39 179.71 3dlb n GLY 304 N -0.25 -2.00 3.45 -0.72 0.00 -1.26 -2.08 105.19 102.33 3dlb n GLY 304 Ca 0.30 -1.45 -0.35 0.00 0.00 0.00 0.00 46.02 44.52 3dlb n GLY 304 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dlb s THR 305 N 0.00 4.05 0.39 2.61 -4.23 -1.26 -4.88 115.64 112.33 3dlb s THR 305 Ca 0.00 -0.28 -0.24 0.00 -1.18 0.00 0.00 61.69 60.00 3dlb s THR 305 Cb 0.00 -2.84 -0.13 0.00 1.34 0.00 0.00 72.50 70.87 3dlb s THR 305 CO 0.00 0.41 0.66 -2.65 -0.54 0.00 0.00 174.62 172.50 3dlb n PRO 306 N 4.35 0.72 -3.63 3.99 -0.02 -1.26 -4.71 135.00 134.43 3dlb n PRO 306 Ca -0.17 0.26 -0.27 0.00 -2.02 0.00 0.00 63.50 61.30 3dlb n PRO 306 Cb 0.52 -1.58 -0.17 0.00 -0.02 0.00 0.00 33.50 32.25 3dlb n PRO 306 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3dlb s GLU 307 N -1.60 0.24 0.19 -0.52 0.41 -0.66 -4.93 118.70 111.82 3dlb s GLU 307 Ca 0.63 -0.26 -0.33 0.00 -0.41 0.00 0.00 54.97 54.60 3dlb s GLU 307 Cb -0.63 -1.80 -0.15 0.00 -1.78 0.00 0.00 34.13 29.77 3dlb s GLU 307 CO 0.58 -0.73 1.29 0.00 -0.49 0.00 0.00 175.26 175.91 3dlb n ALA 308 N 5.21 0.00 -2.69 5.21 0.00 -1.26 -1.31 120.51 125.67 3dlb n ALA 308 Ca -0.07 0.45 -0.39 0.00 0.00 0.00 0.00 53.44 53.43 3dlb n ALA 308 Cb 0.47 -2.14 -0.06 0.00 0.00 0.00 0.00 19.45 17.72 3dlb n ALA 308 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3dlb s VAL 309 N -0.02 5.12 -0.12 0.00 1.01 -1.18 -4.85 120.40 120.35 3dlb s VAL 309 Ca 0.73 1.06 -0.07 0.00 0.00 0.00 0.00 61.98 63.70 3dlb s VAL 309 Cb -0.78 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 31.69 3dlb s VAL 309 CO 0.50 0.23 0.14 0.00 0.00 0.00 0.00 175.10 175.97 3dlb s ARG 310 N 1.17 3.44 -0.02 2.72 1.70 -1.26 -1.96 118.95 124.74 3dlb s ARG 310 Ca 0.27 -0.13 0.02 0.00 -0.47 0.00 0.00 55.73 55.42 3dlb s ARG 310 Cb -0.16 -3.19 0.01 0.00 -0.57 0.00 0.00 34.95 31.04 3dlb s ARG 310 CO 0.11 0.78 -0.06 0.00 -1.08 0.00 0.00 175.30 175.05 3dlb s ALA 311 N -1.03 0.60 -0.39 7.88 0.00 -0.09 -4.96 121.76 123.77 3dlb s ALA 311 Ca 0.15 -0.19 -0.29 0.00 0.00 0.00 0.00 51.96 51.63 3dlb s ALA 311 Cb -0.12 -0.25 0.01 0.00 0.00 0.00 0.00 23.12 22.76 3dlb s ALA 311 CO 0.04 0.08 1.30 1.14 0.00 0.00 0.00 175.76 178.32 3dlb s GLN 312 N 0.27 3.74 -0.11 0.00 0.00 -1.26 -1.45 119.66 120.84 3dlb s GLN 312 Ca -0.03 0.96 -0.05 0.00 -0.00 0.00 0.00 55.36 56.24 3dlb s GLN 312 Cb -0.07 -3.94 -0.04 0.00 0.00 0.00 0.00 33.01 28.96 3dlb s GLN 312 CO -0.00 -1.35 0.07 0.00 0.00 0.00 0.00 175.29 174.00 3dlb s ALA 313 N 4.80 3.54 -0.05 2.60 0.00 0.86 -4.21 121.76 129.31 3dlb s ALA 313 Ca 0.56 -0.73 -0.03 0.00 0.00 0.00 0.00 51.96 51.76 3dlb s ALA 313 Cb -0.13 -1.74 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 3dlb s ALA 313 CO 0.29 0.54 0.10 0.71 0.00 0.00 0.00 175.76 177.40 3dlb s TYR 314 N -0.75 3.39 -0.26 0.00 1.51 -0.10 0.19 117.35 121.33 3dlb s TYR 314 Ca 0.12 0.32 -0.29 0.00 -1.01 0.00 0.00 57.07 56.21 3dlb s TYR 314 Cb -0.12 -1.82 0.01 0.00 -0.11 0.00 0.00 41.96 39.93 3dlb s TYR 314 CO 0.03 0.60 1.05 0.50 -1.11 0.00 0.00 175.55 176.62 3dlb s ARG 315 N -1.43 4.18 0.20 -0.62 6.06 -1.26 -1.31 118.95 124.77 3dlb s ARG 315 Ca 0.20 1.24 -0.16 0.00 -2.50 0.00 0.00 55.73 54.50 3dlb s ARG 315 Cb -0.12 -3.68 -0.08 0.00 0.06 0.00 0.00 34.95 31.14 3dlb s ARG 315 CO 0.10 -0.73 0.65 -0.51 -2.50 0.00 0.00 175.30 172.31 3dlb s LEU 316 N 3.36 4.30 0.11 -0.88 1.43 -0.77 -4.88 118.68 121.36 3dlb s LEU 316 Ca 0.44 1.24 -0.30 0.00 -1.03 0.00 0.00 54.13 54.48 3dlb s LEU 316 Cb -0.14 -3.52 -0.07 0.00 0.03 0.00 0.00 46.19 42.49 3dlb s LEU 316 CO 0.10 0.03 1.23 -0.55 0.23 0.00 0.00 176.35 177.39 3dlb s SER 317 N -1.78 7.03 -0.17 2.29 0.15 -1.26 -4.66 113.70 115.30 3dlb s SER 317 Ca 0.42 2.15 -0.29 0.00 0.70 0.00 0.00 55.95 58.93 3dlb s SER 317 Cb -0.15 -2.59 -0.00 0.00 -1.71 0.00 0.00 66.02 61.57 3dlb s SER 317 CO 0.20 -0.47 1.06 -0.51 1.20 0.00 0.00 173.24 174.71 3dlb s ILE 318 N 0.69 4.66 0.50 6.45 1.10 -1.26 -5.00 121.20 128.34 3dlb s ILE 318 Ca 0.58 1.97 -0.21 0.00 -0.51 0.00 0.00 60.65 62.48 3dlb s ILE 318 Cb -0.32 -4.27 -0.07 0.00 0.15 0.00 0.00 42.46 37.95 3dlb s ILE 318 CO 0.32 -0.10 1.12 -2.16 -2.11 0.00 0.00 174.94 172.00 3dlb s PRO 319 N 2.77 3.58 -0.29 3.50 0.04 -1.26 -5.02 135.00 138.32 3dlb s PRO 319 Ca 0.47 1.61 -0.18 0.00 0.04 0.00 0.00 61.00 62.94 3dlb s PRO 319 Cb -0.17 -2.16 -0.02 0.00 0.04 0.00 0.00 34.50 32.19 3dlb s PRO 319 CO 0.12 -0.66 0.51 0.21 0.04 0.00 0.00 177.00 177.21 3dlb s LYS 320 N -3.07 3.94 0.00 4.56 2.20 -1.26 -5.03 119.74 121.07 3dlb s LYS 320 Ca 0.69 0.17 -0.01 0.00 -0.36 0.00 0.00 55.97 56.46 3dlb s LYS 320 Cb -0.24 -3.70 -0.04 0.00 -1.51 0.00 0.00 37.83 32.35 3dlb s LYS 320 CO 0.28 -0.43 0.10 -0.51 -0.36 0.00 0.00 175.35 174.43 3dlb s LEU 321 N 2.33 3.99 -0.06 5.43 1.43 -1.26 -2.25 118.68 128.29 3dlb s LEU 321 Ca 0.20 0.18 -0.01 0.00 -1.03 0.00 0.00 54.13 53.47 3dlb s LEU 321 Cb -0.16 -2.37 0.03 0.00 0.03 0.00 0.00 46.19 43.72 3dlb s LEU 321 CO 0.10 0.26 -0.00 -0.04 0.23 0.00 0.00 176.35 176.90 3dlb s MET 322 N -1.84 0.56 0.00 1.70 -1.94 -0.37 -2.93 119.30 114.47 3dlb s MET 322 Ca 0.24 0.10 0.00 0.00 -1.71 0.00 0.00 55.69 54.32 3dlb s MET 322 Cb -0.12 -0.87 0.00 0.00 2.01 0.00 0.00 34.83 35.85 3dlb s MET 322 CO 0.16 -0.26 0.00 0.41 -0.01 0.00 0.00 175.02 175.32 3dlb n GLY 323 N 4.90 0.56 0.14 -0.03 0.00 -1.26 -0.49 105.19 109.00 3dlb n GLY 323 Ca -0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.68 3dlb n GLY 323 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3dlb h ARG 324 N 0.00 0.38 -5.98 1.61 -0.00 -1.43 -3.28 114.38 105.68 3dlb h ARG 324 Ca 0.00 -0.65 -0.59 0.00 -0.00 0.00 0.00 59.98 58.74 3dlb h ARG 324 Cb 0.00 0.24 -0.11 0.00 -0.00 0.00 0.00 29.97 30.10 3dlb h ARG 324 CO 0.00 1.29 -0.62 1.03 -0.00 0.00 0.00 179.97 181.67 3dlb s ARG 325 N -2.58 2.03 0.70 0.08 0.52 -1.26 -5.03 118.95 113.40 3dlb s ARG 325 Ca -0.15 -1.81 -0.16 0.00 -0.52 0.00 0.00 55.73 53.08 3dlb s ARG 325 Cb 0.06 -1.87 -0.02 0.00 0.52 0.00 0.00 34.95 33.63 3dlb s ARG 325 CO 0.85 0.12 0.79 0.00 0.02 0.00 0.00 175.30 177.08 3dlb n ALA 326 N -0.93 -0.68 -3.30 2.13 0.00 -1.26 -4.71 120.51 111.75 3dlb n ALA 326 Ca -0.04 -0.17 -0.14 0.00 0.00 0.00 0.00 53.44 53.09 3dlb n ALA 326 Cb 0.63 -2.01 -0.09 0.00 0.00 0.00 0.00 19.45 17.98 3dlb n ALA 326 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3dlb s VAL 327 N -1.80 0.03 -0.04 0.00 0.11 -1.15 -4.79 120.40 112.75 3dlb s VAL 327 Ca 0.71 -0.23 0.13 0.00 -2.93 0.00 0.00 61.98 59.65 3dlb s VAL 327 Cb -0.36 -0.65 -0.16 0.00 -1.53 0.00 0.00 36.38 33.68 3dlb s VAL 327 CO 0.53 -0.13 0.97 0.77 -3.33 0.00 0.00 175.10 173.91 3dlb h SER 328 N 4.38 0.00 -4.95 3.54 4.64 -1.95 -3.36 113.55 115.86 3dlb h SER 328 Ca -0.28 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 60.86 3dlb h SER 328 Cb 1.17 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.09 3dlb h SER 328 CO 0.34 0.83 -0.70 -1.59 -0.87 0.00 0.00 176.83 174.84 3dlb s LYS 329 N -2.76 0.60 0.37 4.77 -2.85 -1.26 -4.97 119.74 113.64 3dlb s LYS 329 Ca -0.02 -1.06 0.05 0.00 -1.00 0.00 0.00 55.97 53.94 3dlb s LYS 329 Cb 0.09 0.00 0.71 0.00 -2.06 0.00 0.00 37.83 36.57 3dlb s LYS 329 CO 0.81 -0.05 1.99 -1.35 0.10 0.00 0.00 175.35 176.85 3dlb h PRO 330 N 3.60 0.63 -0.80 1.78 0.11 -1.91 -2.96 132.00 132.46 3dlb h PRO 330 Ca -0.34 -0.07 0.12 0.00 0.11 0.00 0.00 66.00 65.82 3dlb h PRO 330 Cb 1.17 -0.13 -0.08 0.00 0.11 0.00 0.00 31.00 32.07 3dlb h PRO 330 CO 0.57 0.48 0.41 0.00 -0.21 0.00 0.00 178.00 179.25 3dlb h ALA 331 N 1.62 1.15 0.00 -0.75 0.00 -1.96 -0.79 119.26 118.52 3dlb h ALA 331 Ca 0.16 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3dlb h ALA 331 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3dlb h ALA 331 CO -0.02 -0.05 0.00 -0.25 0.00 0.00 0.00 179.25 178.93 3dlb n ASP 332 N -4.85 0.00 0.08 0.00 8.00 -1.12 -1.25 116.55 117.41 3dlb n ASP 332 Ca 0.14 -0.22 0.13 0.00 0.71 0.00 0.00 54.79 55.55 3dlb n ASP 332 Cb 0.35 -0.04 0.37 0.00 -0.02 0.00 0.00 41.12 41.78 3dlb n ASP 332 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dlb n ALA 333 N -1.04 2.46 1.89 2.24 0.00 -0.30 -2.05 120.51 123.71 3dlb n ALA 333 Ca 0.06 -0.09 0.16 0.00 0.00 0.00 0.00 53.44 53.57 3dlb n ALA 333 Cb 0.03 -1.39 0.90 0.00 0.00 0.00 0.00 19.45 18.99 3dlb n ALA 333 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3dlb n LEU 334 N -2.14 0.08 0.00 0.00 4.77 -0.38 -0.69 117.00 118.64 3dlb n LEU 334 Ca 0.05 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 3dlb n LEU 334 Cb 0.42 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 3dlb n LEU 334 CO 0.31 0.01 -0.36 0.54 -1.33 0.00 0.00 177.39 176.56 3dlb n ARG 335 N -0.99 1.99 0.01 3.23 1.74 -1.15 -3.06 116.66 118.44 3dlb n ARG 335 Ca 0.22 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 57.13 3dlb n ARG 335 Cb 0.14 -0.86 -0.14 0.00 -1.02 0.00 0.00 32.46 30.58 3dlb n ARG 335 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3dlb h VAL 336 N 0.00 0.82 0.00 1.55 2.07 -1.50 -3.46 116.25 115.73 3dlb h VAL 336 Ca 0.00 -2.55 0.00 0.00 0.82 0.00 0.00 66.70 64.97 3dlb h VAL 336 Cb 0.73 2.55 0.00 0.00 -1.52 0.00 0.00 31.29 33.05 3dlb h VAL 336 CO 0.00 0.77 0.00 0.61 0.02 0.00 0.00 177.57 178.97 3dlb n GLY 337 N 1.79 3.68 3.85 2.17 0.00 0.14 -4.70 105.19 112.12 3dlb n GLY 337 Ca -0.24 -1.72 -0.31 0.00 0.00 0.00 0.00 46.02 43.75 3dlb n GLY 337 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dlb s PHE 338 N -2.35 3.50 0.12 1.61 0.08 -1.25 -2.10 117.98 117.58 3dlb s PHE 338 Ca 0.00 1.35 -0.15 0.00 0.12 0.00 0.00 56.93 58.26 3dlb s PHE 338 Cb 0.00 -2.77 -0.04 0.00 -0.57 0.00 0.00 43.02 39.64 3dlb s PHE 338 CO 0.00 -0.71 1.51 -0.92 -0.10 0.00 0.00 175.22 175.01 3dlb h TYR 339 N -0.07 0.81 -3.91 0.36 3.20 -0.17 -3.21 116.97 113.98 3dlb h TYR 339 Ca -0.45 -0.18 -0.40 0.00 3.14 0.00 0.00 58.73 60.84 3dlb h TYR 339 Cb 1.19 -0.19 -0.30 0.00 1.54 0.00 0.00 36.73 38.97 3dlb h TYR 339 CO 0.65 0.87 -0.78 1.03 -1.64 0.00 0.00 178.16 178.29 3dlb s ARG 340 N -4.74 0.79 0.37 1.82 1.81 -0.64 -4.83 118.95 113.52 3dlb s ARG 340 Ca -0.13 -0.29 0.06 0.00 -1.72 0.00 0.00 55.73 53.65 3dlb s ARG 340 Cb 0.10 -0.75 -0.07 0.00 -0.45 0.00 0.00 34.95 33.77 3dlb s ARG 340 CO 0.81 0.14 0.02 0.00 -0.68 0.00 0.00 175.30 175.58 3dlb s ALA 341 N 0.01 2.81 0.03 2.13 0.00 -1.26 -3.57 121.76 121.91 3dlb s ALA 341 Ca 0.00 -2.18 -0.28 0.00 0.00 0.00 0.00 51.96 49.50 3dlb s ALA 341 Cb -0.06 0.33 0.09 0.00 0.00 0.00 0.00 23.12 23.49 3dlb s ALA 341 CO -0.00 -0.17 0.93 -0.65 0.00 0.00 0.00 175.76 175.86 3dlb s GLN 342 N -3.77 0.89 -0.17 0.00 -0.21 -1.26 -5.03 119.66 110.11 3dlb s GLN 342 Ca 0.35 -0.38 -0.29 0.00 0.02 0.00 0.00 55.36 55.06 3dlb s GLN 342 Cb 0.09 0.37 -0.02 0.00 1.00 0.00 0.00 33.01 34.45 3dlb s GLN 342 CO 0.17 -0.39 1.34 -1.21 -2.12 0.00 0.00 175.29 173.08 3dlb s GLU 343 N -3.12 4.16 0.11 2.91 0.41 -1.26 -4.46 118.70 117.46 3dlb s GLU 343 Ca 0.07 1.69 0.09 0.00 -0.41 0.00 0.00 54.97 56.41 3dlb s GLU 343 Cb -0.01 -3.83 -0.04 0.00 -1.78 0.00 0.00 34.13 28.47 3dlb s GLU 343 CO -0.06 -0.81 -0.18 -0.08 -0.49 0.00 0.00 175.26 173.65 3dlb s THR 344 N 3.78 2.87 -0.13 3.63 -1.32 -0.60 -5.00 115.64 118.87 3dlb s THR 344 Ca 0.59 -1.48 0.00 0.00 -1.21 0.00 0.00 61.69 59.58 3dlb s THR 344 Cb -0.23 -2.32 0.02 0.00 -1.51 0.00 0.00 72.50 68.47 3dlb s THR 344 CO 0.19 0.11 -0.11 0.00 -2.21 0.00 0.00 174.62 172.59 3dlb s ALA 345 N -1.14 1.59 -0.11 11.08 0.00 -1.26 -1.14 121.76 130.78 3dlb s ALA 345 Ca 0.18 -0.72 -0.01 0.00 0.00 0.00 0.00 51.96 51.42 3dlb s ALA 345 Cb -0.11 -0.97 0.03 0.00 0.00 0.00 0.00 23.12 22.08 3dlb s ALA 345 CO 0.10 -0.37 -0.06 -0.51 0.00 0.00 0.00 175.76 174.92 3dlb s LEU 346 N 1.55 1.10 0.16 0.00 1.02 -0.92 -0.06 118.68 121.52 3dlb s LEU 346 Ca 0.04 -0.29 0.00 0.00 0.02 0.00 0.00 54.13 53.90 3dlb s LEU 346 Cb -0.13 -0.77 -0.04 0.00 0.02 0.00 0.00 46.19 45.27 3dlb s LEU 346 CO -0.09 -0.14 0.33 0.00 0.02 0.00 0.00 176.35 176.47 3dlb s ALA 347 N 1.76 3.90 0.00 4.21 0.00 -0.96 -2.27 121.76 128.40 3dlb s ALA 347 Ca 0.05 -0.89 0.06 0.00 0.00 0.00 0.00 51.96 51.17 3dlb s ALA 347 Cb -0.13 -1.90 -0.03 0.00 0.00 0.00 0.00 23.12 21.06 3dlb s ALA 347 CO -0.08 0.54 -0.16 -1.17 0.00 0.00 0.00 175.76 174.89 3dlb s LEU 348 N -3.16 2.69 -0.15 0.00 0.20 -0.92 -1.65 118.68 115.69 3dlb s LEU 348 Ca 0.37 -0.32 0.01 0.00 0.69 0.00 0.00 54.13 54.88 3dlb s LEU 348 Cb -0.11 -1.56 0.02 0.00 -0.43 0.00 0.00 46.19 44.10 3dlb s LEU 348 CO 0.28 0.29 -0.19 -0.22 -0.29 0.00 0.00 176.35 176.23 3dlb s LEU 349 N -1.16 1.98 -0.21 -0.68 2.96 -0.12 0.21 118.68 121.66 3dlb s LEU 349 Ca 0.14 -0.57 -0.05 0.00 -0.22 0.00 0.00 54.13 53.42 3dlb s LEU 349 Cb -0.11 -1.36 -0.02 0.00 0.50 0.00 0.00 46.19 45.21 3dlb s LEU 349 CO 0.04 0.01 -0.01 -0.60 -1.32 0.00 0.00 176.35 174.47 3dlb s ARG 350 N 1.17 3.56 -0.44 1.98 3.52 -1.26 -2.19 118.95 125.28 3dlb s ARG 350 Ca 0.00 -0.54 0.04 0.00 -0.13 0.00 0.00 55.73 55.10 3dlb s ARG 350 Cb -0.14 -3.07 0.48 0.00 -1.56 0.00 0.00 34.95 30.66 3dlb s ARG 350 CO -0.08 -0.04 1.59 1.28 -0.81 0.00 0.00 175.30 177.24 3dlb n LEU 351 N 4.40 5.91 0.00 -0.88 4.77 -0.63 -4.76 117.00 125.80 3dlb n LEU 351 Ca -0.17 -4.35 0.00 0.00 -0.03 0.00 0.00 56.01 51.46 3dlb n LEU 351 Cb 0.52 -0.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 3dlb n LEU 351 CO 0.31 1.67 0.00 -0.90 -1.33 0.00 0.00 177.39 177.14 3dlb n ASP 352 N -0.89 0.00 0.00 -1.43 5.75 -1.26 -4.32 116.55 114.40 3dlb n ASP 352 Ca 0.50 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 55.28 3dlb n ASP 352 Cb 0.90 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.99 3dlb n ASP 352 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dlb n GLY 353 N 0.78 2.62 0.00 6.12 0.00 -1.26 -5.14 105.19 108.31 3dlb n GLY 353 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3dlb n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dlb n ALA 354 N -3.00 0.00 0.00 4.61 0.00 -1.26 -4.89 120.51 115.97 3dlb n ALA 354 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3dlb n ALA 354 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 3dlb n ALA 354 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dlb n GLY 356 N 0.00 0.00 3.79 0.00 0.00 -1.26 -4.78 105.19 102.94 3dlb n GLY 356 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 3dlb n GLY 356 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3dlb s TRP 357 N 0.00 3.81 0.57 1.61 0.52 -1.26 -5.04 118.94 119.16 3dlb s TRP 357 Ca 0.00 1.58 -0.21 0.00 0.02 0.00 0.00 56.10 57.49 3dlb s TRP 357 Cb 0.00 -2.74 -0.04 0.00 -1.15 0.00 0.00 33.47 29.54 3dlb s TRP 357 CO 0.00 0.43 1.35 -2.14 0.02 0.00 0.00 176.95 176.60 3dlb s PRO 358 N -1.50 2.97 0.13 4.98 0.02 -1.26 -4.84 135.00 135.51 3dlb s PRO 358 Ca 0.40 2.20 -0.19 0.00 0.02 0.00 0.00 61.00 63.43 3dlb s PRO 358 Cb -0.21 -2.15 -0.01 0.00 0.02 0.00 0.00 34.50 32.16 3dlb s PRO 358 CO 0.24 -1.31 1.74 1.49 -0.33 0.00 0.00 177.00 178.83 3dlb h GLU 359 N 1.21 0.14 0.00 5.54 4.57 -1.99 -2.45 114.58 121.60 3dlb h GLU 359 Ca -0.51 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.66 3dlb h GLU 359 Cb 1.31 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.87 3dlb h GLU 359 CO 0.56 0.09 0.00 0.27 -1.18 0.00 0.00 179.01 178.75 3dlb h PHE 360 N 0.15 0.00 0.20 0.92 -5.15 -1.99 0.60 116.94 111.67 3dlb h PHE 360 Ca 0.11 0.00 -0.30 0.00 -0.20 0.00 0.00 57.97 57.58 3dlb h PHE 360 Cb 0.11 0.00 0.02 0.00 0.22 0.00 0.00 35.95 36.30 3dlb h PHE 360 CO -0.15 0.00 -1.40 -0.07 -2.00 0.00 0.00 178.31 174.68 3dlb h LEU 361 N 0.00 0.67 -1.14 2.10 3.38 -1.85 -2.72 115.31 115.75 3dlb h LEU 361 Ca 0.00 -0.92 -0.08 0.00 0.09 0.00 0.00 57.88 56.97 3dlb h LEU 361 Cb 0.26 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3dlb h LEU 361 CO 0.00 1.66 -0.24 -0.09 0.09 0.00 0.00 178.44 179.86 3dlb h ARG 362 N -0.02 0.30 0.51 1.13 2.43 -0.99 -2.69 114.38 115.05 3dlb h ARG 362 Ca -0.26 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 58.78 3dlb h ARG 362 Cb 2.00 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 31.53 3dlb h ARG 362 CO 0.20 0.53 -0.24 -0.09 -1.51 0.00 0.00 179.97 178.86 3dlb h ARG 363 N 0.27 -0.66 -0.59 0.20 2.43 -0.96 -2.42 114.38 112.66 3dlb h ARG 363 Ca 0.04 0.04 0.12 0.00 -0.81 0.00 0.00 59.98 59.37 3dlb h ARG 363 Cb 0.58 0.15 -0.09 0.00 -0.42 0.00 0.00 29.97 30.19 3dlb h ARG 363 CO 0.04 -0.44 0.07 0.00 -1.51 0.00 0.00 179.97 178.13 3dlb h ALA 364 N -1.26 0.64 -0.65 2.80 0.00 -1.52 0.60 119.26 119.87 3dlb h ALA 364 Ca -0.07 0.15 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3dlb h ALA 364 Cb 0.52 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 3dlb h ALA 364 CO 0.11 -0.35 0.43 -0.07 0.00 0.00 0.00 179.25 179.38 3dlb h LEU 365 N 0.19 0.69 -0.09 0.00 3.38 -1.56 1.04 115.31 118.96 3dlb h LEU 365 Ca 0.31 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 58.13 3dlb h LEU 365 Cb 0.47 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.07 3dlb h LEU 365 CO -0.44 0.48 -0.48 -0.07 0.09 0.00 0.00 178.44 178.02 3dlb h LEU 366 N 0.80 0.57 0.62 1.67 3.38 -0.30 -1.48 115.31 120.57 3dlb h LEU 366 Ca 0.26 -0.65 -0.03 0.00 0.09 0.00 0.00 57.88 57.55 3dlb h LEU 366 Cb 0.04 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3dlb h LEU 366 CO -0.07 1.13 -0.31 -0.09 0.09 0.00 0.00 178.44 179.19 3dlb h ARG 367 N 0.06 -0.83 -0.99 1.13 2.43 0.12 0.33 114.38 116.62 3dlb h ARG 367 Ca -0.03 0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.29 3dlb h ARG 367 Cb 1.12 0.19 -0.07 0.00 -0.42 0.00 0.00 29.97 30.79 3dlb h ARG 367 CO 0.10 -0.55 0.63 0.00 -1.51 0.00 0.00 179.97 178.64 3dlb h ALA 368 N -0.48 1.49 0.00 2.80 0.00 0.12 0.13 119.26 123.31 3dlb h ALA 368 Ca -0.08 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 3dlb h ALA 368 Cb 0.67 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 3dlb h ALA 368 CO 0.13 0.31 -0.88 0.74 0.00 0.00 0.00 179.25 179.56 3dlb h PHE 369 N 1.06 0.00 -0.09 0.00 -1.00 -1.08 -2.94 116.94 112.89 3dlb h PHE 369 Ca 0.46 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 61.23 3dlb h PHE 369 Cb 0.34 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.90 3dlb h PHE 369 CO -0.00 0.88 0.02 0.78 -1.61 0.00 0.00 178.31 178.37 3dlb h GLY 370 N 2.68 0.15 1.79 -1.45 0.00 0.70 -1.47 103.07 105.47 3dlb h GLY 370 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.22 3dlb h GLY 370 CO 0.11 0.09 0.00 0.00 0.00 0.00 0.00 176.54 176.75 3dlb n ALA 371 N -2.25 1.16 0.04 3.60 0.00 0.35 -0.96 120.51 122.45 3dlb n ALA 371 Ca -0.06 -0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.38 3dlb n ALA 371 Cb 0.16 -1.02 0.02 0.00 0.00 0.00 0.00 19.45 18.61 3dlb n ALA 371 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3dlb n SER 372 N -1.39 1.52 -2.29 0.00 7.64 -0.77 -4.48 113.62 113.84 3dlb n SER 372 Ca 0.00 -1.41 -0.17 0.00 1.01 0.00 0.00 58.87 58.31 3dlb n SER 372 Cb 0.01 -0.01 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 3dlb n SER 372 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dlb n GLY 373 N -0.04 -0.21 3.71 0.23 0.00 -0.14 -4.95 105.19 103.80 3dlb n GLY 373 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 3dlb n GLY 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dlb s ALA 374 N -2.79 3.37 0.09 4.61 0.00 -0.84 -5.05 121.76 121.16 3dlb s ALA 374 Ca 0.00 -1.10 -0.23 0.00 0.00 0.00 0.00 51.96 50.63 3dlb s ALA 374 Cb 0.00 -1.26 -0.07 0.00 0.00 0.00 0.00 23.12 21.79 3dlb s ALA 374 CO 0.00 0.70 0.70 -1.54 0.00 0.00 0.00 175.76 175.62 3dlb s SER 375 N -2.38 7.21 -0.08 0.00 1.04 -1.26 -4.55 113.70 113.67 3dlb s SER 375 Ca 0.27 1.44 0.01 0.00 0.48 0.00 0.00 55.95 58.15 3dlb s SER 375 Cb -0.12 -2.44 0.02 0.00 0.10 0.00 0.00 66.02 63.58 3dlb s SER 375 CO 0.19 0.17 -0.11 -0.22 0.98 0.00 0.00 173.24 174.26 3dlb s LEU 376 N -0.79 1.52 -0.07 2.42 2.96 -1.26 -1.55 118.68 121.90 3dlb s LEU 376 Ca 0.34 -0.31 -0.00 0.00 -0.22 0.00 0.00 54.13 53.93 3dlb s LEU 376 Cb -0.21 -0.86 -0.03 0.00 0.50 0.00 0.00 46.19 45.59 3dlb s LEU 376 CO 0.22 -0.02 -0.03 -0.13 -1.32 0.00 0.00 176.35 175.08 3dlb s ARG 377 N 1.01 2.84 -0.28 1.98 0.52 -0.29 -5.02 118.95 119.73 3dlb s ARG 377 Ca -0.08 -0.50 0.01 0.00 -0.52 0.00 0.00 55.73 54.65 3dlb s ARG 377 Cb -0.15 -2.68 0.08 0.00 0.52 0.00 0.00 34.95 32.72 3dlb s ARG 377 CO -0.01 0.68 0.00 -0.51 0.02 0.00 0.00 175.30 175.48 3dlb s LEU 378 N -0.91 3.03 0.56 2.53 2.01 -1.26 -2.18 118.68 122.46 3dlb s LEU 378 Ca 0.13 -1.51 0.03 0.00 0.01 0.00 0.00 54.13 52.79 3dlb s LEU 378 Cb -0.11 -1.22 0.05 0.00 0.01 0.00 0.00 46.19 44.91 3dlb s LEU 378 CO 0.03 -0.31 0.77 -1.00 1.01 0.00 0.00 176.35 176.85 3dlb s HIS 379 N 1.32 2.52 -0.01 0.29 3.76 -0.96 -5.01 115.29 117.20 3dlb s HIS 379 Ca 0.01 -0.19 0.01 0.00 -0.15 0.00 0.00 55.06 54.74 3dlb s HIS 379 Cb -0.19 -2.68 0.01 0.00 1.11 0.00 0.00 32.58 30.83 3dlb s HIS 379 CO -0.11 -0.95 -0.02 -0.08 -0.85 0.00 0.00 174.74 172.74 3dlb s THR 380 N -2.74 0.17 -0.33 1.30 -1.32 -1.26 -2.17 115.64 109.29 3dlb s THR 380 Ca 0.59 -0.05 -0.29 0.00 -1.21 0.00 0.00 61.69 60.73 3dlb s THR 380 Cb -0.09 -0.18 0.01 0.00 -1.51 0.00 0.00 72.50 70.72 3dlb s THR 380 CO 0.38 0.07 1.26 -0.76 -2.21 0.00 0.00 174.62 173.37 3dlb s LEU 381 N 0.23 3.84 0.00 9.08 1.43 0.56 -4.81 118.68 129.01 3dlb s LEU 381 Ca -0.02 1.08 0.04 0.00 -1.03 0.00 0.00 54.13 54.20 3dlb s LEU 381 Cb -0.04 -3.54 0.24 0.00 0.03 0.00 0.00 46.19 42.87 3dlb s LEU 381 CO -0.01 -1.09 0.73 0.00 0.23 0.00 0.00 176.35 176.22 3dlb n HIS 382 N 7.62 0.00 -4.03 0.29 1.44 -1.26 -4.66 115.22 114.61 3dlb n HIS 382 Ca 0.14 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.75 3dlb n HIS 382 Cb 0.47 0.00 -0.06 0.00 0.12 0.00 0.00 29.99 30.52 3dlb n HIS 382 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3dlb s ALA 383 N -2.00 0.04 -0.03 1.59 0.00 -1.26 -5.08 121.76 115.02 3dlb s ALA 383 Ca 0.06 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 51.01 3dlb s ALA 383 Cb 0.03 1.12 0.01 0.00 0.00 0.00 0.00 23.12 24.27 3dlb s ALA 383 CO 0.05 -0.79 -0.08 -1.58 0.00 0.00 0.00 175.76 173.36 3dlb s HIS 384 N -4.04 0.86 0.36 0.00 2.46 -1.26 -4.84 115.29 108.82 3dlb s HIS 384 Ca 0.25 -0.21 0.30 0.00 0.47 0.00 0.00 55.06 55.87 3dlb s HIS 384 Cb 0.01 -0.63 1.17 0.00 -0.13 0.00 0.00 32.58 33.00 3dlb s HIS 384 CO 0.09 -0.10 1.14 -2.30 -2.47 0.00 0.00 174.74 171.10 3dlb n PRO 385 N 3.38 -0.01 0.00 2.88 -0.02 -1.26 -1.59 135.00 138.37 3dlb n PRO 385 Ca -0.19 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 3dlb n PRO 385 Cb 0.54 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 3dlb n PRO 385 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3dlb n SER 386 N -3.82 0.08 -1.08 2.55 3.41 -1.26 -3.02 113.62 110.48 3dlb n SER 386 Ca 0.31 -1.38 0.01 0.00 -0.26 0.00 0.00 58.87 57.55 3dlb n SER 386 Cb 1.30 -0.04 0.23 0.00 -0.26 0.00 0.00 64.21 65.44 3dlb n SER 386 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dlb n GLN 387 N -0.43 2.34 0.00 4.33 6.02 -0.62 -5.04 117.38 123.98 3dlb n GLN 387 Ca 0.00 -3.02 0.00 0.00 -0.01 0.00 0.00 57.00 53.97 3dlb n GLN 387 Cb 0.02 -1.85 0.00 0.00 1.02 0.00 0.00 30.24 29.43 3dlb n GLN 387 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dlb n GLY 388 N -0.86 3.36 0.36 1.08 0.00 -1.17 -2.34 105.19 105.63 3dlb n GLY 388 Ca 0.29 0.19 0.11 0.00 0.00 0.00 0.00 46.02 46.61 3dlb n GLY 388 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3dlb h LEU 389 N 0.00 0.79 -0.50 0.99 3.38 -1.96 -2.23 115.31 115.78 3dlb h LEU 389 Ca 0.00 0.07 0.10 0.00 0.09 0.00 0.00 57.88 58.14 3dlb h LEU 389 Cb 0.00 -0.08 -0.09 0.00 0.09 0.00 0.00 40.66 40.58 3dlb h LEU 389 CO 0.00 0.35 -0.05 0.00 0.09 0.00 0.00 178.44 178.84 3dlb h ALA 390 N 1.60 0.42 -0.02 1.53 0.00 -1.88 -1.07 119.26 119.84 3dlb h ALA 390 Ca 0.52 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.61 3dlb h ALA 390 Cb 0.75 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.81 3dlb h ALA 390 CO -0.30 -0.41 -0.35 0.35 0.00 0.00 0.00 179.25 178.54 3dlb h PHE 391 N 0.07 -1.04 -0.86 0.00 3.57 -1.56 0.47 116.94 117.58 3dlb h PHE 391 Ca 0.25 0.03 0.22 0.00 3.53 0.00 0.00 57.97 62.00 3dlb h PHE 391 Cb 0.38 0.46 -0.13 0.00 2.79 0.00 0.00 35.95 39.45 3dlb h PHE 391 CO -0.35 -0.37 0.31 -0.09 -2.23 0.00 0.00 178.31 175.58 3dlb h ARG 392 N -0.42 0.31 0.30 1.11 9.65 -1.55 0.86 114.38 124.64 3dlb h ARG 392 Ca 0.01 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3dlb h ARG 392 Cb 0.46 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.95 3dlb h ARG 392 CO -0.25 0.20 -0.30 1.49 2.80 0.00 0.00 179.97 183.91 3dlb h GLU 393 N 0.32 -0.61 -0.37 0.20 4.57 0.19 -1.84 114.58 117.04 3dlb h GLU 393 Ca 0.53 0.04 0.07 0.00 -1.18 0.00 0.00 59.36 58.83 3dlb h GLU 393 Cb 1.02 0.14 -0.07 0.00 -0.16 0.00 0.00 28.75 29.69 3dlb h GLU 393 CO -0.56 -0.41 -0.06 0.00 -1.18 0.00 0.00 179.01 176.80 3dlb h ALA 394 N -0.07 0.28 -0.78 2.92 0.00 0.21 -1.42 119.26 120.40 3dlb h ALA 394 Ca -0.01 0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.12 3dlb h ALA 394 Cb 0.58 0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.55 3dlb h ALA 394 CO -0.06 -0.44 0.43 -0.07 0.00 0.00 0.00 179.25 179.11 3dlb h LEU 395 N 0.03 0.60 -0.72 0.00 3.38 -0.83 0.24 115.31 118.01 3dlb h LEU 395 Ca 0.18 0.05 -0.09 0.00 0.09 0.00 0.00 57.88 58.10 3dlb h LEU 395 Cb 0.27 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3dlb h LEU 395 CO -0.35 0.35 -0.05 -0.09 0.09 0.00 0.00 178.44 178.38 3dlb h ARG 396 N 0.73 0.93 0.44 1.13 2.43 -0.56 0.29 114.38 119.77 3dlb h ARG 396 Ca 0.37 -0.30 -0.02 0.00 -0.81 0.00 0.00 59.98 59.22 3dlb h ARG 396 Cb 0.35 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 3dlb h ARG 396 CO -0.25 0.95 -0.21 0.87 -1.51 0.00 0.00 179.97 179.82 3dlb h LYS 397 N 0.85 -0.58 -1.00 0.20 1.57 -0.56 0.22 116.57 117.27 3dlb h LYS 397 Ca 0.15 0.04 0.10 0.00 -1.87 0.00 0.00 60.65 59.07 3dlb h LYS 397 Cb 0.57 0.13 -0.08 0.00 0.08 0.00 0.00 32.23 32.93 3dlb h LYS 397 CO 0.03 -0.31 0.64 0.00 -0.57 0.00 0.00 179.45 179.24 3dlb h ALA 398 N -0.25 1.49 -0.48 3.86 0.00 -0.80 0.25 119.26 123.33 3dlb h ALA 398 Ca -0.06 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.78 3dlb h ALA 398 Cb 0.53 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3dlb h ALA 398 CO 0.10 0.29 -0.02 -0.22 0.00 0.00 0.00 179.25 179.40 3dlb h LYS 399 N 1.04 0.80 -0.49 0.00 3.11 -0.25 -1.52 116.57 119.26 3dlb h LYS 399 Ca 0.48 -0.23 -0.05 0.00 -2.81 0.00 0.00 60.65 58.04 3dlb h LYS 399 Cb 0.39 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.52 3dlb h LYS 399 CO -0.23 0.82 0.11 0.93 -2.81 0.00 0.00 179.45 178.27 3dlb h GLU 400 N 0.74 0.79 -0.03 1.90 5.08 0.15 -2.93 114.58 120.28 3dlb h GLU 400 Ca 0.14 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 3dlb h GLU 400 Cb 0.48 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.63 3dlb h GLU 400 CO 0.02 0.78 0.00 0.39 -1.00 0.00 0.00 179.01 179.20 3dlb n GLU 401 N -4.46 0.54 -0.09 2.33 1.02 0.40 -4.80 120.64 115.58 3dlb n GLU 401 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 3dlb n GLU 401 Cb 0.23 -1.01 0.00 0.00 -0.02 0.00 0.00 31.44 30.63 3dlb n GLU 401 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dlb n GLY 402 N 0.05 0.59 3.67 0.62 0.00 -1.11 -5.04 105.19 103.98 3dlb n GLY 402 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.55 3dlb n GLY 402 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3dlb n VAL 403 N -2.00 0.24 0.58 1.61 0.31 -0.60 -4.36 118.33 114.11 3dlb n VAL 403 Ca 0.00 -0.04 0.06 0.00 -0.01 0.00 0.00 64.34 64.35 3dlb n VAL 403 Cb 0.00 -1.68 -0.03 0.00 -0.91 0.00 0.00 33.84 31.22 3dlb n VAL 403 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3dlb n GLN 404 N 4.72 2.26 -3.60 5.55 6.02 0.91 -4.62 117.38 128.63 3dlb n GLN 404 Ca 0.19 -0.45 -0.05 0.00 -0.01 0.00 0.00 57.00 56.69 3dlb n GLN 404 Cb 0.29 -1.14 -0.03 0.00 1.02 0.00 0.00 30.24 30.38 3dlb n GLN 404 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3dlb s ALA 405 N -1.83 -2.07 -0.03 -1.58 0.00 -1.25 -4.41 121.76 110.59 3dlb s ALA 405 Ca 0.09 1.66 0.05 0.00 0.00 0.00 0.00 51.96 53.76 3dlb s ALA 405 Cb 0.10 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.76 3dlb s ALA 405 CO 0.40 -0.50 -0.18 0.08 0.00 0.00 0.00 175.76 175.56 3dlb s VAL 406 N -2.01 1.47 -0.08 0.00 1.01 -0.39 -2.28 120.40 118.13 3dlb s VAL 406 Ca 0.08 -0.76 -0.09 0.00 0.00 0.00 0.00 61.98 61.20 3dlb s VAL 406 Cb -0.01 -1.25 -0.05 0.00 0.00 0.00 0.00 36.38 35.08 3dlb s VAL 406 CO -0.05 0.42 0.23 -0.22 0.00 0.00 0.00 175.10 175.48 3dlb s LEU 407 N -0.16 4.42 -0.27 3.92 2.96 -0.66 -1.09 118.68 127.79 3dlb s LEU 407 Ca 0.01 0.63 0.00 0.00 -0.22 0.00 0.00 54.13 54.55 3dlb s LEU 407 Cb -0.10 -2.25 0.08 0.00 0.50 0.00 0.00 46.19 44.42 3dlb s LEU 407 CO 0.01 0.38 0.03 -0.69 -1.32 0.00 0.00 176.35 174.76 3dlb s VAL 408 N -1.05 1.26 -0.13 1.68 1.01 -0.04 -0.94 120.40 122.18 3dlb s VAL 408 Ca 0.18 -1.38 -0.24 0.00 0.00 0.00 0.00 61.98 60.55 3dlb s VAL 408 Cb -0.14 -1.78 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 3dlb s VAL 408 CO 0.07 -0.42 0.74 -0.76 0.00 0.00 0.00 175.10 174.73 3dlb s LEU 409 N 1.47 4.23 -0.17 3.92 1.43 -0.93 -0.56 118.68 128.06 3dlb s LEU 409 Ca 0.04 1.11 -0.28 0.00 -1.03 0.00 0.00 54.13 53.97 3dlb s LEU 409 Cb -0.18 -3.10 0.08 0.00 0.03 0.00 0.00 46.19 43.02 3dlb s LEU 409 CO -0.14 -0.26 0.77 0.28 0.23 0.00 0.00 176.35 177.23 3dlb s THR 410 N 1.56 0.00 0.89 5.49 -1.32 -0.90 -1.61 115.64 119.75 3dlb s THR 410 Ca 0.36 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.72 3dlb s THR 410 Cb -0.17 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 69.91 3dlb s THR 410 CO 0.14 0.00 0.89 -0.81 -2.21 0.00 0.00 174.62 172.64 3dlb n PRO 411 N 1.72 -0.22 -1.58 7.08 -0.04 -1.26 -0.23 135.00 140.47 3dlb n PRO 411 Ca -0.15 -0.00 -0.45 0.00 -0.04 0.00 0.00 63.50 62.86 3dlb n PRO 411 Cb 0.56 -2.20 -0.04 0.00 -0.04 0.00 0.00 33.50 31.79 3dlb n PRO 411 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3dlb n PRO 412 N -3.02 1.89 -3.95 0.54 -0.02 -1.26 -4.79 135.00 124.39 3dlb n PRO 412 Ca 0.11 0.56 -0.31 0.00 -2.02 0.00 0.00 63.50 61.83 3dlb n PRO 412 Cb 0.52 -3.00 -0.05 0.00 -0.02 0.00 0.00 33.50 30.95 3dlb n PRO 412 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dlb s MET 413 N 5.95 3.30 0.56 -0.52 0.23 -1.26 -5.08 119.30 122.48 3dlb s MET 413 Ca 1.01 -0.49 -0.21 0.00 -1.03 0.00 0.00 55.69 54.97 3dlb s MET 413 Cb -0.49 -2.96 -0.04 0.00 -1.53 0.00 0.00 34.83 29.81 3dlb s MET 413 CO 0.40 0.60 1.30 0.00 -2.03 0.00 0.00 175.02 175.30 3dlb s ALA 414 N -1.46 2.71 0.25 3.16 0.00 -1.26 -4.77 121.76 120.39 3dlb s ALA 414 Ca 0.33 1.22 -0.06 0.00 0.00 0.00 0.00 51.96 53.45 3dlb s ALA 414 Cb -0.13 -3.53 0.46 0.00 0.00 0.00 0.00 23.12 19.93 3dlb s ALA 414 CO 0.26 -1.32 1.62 2.35 0.00 0.00 0.00 175.76 178.67 3dlb h TRP 415 N 1.25 -0.11 -0.96 0.00 7.01 -2.00 0.20 115.95 121.35 3dlb h TRP 415 Ca -0.51 0.06 0.05 0.00 2.11 0.00 0.00 58.89 60.60 3dlb h TRP 415 Cb 1.30 0.17 -0.06 0.00 -2.10 0.00 0.00 29.16 28.48 3dlb h TRP 415 CO 0.46 -0.28 0.62 0.93 -2.79 0.00 0.00 178.44 177.38 3dlb h GLU 416 N 0.08 1.15 -0.45 2.65 5.08 -2.00 -2.28 114.58 118.80 3dlb h GLU 416 Ca 0.43 -0.07 -0.13 0.00 -1.00 0.00 0.00 59.36 58.59 3dlb h GLU 416 Cb 0.77 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3dlb h GLU 416 CO -0.72 0.76 -0.24 -0.44 -1.00 0.00 0.00 179.01 177.37 3dlb h ASP 417 N 1.18 0.98 -0.04 1.42 3.32 -0.96 -2.78 116.42 119.54 3dlb h ASP 417 Ca 0.39 -0.41 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 3dlb h ASP 417 Cb 0.06 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.34 3dlb h ASP 417 CO -0.14 1.17 -0.03 0.08 -1.72 0.00 0.00 179.24 178.61 3dlb h ARG 418 N 0.79 0.10 -0.79 3.56 0.11 -1.20 -2.21 114.38 114.74 3dlb h ARG 418 Ca 0.10 -0.05 0.19 0.00 0.10 0.00 0.00 59.98 60.32 3dlb h ARG 418 Cb 0.82 -0.00 -0.13 0.00 1.11 0.00 0.00 29.97 31.76 3dlb h ARG 418 CO 0.07 0.51 0.08 -0.91 0.10 0.00 0.00 179.97 179.82 3dlb h ASN 419 N -0.32 -0.24 -0.31 0.08 -0.26 -1.46 0.21 115.58 113.29 3dlb h ASN 419 Ca 0.01 0.19 0.04 0.00 -0.56 0.00 0.00 56.30 55.99 3dlb h ASN 419 Cb 0.49 0.32 -0.04 0.00 -1.06 0.00 0.00 38.32 38.02 3dlb h ASN 419 CO 0.01 -0.16 0.06 -0.09 -1.06 0.00 0.00 177.43 176.18 3dlb h ARG 420 N 0.14 0.17 -0.49 0.81 2.43 -1.29 -2.07 114.38 114.08 3dlb h ARG 420 Ca 0.45 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.59 3dlb h ARG 420 Cb 0.83 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.32 3dlb h ARG 420 CO -0.66 0.11 0.22 1.25 -1.51 0.00 0.00 179.97 179.39 3dlb h LEU 421 N 0.17 0.65 -2.04 3.80 5.85 -0.07 -1.79 115.31 121.89 3dlb h LEU 421 Ca 0.14 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3dlb h LEU 421 Cb 0.15 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.01 3dlb h LEU 421 CO -0.19 0.61 0.00 0.11 -0.34 0.00 0.00 178.44 178.63 3dlb h LYS 422 N 0.65 0.00 0.17 1.25 1.57 -0.65 -0.89 116.57 118.67 3dlb h LYS 422 Ca 0.17 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.61 3dlb h LYS 422 Cb 0.14 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.46 3dlb h LYS 422 CO -0.02 0.00 -1.69 0.00 -0.57 0.00 0.00 179.45 177.17 3dlb h ALA 423 N 2.03 0.18 -0.17 3.86 0.00 -0.64 0.60 119.26 125.12 3dlb h ALA 423 Ca 0.00 -1.13 -0.08 0.00 0.00 0.00 0.00 54.91 53.70 3dlb h ALA 423 Cb 0.14 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3dlb h ALA 423 CO 0.00 1.05 -0.25 -0.07 0.00 0.00 0.00 179.25 179.98 3dlb h LEU 424 N 0.10 0.30 -0.03 0.00 3.38 -0.54 -2.16 115.31 116.36 3dlb h LEU 424 Ca -0.32 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.49 3dlb h LEU 424 Cb 2.08 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 42.76 3dlb h LEU 424 CO 0.18 0.55 -0.28 -0.07 0.09 0.00 0.00 178.44 178.91 3dlb h LEU 425 N 0.27 0.29 -2.48 1.67 3.38 -1.25 -3.29 115.31 113.91 3dlb h LEU 425 Ca 0.04 -0.71 0.02 0.00 0.09 0.00 0.00 57.88 57.32 3dlb h LEU 425 Cb 0.59 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 3dlb h LEU 425 CO 0.04 0.96 0.11 -0.07 0.09 0.00 0.00 178.44 179.58 3dlb h LEU 426 N -0.35 0.00 0.00 1.67 3.38 -0.58 0.96 115.31 120.39 3dlb h LEU 426 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3dlb h LEU 426 Cb 0.98 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.73 3dlb h LEU 426 CO 0.06 0.00 -0.26 -1.14 0.09 0.00 0.00 178.44 177.19 3dlb n ARG 427 N -3.49 0.08 -0.43 1.13 0.63 -0.84 -2.05 116.66 111.68 3dlb n ARG 427 Ca -0.01 0.04 0.06 0.00 -0.92 0.00 0.00 57.85 57.02 3dlb n ARG 427 Cb 0.20 -1.57 0.21 0.00 0.45 0.00 0.00 32.46 31.75 3dlb n ARG 427 CO 0.00 0.00 0.00 0.39 -2.51 0.00 0.00 177.63 175.51 3dlb n GLU 428 N -1.68 2.05 -3.80 -0.14 -0.58 -0.08 -4.95 120.64 111.46 3dlb n GLU 428 Ca 0.06 -2.89 -0.24 0.00 -0.42 0.00 0.00 57.16 53.67 3dlb n GLU 428 Cb 0.36 -1.72 0.01 0.00 -0.57 0.00 0.00 31.44 29.53 3dlb n GLU 428 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3dlb n GLY 429 N -0.99 -0.34 2.86 0.62 0.00 -0.87 -4.87 105.19 101.60 3dlb n GLY 429 Ca 0.22 0.18 -0.30 0.00 0.00 0.00 0.00 46.02 46.12 3dlb n GLY 429 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dlb s LEU 430 N -6.76 3.12 0.82 0.99 1.43 0.14 -4.96 118.68 113.46 3dlb s LEU 430 Ca 0.06 -1.73 -0.12 0.00 -1.03 0.00 0.00 54.13 51.30 3dlb s LEU 430 Cb -0.02 -1.16 0.09 0.00 0.03 0.00 0.00 46.19 45.13 3dlb s LEU 430 CO 0.85 -0.38 1.17 -2.84 0.23 0.00 0.00 176.35 175.39 3dlb s PRO 431 N 1.35 1.63 0.13 1.29 0.02 -1.26 -3.61 135.00 134.55 3dlb s PRO 431 Ca 0.08 1.63 -0.14 0.00 0.02 0.00 0.00 61.00 62.58 3dlb s PRO 431 Cb -0.18 -1.79 0.03 0.00 0.02 0.00 0.00 34.50 32.58 3dlb s PRO 431 CO -0.16 -2.19 0.37 -1.54 -0.33 0.00 0.00 177.00 173.15 3dlb s SER 432 N -2.42 -0.16 -0.03 2.53 1.04 -1.26 -1.26 113.70 112.13 3dlb s SER 432 Ca 0.70 -0.43 0.03 0.00 0.48 0.00 0.00 55.95 56.74 3dlb s SER 432 Cb -0.26 0.46 0.00 0.00 0.10 0.00 0.00 66.02 66.33 3dlb s SER 432 CO 0.52 -0.86 -0.13 -1.58 0.98 0.00 0.00 173.24 172.17 3dlb s GLN 433 N -3.83 1.37 -0.35 4.02 2.00 -0.25 -4.93 119.66 117.68 3dlb s GLN 433 Ca 0.05 -0.46 -0.08 0.00 -2.00 0.00 0.00 55.36 52.88 3dlb s GLN 433 Cb 0.02 -1.23 0.04 0.00 0.80 0.00 0.00 33.01 32.64 3dlb s GLN 433 CO -0.10 0.18 0.14 0.42 -0.50 0.00 0.00 175.29 175.42 3dlb s ILE 434 N 0.12 3.99 -0.37 -2.34 1.09 -1.26 -0.86 121.20 121.56 3dlb s ILE 434 Ca -0.03 -1.08 -0.11 0.00 -1.10 0.00 0.00 60.65 58.32 3dlb s ILE 434 Cb -0.10 -3.27 0.03 0.00 -1.06 0.00 0.00 42.46 38.06 3dlb s ILE 434 CO 0.01 -0.21 0.21 -0.22 -0.10 0.00 0.00 174.94 174.63 3dlb s LEU 435 N 1.44 4.72 0.07 2.97 0.20 0.28 -4.96 118.68 123.40 3dlb s LEU 435 Ca -0.01 -0.97 -0.30 0.00 0.69 0.00 0.00 54.13 53.54 3dlb s LEU 435 Cb -0.20 -2.03 -0.09 0.00 -0.43 0.00 0.00 46.19 43.44 3dlb s LEU 435 CO 0.04 -0.38 1.90 0.20 -0.29 0.00 0.00 176.35 177.82 3dlb s ASN 436 N 1.57 6.45 0.43 3.68 0.02 -1.26 -2.12 114.94 123.70 3dlb s ASN 436 Ca 0.02 2.69 0.19 0.00 -1.02 0.00 0.00 52.86 54.74 3dlb s ASN 436 Cb -0.19 -2.54 1.12 0.00 0.02 0.00 0.00 41.25 39.66 3dlb s ASN 436 CO 0.07 -1.03 1.86 1.62 0.02 0.00 0.00 177.10 179.64 3dlb h VAL 437 N 5.28 0.66 0.00 1.60 3.04 -0.89 -3.30 116.25 122.64 3dlb h VAL 437 Ca -0.48 -0.13 -0.44 0.00 -1.01 0.00 0.00 66.70 64.65 3dlb h VAL 437 Cb 1.23 0.26 0.04 0.00 -2.01 0.00 0.00 31.29 30.81 3dlb h VAL 437 CO 0.94 0.07 2.11 -0.81 -1.01 0.00 0.00 177.57 178.87 3dlb n PRO 438 N -4.49 1.32 -1.53 4.17 -0.04 -1.26 -4.79 135.00 128.38 3dlb n PRO 438 Ca 0.19 -1.39 -0.50 0.00 -0.04 0.00 0.00 63.50 61.76 3dlb n PRO 438 Cb 0.72 -2.55 -0.06 0.00 -0.04 0.00 0.00 33.50 31.57 3dlb n PRO 438 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 3dlb n LEU 439 N 6.00 2.52 -4.28 1.53 -0.00 -1.24 -4.93 117.00 116.60 3dlb n LEU 439 Ca 0.40 0.55 -0.45 0.00 -0.00 0.00 0.00 56.01 56.51 3dlb n LEU 439 Cb 0.24 -1.30 -0.05 0.00 -0.00 0.00 0.00 43.42 42.31 3dlb n LEU 439 CO 0.84 -0.58 0.24 -0.60 -0.00 0.00 0.00 177.39 177.30 3dlb s ARG 440 N 5.61 3.16 0.00 1.47 6.06 -1.26 -4.92 118.95 129.07 3dlb s ARG 440 Ca 1.05 -2.16 0.00 0.00 -2.50 0.00 0.00 55.73 52.11 3dlb s ARG 440 Cb -0.79 -4.24 0.00 0.00 0.06 0.00 0.00 34.95 29.98 3dlb s ARG 440 CO 0.49 -1.28 0.84 -1.91 -2.50 0.00 0.00 175.30 170.95 3dlb n GLU 441 N 4.41 0.00 0.14 5.12 0.00 -1.26 0.12 120.64 129.17 3dlb n GLU 441 Ca 0.02 0.84 0.00 0.00 0.00 0.00 0.00 57.16 58.02 3dlb n GLU 441 Cb 0.43 -1.30 0.00 0.00 0.00 0.00 0.00 31.44 30.57 3dlb n GLU 441 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 3dlb n GLU 442 N -2.56 0.01 -2.54 5.31 0.28 -1.26 -2.09 120.64 117.79 3dlb n GLU 442 Ca 0.00 0.40 -0.42 0.00 -0.16 0.00 0.00 57.16 56.99 3dlb n GLU 442 Cb 0.00 -2.13 0.01 0.00 1.43 0.00 0.00 31.44 30.75 3dlb n GLU 442 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 3dlb n GLU 443 N -1.60 4.62 -0.32 3.44 1.02 0.32 -4.79 120.64 123.34 3dlb n GLU 443 Ca 0.00 -4.14 0.03 0.00 -0.02 0.00 0.00 57.16 53.02 3dlb n GLU 443 Cb 0.69 -2.61 0.17 0.00 -0.02 0.00 0.00 31.44 29.66 3dlb n GLU 443 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dlb h ARG 444 N 4.95 0.92 -0.98 3.49 3.08 -1.62 -1.50 114.38 122.72 3dlb h ARG 444 Ca 0.45 -0.06 0.16 0.00 0.07 0.00 0.00 59.98 60.60 3dlb h ARG 444 Cb 0.46 -0.21 -0.16 0.00 0.08 0.00 0.00 29.97 30.14 3dlb h ARG 444 CO 1.38 0.61 -0.36 1.58 -1.07 0.00 0.00 179.97 182.12 3dlb n HIS 445 N -4.64 0.09 0.00 3.04 -0.00 -1.26 -0.37 115.22 112.07 3dlb n HIS 445 Ca 0.14 1.20 0.00 0.00 0.46 0.00 0.00 57.72 59.53 3dlb n HIS 445 Cb 0.23 -0.90 0.00 0.00 -0.12 0.00 0.00 29.99 29.20 3dlb n HIS 445 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 3dlb n ARG 446 N -5.47 0.00 0.26 1.57 1.74 -0.57 -2.79 116.66 111.39 3dlb n ARG 446 Ca 0.11 0.43 0.10 0.00 -0.77 0.00 0.00 57.85 57.72 3dlb n ARG 446 Cb 0.41 -1.41 0.68 0.00 -1.02 0.00 0.00 32.46 31.12 3dlb n ARG 446 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 3dlb h TRP 447 N 0.00 0.00 -0.21 -1.55 5.08 -1.45 -0.31 115.95 117.51 3dlb h TRP 447 Ca 0.00 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 59.88 3dlb h TRP 447 Cb 0.00 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.15 3dlb h TRP 447 CO 0.19 0.12 -0.27 0.93 -1.28 0.00 0.00 178.44 178.13 3dlb h GLU 448 N 0.00 0.39 -0.04 0.12 5.08 -0.81 -2.48 114.58 116.85 3dlb h GLU 448 Ca -0.00 -0.15 -0.07 0.00 -1.00 0.00 0.00 59.36 58.14 3dlb h GLU 448 Cb 0.26 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.49 3dlb h GLU 448 CO 0.02 0.63 -0.25 -0.91 -1.00 0.00 0.00 179.01 177.50 3dlb h ASN 449 N 0.35 0.28 -1.00 1.42 2.35 -1.03 -2.71 115.58 115.23 3dlb h ASN 449 Ca 0.05 -0.69 0.24 0.00 -0.55 0.00 0.00 56.30 55.36 3dlb h ASN 449 Cb 0.66 -0.08 -0.12 0.00 0.05 0.00 0.00 38.32 38.82 3dlb h ASN 449 CO 0.05 0.92 0.59 0.00 -1.65 0.00 0.00 177.43 177.34 3dlb h ALA 450 N 0.36 1.78 -0.24 -0.83 0.00 -0.98 -0.08 119.26 119.28 3dlb h ALA 450 Ca -0.02 0.12 -0.19 0.00 0.00 0.00 0.00 54.91 54.83 3dlb h ALA 450 Cb 0.93 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3dlb h ALA 450 CO 0.05 -0.26 -0.59 -0.07 0.00 0.00 0.00 179.25 178.37 3dlb h LEU 451 N 0.58 0.90 -0.57 0.00 4.07 -1.45 -1.97 115.31 116.87 3dlb h LEU 451 Ca 0.64 -0.50 0.02 0.00 0.08 0.00 0.00 57.88 58.12 3dlb h LEU 451 Cb 1.21 -0.26 -0.03 0.00 1.08 0.00 0.00 40.66 42.66 3dlb h LEU 451 CO -0.48 1.29 0.36 -0.07 -1.08 0.00 0.00 178.44 178.47 3dlb h LEU 452 N 0.60 0.60 0.17 1.67 3.38 -0.70 0.82 115.31 121.85 3dlb h LEU 452 Ca 0.00 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3dlb h LEU 452 Cb 1.20 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.81 3dlb h LEU 452 CO 0.13 0.43 -0.08 1.23 0.09 0.00 0.00 178.44 180.23 3dlb h GLY 453 N 0.72 -0.24 0.31 0.83 0.00 -1.28 0.34 103.07 103.75 3dlb h GLY 453 Ca 0.22 0.09 0.11 0.00 0.00 0.00 0.00 47.33 47.75 3dlb h GLY 453 CO -0.08 -0.09 0.25 -2.00 0.00 0.00 0.00 176.54 174.62 3dlb h LEU 454 N -0.25 0.24 -0.44 3.11 7.12 -1.07 0.35 115.31 124.37 3dlb h LEU 454 Ca -0.02 0.09 -0.11 0.00 0.13 0.00 0.00 57.88 57.97 3dlb h LEU 454 Cb 0.19 0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 40.38 3dlb h LEU 454 CO 0.04 0.13 -0.15 -0.07 -0.13 0.00 0.00 178.44 178.26 3dlb h LEU 455 N 0.42 0.89 -0.68 2.25 3.38 -0.34 -0.18 115.31 121.05 3dlb h LEU 455 Ca 0.34 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 3dlb h LEU 455 Cb 0.45 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 3dlb h LEU 455 CO -0.34 1.07 0.35 0.00 0.09 0.00 0.00 178.44 179.61 3dlb h ALA 456 N 0.85 0.88 0.00 1.53 0.00 0.67 -0.51 119.26 122.68 3dlb h ALA 456 Ca 0.11 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3dlb h ALA 456 Cb 0.70 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3dlb h ALA 456 CO 0.05 0.42 -0.39 0.87 0.00 0.00 0.00 179.25 180.20 3dlb h LYS 457 N 0.94 0.00 0.00 0.00 1.57 -0.18 -2.10 116.57 116.80 3dlb h LYS 457 Ca 0.24 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3dlb h LYS 457 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.40 3dlb h LYS 457 CO -0.03 0.39 0.00 0.00 -0.57 0.00 0.00 179.45 179.23 3dlb n ALA 458 N -2.33 2.03 0.00 3.86 0.00 -0.09 -4.84 120.51 119.12 3dlb n ALA 458 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3dlb n ALA 458 Cb 0.49 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.52 3dlb n ALA 458 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dlb n GLY 459 N 0.78 0.91 3.75 0.00 0.00 -0.79 -4.93 105.19 104.91 3dlb n GLY 459 Ca 0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 3dlb n GLY 459 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dlb s LEU 460 N 0.00 4.55 -0.91 0.99 1.43 -0.24 -4.99 118.68 119.51 3dlb s LEU 460 Ca 0.00 1.72 -0.16 0.00 -1.03 0.00 0.00 54.13 54.66 3dlb s LEU 460 Cb 0.00 -3.44 0.18 0.00 0.03 0.00 0.00 46.19 42.96 3dlb s LEU 460 CO 0.00 0.08 1.00 -1.10 0.23 0.00 0.00 176.35 176.56 3dlb s GLN 461 N -0.63 3.66 0.06 1.70 -0.21 -1.23 -4.00 119.66 119.00 3dlb s GLN 461 Ca 0.41 -2.17 -0.35 0.00 0.02 0.00 0.00 55.36 53.26 3dlb s GLN 461 Cb -0.23 -4.71 -0.20 0.00 1.00 0.00 0.00 33.01 28.87 3dlb s GLN 461 CO 0.28 -1.55 1.53 0.28 -2.12 0.00 0.00 175.29 173.71 3dlb h VAL 462 N 5.22 0.09 -4.03 1.09 2.07 -1.91 -1.58 116.25 117.19 3dlb h VAL 462 Ca 0.15 -0.04 -0.49 0.00 0.82 0.00 0.00 66.70 67.14 3dlb h VAL 462 Cb 1.01 0.09 -0.24 0.00 -1.52 0.00 0.00 31.29 30.64 3dlb h VAL 462 CO 0.96 0.00 -0.81 -0.69 0.02 0.00 0.00 177.57 177.06 3dlb s VAL 463 N -5.85 1.35 -0.13 2.57 1.01 -1.26 -0.33 120.40 117.76 3dlb s VAL 463 Ca -0.19 -1.20 -0.03 0.00 0.00 0.00 0.00 61.98 60.56 3dlb s VAL 463 Cb 0.02 -1.22 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 3dlb s VAL 463 CO 0.59 -0.00 -0.01 0.00 0.00 0.00 0.00 175.10 175.68 3dlb s ALA 464 N -0.97 3.19 -0.32 5.51 0.00 0.35 -4.71 121.76 124.81 3dlb s ALA 464 Ca 0.03 -0.80 -0.09 0.00 0.00 0.00 0.00 51.96 51.10 3dlb s ALA 464 Cb -0.09 -1.57 0.01 0.00 0.00 0.00 0.00 23.12 21.47 3dlb s ALA 464 CO 0.02 0.38 0.14 -1.17 0.00 0.00 0.00 175.76 175.14 3dlb s LEU 465 N -0.22 4.16 -0.02 0.00 1.98 -1.07 -1.24 118.68 122.27 3dlb s LEU 465 Ca 0.05 -0.69 -0.30 0.00 -2.89 0.00 0.00 54.13 50.30 3dlb s LEU 465 Cb -0.12 -1.97 -0.06 0.00 0.66 0.00 0.00 46.19 44.70 3dlb s LEU 465 CO 0.02 -0.24 1.67 -0.94 -1.89 0.00 0.00 176.35 174.97 3dlb s SER 466 N 1.56 6.65 0.31 3.68 1.04 -0.95 -4.74 113.70 121.25 3dlb s SER 466 Ca 0.03 2.31 0.03 0.00 0.48 0.00 0.00 55.95 58.80 3dlb s SER 466 Cb -0.18 -2.54 -0.06 0.00 0.10 0.00 0.00 66.02 63.35 3dlb s SER 466 CO 0.05 -0.92 0.07 -0.83 0.98 0.00 0.00 173.24 172.59 3dlb s GLY 467 N 3.19 2.03 -0.46 7.32 0.00 -1.26 -4.63 107.32 113.51 3dlb s GLY 467 Ca 0.74 -1.98 0.07 0.00 0.00 0.00 0.00 44.72 43.55 3dlb s GLY 467 CO 0.31 -1.77 0.96 0.00 0.00 0.00 0.00 173.10 172.60 3dlb n ALA 468 N -0.65 -0.59 -2.59 3.20 0.00 -1.26 -5.16 120.51 113.46 3dlb n ALA 468 Ca -0.02 -1.72 -0.18 0.00 0.00 0.00 0.00 53.44 51.52 3dlb n ALA 468 Cb 0.66 -1.19 -0.12 0.00 0.00 0.00 0.00 19.45 18.81 3dlb n ALA 468 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 3dlb s TYR 469 N 0.12 1.31 0.40 0.00 1.13 -1.26 -5.01 117.35 114.04 3dlb s TYR 469 Ca 0.28 -0.52 0.13 0.00 -1.41 0.00 0.00 57.07 55.55 3dlb s TYR 469 Cb 0.26 -0.71 0.81 0.00 -1.10 0.00 0.00 41.96 41.23 3dlb s TYR 469 CO -0.13 0.10 1.89 -1.00 -2.51 0.00 0.00 175.55 173.89 3dlb h PRO 470 N 3.89 0.04 -5.21 -3.49 0.13 -2.00 -3.43 132.00 121.92 3dlb h PRO 470 Ca -0.40 -0.01 -0.62 0.00 -0.87 0.00 0.00 66.00 64.10 3dlb h PRO 470 Cb 1.19 -0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.18 3dlb h PRO 470 CO 0.46 0.32 -0.30 0.00 -0.23 0.00 0.00 178.00 178.25 3dlb s ALA 471 N -4.42 3.57 -0.89 -0.56 0.00 -1.26 -4.56 121.76 113.63 3dlb s ALA 471 Ca -0.04 -0.76 0.25 0.00 0.00 0.00 0.00 51.96 51.42 3dlb s ALA 471 Cb 0.15 -2.60 0.56 0.00 0.00 0.00 0.00 23.12 21.23 3dlb s ALA 471 CO 0.72 -0.45 1.46 0.39 0.00 0.00 0.00 175.76 177.88 3dlb n GLU 472 N 4.85 0.09 -3.61 0.00 1.02 -1.15 -4.70 120.64 117.14 3dlb n GLU 472 Ca -0.10 0.03 -0.20 0.00 -0.02 0.00 0.00 57.16 56.86 3dlb n GLU 472 Cb 0.51 -1.56 -0.16 0.00 -0.02 0.00 0.00 31.44 30.22 3dlb n GLU 472 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3dlb s LEU 473 N -3.37 0.07 -0.28 -4.62 2.96 -1.21 -2.91 118.68 109.32 3dlb s LEU 473 Ca 0.10 -0.12 -0.03 0.00 -0.22 0.00 0.00 54.13 53.86 3dlb s LEU 473 Cb 0.16 0.09 0.04 0.00 0.50 0.00 0.00 46.19 46.98 3dlb s LEU 473 CO 0.68 -0.30 -0.01 0.00 -1.32 0.00 0.00 176.35 175.41 3dlb s ALA 474 N 2.24 2.81 -0.09 5.97 0.00 -1.08 -0.23 121.76 131.39 3dlb s ALA 474 Ca 0.04 -1.61 0.02 0.00 0.00 0.00 0.00 51.96 50.41 3dlb s ALA 474 Cb -0.14 -1.89 -0.02 0.00 0.00 0.00 0.00 23.12 21.07 3dlb s ALA 474 CO -0.08 -1.07 -0.14 0.54 0.00 0.00 0.00 175.76 175.01 3dlb s VAL 475 N 1.32 2.98 -0.11 0.00 0.11 -0.24 -2.19 120.40 122.27 3dlb s VAL 475 Ca -0.02 -0.72 0.00 0.00 -2.93 0.00 0.00 61.98 58.31 3dlb s VAL 475 Cb -0.18 -2.20 -0.02 0.00 -1.53 0.00 0.00 36.38 32.44 3dlb s VAL 475 CO -0.02 0.56 -0.12 -0.83 -3.33 0.00 0.00 175.10 171.37 3dlb s GLY 476 N -0.19 1.58 0.07 6.54 0.00 0.38 -2.00 107.32 113.70 3dlb s GLY 476 Ca -0.00 -0.90 -0.02 0.00 0.00 0.00 0.00 44.72 43.80 3dlb s GLY 476 CO 0.03 -0.35 0.25 -1.36 0.00 0.00 0.00 173.10 171.68 3dlb s PHE 477 N -0.00 3.51 -0.04 1.90 0.40 -0.51 -1.47 117.98 121.77 3dlb s PHE 477 Ca -0.03 0.36 0.03 0.00 -0.60 0.00 0.00 56.93 56.68 3dlb s PHE 477 Cb -0.14 -1.84 0.01 0.00 0.51 0.00 0.00 43.02 41.55 3dlb s PHE 477 CO 0.04 0.56 -0.11 0.34 0.70 0.00 0.00 175.22 176.75 3dlb s ASP 478 N -2.40 1.49 -0.07 1.36 3.68 0.26 -4.60 116.67 116.39 3dlb s ASP 478 Ca 0.35 -0.24 0.10 0.00 2.13 0.00 0.00 52.55 54.90 3dlb s ASP 478 Cb -0.13 -0.52 0.15 0.00 -1.45 0.00 0.00 42.92 40.97 3dlb s ASP 478 CO 0.26 0.06 1.04 0.00 0.13 0.00 0.00 175.17 176.66 3dlb n ALA 479 N 3.50 2.07 0.00 3.66 0.00 -1.26 -0.50 120.51 127.98 3dlb n ALA 479 Ca -0.20 -1.83 0.00 0.00 0.00 0.00 0.00 53.44 51.41 3dlb n ALA 479 Cb 0.53 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.70 3dlb n ALA 479 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dlb n GLY 480 N -0.89 1.95 0.00 0.00 0.00 -1.26 -2.90 105.19 102.10 3dlb n GLY 480 Ca 0.08 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3dlb n GLY 480 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dlb n GLY 481 N 0.00 -0.77 3.83 -0.02 0.00 -1.26 -5.11 105.19 101.86 3dlb n GLY 481 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 3dlb n GLY 481 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dlb s ARG 482 N 0.00 2.97 -0.03 1.61 0.52 -1.14 -4.93 118.95 117.94 3dlb s ARG 482 Ca 0.00 0.88 0.08 0.00 -0.52 0.00 0.00 55.73 56.16 3dlb s ARG 482 Cb 0.00 -2.00 0.28 0.00 0.52 0.00 0.00 34.95 33.75 3dlb s ARG 482 CO 0.00 -1.06 1.13 0.39 0.02 0.00 0.00 175.30 175.79 3dlb n GLU 483 N -3.09 1.99 -3.48 3.54 -0.58 -1.26 -4.72 120.64 113.03 3dlb n GLU 483 Ca 0.07 -1.11 -0.13 0.00 -0.42 0.00 0.00 57.16 55.56 3dlb n GLU 483 Cb 0.54 -1.44 -0.03 0.00 -0.57 0.00 0.00 31.44 29.94 3dlb n GLU 483 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 3dlb s SER 484 N -0.75 -0.55 -0.18 1.62 0.15 -1.26 -4.11 113.70 108.63 3dlb s SER 484 Ca 0.20 0.15 0.10 0.00 0.70 0.00 0.00 55.95 57.09 3dlb s SER 484 Cb 0.12 0.56 0.58 0.00 -1.71 0.00 0.00 66.02 65.58 3dlb s SER 484 CO 0.11 -0.86 1.41 0.49 1.20 0.00 0.00 173.24 175.59 3dlb n PHE 485 N -0.01 1.53 -0.04 3.44 3.01 -1.26 -4.50 117.46 119.64 3dlb n PHE 485 Ca -0.18 -0.57 -0.09 0.00 1.01 0.00 0.00 57.45 57.63 3dlb n PHE 485 Cb 0.63 -0.42 -0.03 0.00 -0.01 0.00 0.00 39.48 39.65 3dlb n PHE 485 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3dlb h ARG 486 N 2.75 0.10 -2.14 -1.08 3.08 -1.90 -3.05 114.38 112.14 3dlb h ARG 486 Ca 0.02 -0.01 -0.49 0.00 0.07 0.00 0.00 59.98 59.57 3dlb h ARG 486 Cb 1.60 -0.02 -0.14 0.00 0.08 0.00 0.00 29.97 31.49 3dlb h ARG 486 CO 0.38 0.06 0.71 1.19 -1.07 0.00 0.00 179.97 181.25 3dlb n PHE 487 N -5.10 1.51 -1.69 3.04 3.01 -1.26 -3.73 117.46 113.25 3dlb n PHE 487 Ca -0.03 -2.05 0.12 0.00 1.01 0.00 0.00 57.45 56.50 3dlb n PHE 487 Cb 0.09 -1.53 -0.03 0.00 -0.01 0.00 0.00 39.48 38.00 3dlb n PHE 487 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dlb n GLY 488 N 1.39 -1.87 0.00 1.37 0.00 -1.15 -5.01 105.19 99.91 3dlb n GLY 488 Ca 0.51 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 45.30 3dlb n GLY 488 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dlb n GLY 489 N -2.84 2.24 3.39 -0.02 0.00 -1.26 -4.69 105.19 102.02 3dlb n GLY 489 Ca 0.01 -0.78 -0.15 0.00 0.00 0.00 0.00 46.02 45.09 3dlb n GLY 489 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dlb s ALA 490 N -1.00 -1.33 -0.01 4.61 0.00 0.35 -2.76 121.76 121.63 3dlb s ALA 490 Ca 0.00 0.80 0.02 0.00 0.00 0.00 0.00 51.96 52.79 3dlb s ALA 490 Cb 0.00 0.12 -0.00 0.00 0.00 0.00 0.00 23.12 23.24 3dlb s ALA 490 CO 0.00 -0.37 -0.08 0.00 0.00 0.00 0.00 175.76 175.31 3dlb s ALA 491 N -1.55 0.68 0.11 0.00 0.00 -0.01 0.89 121.76 121.88 3dlb s ALA 491 Ca -0.10 -0.33 0.10 0.00 0.00 0.00 0.00 51.96 51.62 3dlb s ALA 491 Cb -0.02 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.87 3dlb s ALA 491 CO 0.05 0.15 -0.22 0.00 0.00 0.00 0.00 175.76 175.74 3dlb s ALA 493 N -1.07 -1.50 -0.00 0.00 0.00 -1.26 -0.47 121.76 117.46 3dlb s ALA 493 Ca 0.16 1.86 0.04 0.00 0.00 0.00 0.00 51.96 54.01 3dlb s ALA 493 Cb -0.10 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.89 3dlb s ALA 493 CO 0.07 -0.31 -0.09 0.54 0.00 0.00 0.00 175.76 175.98 3dlb s VAL 494 N 0.91 3.48 -0.21 0.00 0.11 -0.93 0.74 120.40 124.50 3dlb s VAL 494 Ca -0.05 -0.81 0.00 0.00 -2.93 0.00 0.00 61.98 58.20 3dlb s VAL 494 Cb -0.05 -2.49 0.00 0.00 -1.53 0.00 0.00 36.38 32.31 3dlb s VAL 494 CO -0.08 0.42 0.79 0.61 -3.33 0.00 0.00 175.10 173.51 3dlb n GLY 495 N 1.67 1.68 0.00 6.54 0.00 0.16 -2.62 105.19 112.62 3dlb n GLY 495 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3dlb n GLY 495 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dlb n GLY 496 N 0.45 2.00 0.07 -0.02 0.00 -1.15 -4.57 105.19 101.98 3dlb n GLY 496 Ca 0.00 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.28 3dlb n GLY 496 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dlb n ASP 497 N 2.90 1.68 0.00 1.61 9.92 -1.26 -4.96 116.55 126.43 3dlb n ASP 497 Ca 0.00 -0.01 0.00 0.00 -0.53 0.00 0.00 54.79 54.25 3dlb n ASP 497 Cb 0.00 0.69 0.00 0.00 -0.64 0.00 0.00 41.12 41.17 3dlb n ASP 497 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3dlb n GLY 498 N 2.20 -1.85 2.72 0.44 0.00 -1.26 -2.59 105.19 104.85 3dlb n GLY 498 Ca -0.24 1.01 -0.07 0.00 0.00 0.00 0.00 46.02 46.72 3dlb n GLY 498 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dlb n GLY 499 N 0.00 -0.57 3.68 -0.02 0.00 -1.26 -4.88 105.19 102.13 3dlb n GLY 499 Ca 0.00 0.44 -0.42 0.00 0.00 0.00 0.00 46.02 46.04 3dlb n GLY 499 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3dlb s HIS 500 N 0.52 1.87 0.63 1.61 3.76 -1.26 0.35 115.29 122.77 3dlb s HIS 500 Ca 0.30 -0.15 0.00 0.00 -0.15 0.00 0.00 55.06 55.06 3dlb s HIS 500 Cb 0.21 -4.19 0.07 0.00 1.11 0.00 0.00 32.58 29.79 3dlb s HIS 500 CO -0.19 -5.06 0.87 -0.51 -0.85 0.00 0.00 174.74 169.01 3dlb s LEU 501 N 3.31 3.12 -1.11 0.89 1.43 0.23 -4.78 118.68 121.78 3dlb s LEU 501 Ca 0.83 -0.15 -0.26 0.00 -1.03 0.00 0.00 54.13 53.53 3dlb s LEU 501 Cb -0.45 -2.50 -0.20 0.00 0.03 0.00 0.00 46.19 43.08 3dlb s LEU 501 CO 0.38 -1.46 2.06 -0.11 0.23 0.00 0.00 176.35 177.45 3dlb n LEU 502 N -2.56 1.84 -4.68 1.79 -0.00 -1.26 -4.61 117.00 107.51 3dlb n LEU 502 Ca 0.11 -2.68 -0.42 0.00 -0.00 0.00 0.00 56.01 53.02 3dlb n LEU 502 Cb 0.60 -1.72 -0.03 0.00 -0.00 0.00 0.00 43.42 42.27 3dlb n LEU 502 CO 0.44 -3.13 1.39 -1.66 -0.00 0.00 0.00 177.39 174.43 3dlb s TRP 503 N 15.50 2.22 0.36 1.96 -0.00 -1.26 -4.82 118.94 132.89 3dlb s TRP 503 Ca 0.78 0.16 0.06 0.00 -0.00 0.00 0.00 56.10 57.10 3dlb s TRP 503 Cb -0.03 -4.03 0.06 0.00 -0.00 0.00 0.00 33.47 29.46 3dlb s TRP 503 CO 0.18 -4.24 0.48 0.25 -0.00 0.00 0.00 176.95 173.62 3dlb n THR 504 N 4.87 0.00 -3.51 0.66 -2.24 -0.64 -4.92 114.28 108.50 3dlb n THR 504 Ca 0.17 -1.22 -0.17 0.00 -2.27 0.00 0.00 64.05 60.56 3dlb n THR 504 Cb 0.40 -0.66 -0.05 0.00 -2.10 0.00 0.00 70.33 67.92 3dlb n THR 504 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 3dlb s LEU 505 N 0.00 -0.63 0.00 3.22 2.34 -1.26 -0.83 118.68 121.52 3dlb s LEU 505 Ca 0.37 0.60 0.00 0.00 0.06 0.00 0.00 54.13 55.16 3dlb s LEU 505 Cb -0.03 2.50 0.00 0.00 -0.56 0.00 0.00 46.19 48.10 3dlb s LEU 505 CO 0.23 -0.64 0.00 -0.81 -1.06 0.00 0.00 176.35 174.07 3dlb n PRO 506 N 0.72 0.00 0.00 1.48 -0.04 -1.11 -4.94 135.00 131.11 3dlb n PRO 506 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 3dlb n PRO 506 Cb 0.58 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.04 3dlb n PRO 506 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 3dlb n ARG 513 N 0.00 0.00 -1.98 0.54 1.85 -1.24 -4.57 116.66 111.25 3dlb n ARG 513 Ca 0.00 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.43 3dlb n ARG 513 Cb 0.00 0.00 -0.02 0.00 -1.05 0.00 0.00 32.46 31.39 3dlb n ARG 513 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 3dlb s ILE 514 N 0.00 2.63 0.21 8.89 -1.09 -1.26 -4.63 121.20 125.95 3dlb s ILE 514 Ca 0.00 0.51 -0.14 0.00 -2.23 0.00 0.00 60.65 58.79 3dlb s ILE 514 Cb 0.00 -3.33 0.24 0.00 -1.58 0.00 0.00 42.46 37.80 3dlb s ILE 514 CO 0.00 0.07 1.62 1.55 -1.23 0.00 0.00 174.94 176.95 3dlb h PRO 515 N 5.41 -0.01 -0.48 2.79 0.13 -1.85 -0.22 132.00 137.77 3dlb h PRO 515 Ca -0.45 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.68 3dlb h PRO 515 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 3dlb h PRO 515 CO 0.81 -0.01 0.32 1.96 -0.23 0.00 0.00 178.00 180.85 3dlb h GLN 516 N -0.01 0.63 0.00 0.86 4.20 -1.92 -1.71 115.11 117.16 3dlb h GLN 516 Ca 0.31 -0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.95 3dlb h GLN 516 Cb 0.49 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.12 3dlb h GLN 516 CO -0.68 0.42 -0.16 0.93 -0.67 0.00 0.00 178.83 178.67 3dlb h GLU 517 N 0.65 0.00 0.33 1.46 5.08 -1.58 -2.36 114.58 118.16 3dlb h GLU 517 Ca 0.18 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.52 3dlb h GLU 517 Cb -0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 3dlb h GLU 517 CO -0.04 0.16 -0.16 0.28 -1.00 0.00 0.00 179.01 178.25 3dlb h VAL 518 N 0.00 0.00 -0.97 3.13 2.07 -0.25 -2.84 116.25 117.40 3dlb h VAL 518 Ca -0.00 -0.31 0.31 0.00 0.82 0.00 0.00 66.70 67.52 3dlb h VAL 518 Cb 0.37 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.98 3dlb h VAL 518 CO 0.02 0.00 0.35 0.58 0.02 0.00 0.00 177.57 178.54 3dlb h VAL 519 N -0.76 0.16 -0.43 2.57 2.07 -1.25 -0.52 116.25 118.09 3dlb h VAL 519 Ca -0.05 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.37 3dlb h VAL 519 Cb 0.34 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.11 3dlb h VAL 519 CO 0.08 0.02 0.03 -0.25 0.02 0.00 0.00 177.57 177.47 3dlb h TRP 520 N 0.14 0.80 -0.18 1.57 -0.00 -1.46 -2.51 115.95 114.31 3dlb h TRP 520 Ca 0.69 -0.13 -0.00 0.00 -0.00 0.00 0.00 58.89 59.45 3dlb h TRP 520 Cb 1.58 -0.21 -0.01 0.00 -0.00 0.00 0.00 29.16 30.52 3dlb h TRP 520 CO -0.19 0.78 0.10 -0.44 -0.00 0.00 0.00 178.44 178.70 3dlb h ASP 521 N 0.58 0.22 -0.62 2.65 5.19 -0.85 0.50 116.42 124.10 3dlb h ASP 521 Ca 0.12 -0.07 0.07 0.00 -0.62 0.00 0.00 57.03 56.54 3dlb h ASP 521 Cb 0.45 -0.06 -0.10 0.00 0.18 0.00 0.00 39.33 39.80 3dlb h ASP 521 CO 0.02 0.22 -0.54 -0.07 -3.12 0.00 0.00 179.24 175.74 3dlb h LEU 522 N 0.20 -1.88 -1.61 1.55 3.38 -1.39 0.24 115.31 115.80 3dlb h LEU 522 Ca 0.06 0.27 -0.04 0.00 0.09 0.00 0.00 57.88 58.26 3dlb h LEU 522 Cb 0.05 0.81 -0.01 0.00 0.09 0.00 0.00 40.66 41.60 3dlb h LEU 522 CO -0.01 -0.34 -0.20 0.25 0.09 0.00 0.00 178.44 178.22 3dlb h LEU 523 N -0.25 0.00 -0.12 1.67 5.85 -1.14 -2.29 115.31 119.03 3dlb h LEU 523 Ca 0.12 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 3dlb h LEU 523 Cb 0.54 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 3dlb h LEU 523 CO -0.72 0.20 -0.12 -0.08 -0.34 0.00 0.00 178.44 177.38 3dlb h GLU 524 N 0.00 0.30 0.74 1.25 4.22 0.30 -1.38 114.58 120.01 3dlb h GLU 524 Ca -0.00 -0.16 -0.04 0.00 0.08 0.00 0.00 59.36 59.24 3dlb h GLU 524 Cb 0.48 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.74 3dlb h GLU 524 CO 0.03 0.70 -0.35 0.93 -2.18 0.00 0.00 179.01 178.14 3dlb h GLU 525 N -0.10 -0.95 -0.75 1.92 4.39 -0.60 -0.71 114.58 117.79 3dlb h GLU 525 Ca 0.02 0.06 0.15 0.00 0.34 0.00 0.00 59.36 59.93 3dlb h GLU 525 Cb 0.65 0.22 -0.10 0.00 -0.10 0.00 0.00 28.75 29.42 3dlb h GLU 525 CO 0.03 -0.62 0.27 1.79 -1.16 0.00 0.00 179.01 179.32 3dlb h THR 526 N -1.08 0.61 -0.93 1.13 1.35 -1.48 0.92 112.91 113.44 3dlb h THR 526 Ca -0.10 -0.13 0.05 0.00 -0.55 0.00 0.00 66.41 65.68 3dlb h THR 526 Cb 0.78 0.19 -0.06 0.00 -1.73 0.00 0.00 68.15 67.33 3dlb h THR 526 CO 0.17 0.07 0.59 -0.07 -0.25 0.00 0.00 175.52 176.03 3dlb h LEU 527 N 0.39 0.96 -1.02 3.87 3.38 -1.12 -1.20 115.31 120.57 3dlb h LEU 527 Ca 0.42 0.01 -0.10 0.00 0.09 0.00 0.00 57.88 58.29 3dlb h LEU 527 Cb 0.66 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 3dlb h LEU 527 CO -0.43 0.63 -0.43 -0.25 0.09 0.00 0.00 178.44 178.04 3dlb h TRP 528 N 1.10 0.15 -0.18 1.13 2.91 0.22 -2.35 115.95 118.93 3dlb h TRP 528 Ca 0.39 -0.04 -0.12 0.00 1.13 0.00 0.00 58.89 60.25 3dlb h TRP 528 Cb 0.11 -0.03 -0.01 0.00 -0.51 0.00 0.00 29.16 28.71 3dlb h TRP 528 CO -0.02 0.54 -0.40 0.00 -1.03 0.00 0.00 178.44 177.53 3dlb h ALA 529 N 1.46 0.98 0.00 2.65 0.00 0.87 -2.58 119.26 122.63 3dlb h ALA 529 Ca 0.01 -0.42 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 3dlb h ALA 529 Cb 0.81 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.48 3dlb h ALA 529 CO 0.06 0.62 -0.50 0.35 0.00 0.00 0.00 179.25 179.77 3dlb h PHE 530 N 0.34 0.00 0.00 0.00 3.57 -1.11 -1.28 116.94 118.46 3dlb h PHE 530 Ca 0.03 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.53 3dlb h PHE 530 Cb 0.85 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.59 3dlb h PHE 530 CO 0.03 0.50 -0.08 0.00 -2.23 0.00 0.00 178.31 176.53 3dlb h ARG 531 N 0.00 0.00 0.01 1.11 2.47 -1.19 -3.67 114.38 113.11 3dlb h ARG 531 Ca -0.01 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.71 3dlb h ARG 531 Cb 1.25 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.57 3dlb h ARG 531 CO 0.07 0.00 -0.00 0.07 0.56 0.00 0.00 179.97 180.66 3dlb h ARG 532 N 0.00 -0.01 0.04 0.04 -0.00 -1.00 -2.10 114.38 111.35 3dlb h ARG 532 Ca 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 59.98 59.98 3dlb h ARG 532 Cb 0.83 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.80 3dlb h ARG 532 CO 0.00 0.81 -0.02 1.57 -0.00 0.00 0.00 179.97 182.33 3dlb h LYS 533 N -0.90 -0.05 -0.01 0.08 2.10 -1.56 -3.31 116.57 112.93 3dlb h LYS 533 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3dlb h LYS 533 Cb 0.83 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.17 3dlb h LYS 533 CO 0.00 0.50 -0.10 0.00 -2.00 0.00 0.00 179.45 177.86 3dlb n ALA 534 N -2.43 2.77 -4.00 0.07 0.00 -1.26 -4.92 120.51 110.74 3dlb n ALA 534 Ca -0.09 -0.33 -0.30 0.00 0.00 0.00 0.00 53.44 52.72 3dlb n ALA 534 Cb 0.29 -1.27 -0.00 0.00 0.00 0.00 0.00 19.45 18.46 3dlb n ALA 534 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dlb n GLY 535 N 1.23 -0.38 0.00 0.00 0.00 -0.79 -4.89 105.19 100.35 3dlb n GLY 535 Ca 0.16 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.34 3dlb n GLY 535 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3dlb n ARG 536 N -4.46 0.00 -2.60 1.61 0.63 -1.22 -5.05 116.66 105.57 3dlb n ARG 536 Ca -0.09 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.48 3dlb n ARG 536 Cb 0.58 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.44 3dlb n ARG 536 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 3dlb s LEU 537 N 0.00 4.11 0.34 6.15 1.02 -1.26 -4.10 118.68 124.93 3dlb s LEU 537 Ca 0.00 1.96 -0.28 0.00 0.02 0.00 0.00 54.13 55.83 3dlb s LEU 537 Cb 0.00 -4.25 -0.10 0.00 0.02 0.00 0.00 46.19 41.87 3dlb s LEU 537 CO 0.00 -0.46 1.22 -2.16 0.02 0.00 0.00 176.35 174.97 3dlb s PRO 538 N -2.60 4.35 0.18 1.29 0.04 -1.26 -4.94 135.00 132.06 3dlb s PRO 538 Ca 0.58 2.02 -0.05 0.00 0.04 0.00 0.00 61.00 63.59 3dlb s PRO 538 Cb -0.20 -3.00 0.09 0.00 0.04 0.00 0.00 34.50 31.43 3dlb s PRO 538 CO 0.25 -0.12 1.51 0.66 0.04 0.00 0.00 177.00 179.33 3dlb h SER 539 N 3.30 0.72 -4.92 6.66 4.64 -1.94 -3.45 113.55 118.55 3dlb h SER 539 Ca -0.48 -0.36 -0.17 0.00 -0.47 0.00 0.00 61.79 60.31 3dlb h SER 539 Cb 1.22 -0.20 -0.21 0.00 -0.31 0.00 0.00 62.40 62.90 3dlb h SER 539 CO 0.65 1.09 -0.67 -0.60 -0.87 0.00 0.00 176.83 176.43 3dlb s ARG 540 N -4.13 0.32 0.05 4.77 3.52 -1.26 -1.76 118.95 120.47 3dlb s ARG 540 Ca -0.08 -0.55 0.05 0.00 -0.13 0.00 0.00 55.73 55.02 3dlb s ARG 540 Cb 0.11 0.12 -0.02 0.00 -1.56 0.00 0.00 34.95 33.60 3dlb s ARG 540 CO 0.85 -0.06 -0.13 0.08 -0.81 0.00 0.00 175.30 175.23 3dlb s VAL 541 N -1.38 1.03 -0.15 7.11 1.01 -0.81 -2.95 120.40 124.26 3dlb s VAL 541 Ca -0.15 -1.13 0.01 0.00 0.00 0.00 0.00 61.98 60.70 3dlb s VAL 541 Cb -0.09 -0.97 -0.00 0.00 0.00 0.00 0.00 36.38 35.31 3dlb s VAL 541 CO -0.01 -0.15 -0.16 -0.22 0.00 0.00 0.00 175.10 174.57 3dlb s LEU 542 N -1.44 2.44 -0.13 3.92 2.96 0.68 -2.27 118.68 124.83 3dlb s LEU 542 Ca -0.01 -0.47 -0.01 0.00 -0.22 0.00 0.00 54.13 53.41 3dlb s LEU 542 Cb -0.09 -1.55 -0.02 0.00 0.50 0.00 0.00 46.19 45.03 3dlb s LEU 542 CO 0.02 0.09 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.27 3dlb s LEU 543 N 0.75 2.84 -0.05 -0.68 1.43 -0.83 -1.08 118.68 121.05 3dlb s LEU 543 Ca -0.07 -0.28 0.06 0.00 -1.03 0.00 0.00 54.13 52.81 3dlb s LEU 543 Cb -0.15 -1.65 -0.01 0.00 0.03 0.00 0.00 46.19 44.40 3dlb s LEU 543 CO 0.01 0.17 -0.24 -0.76 0.23 0.00 0.00 176.35 175.75 3dlb s LEU 544 N 0.34 2.05 0.20 1.79 1.43 -0.85 -1.64 118.68 122.00 3dlb s LEU 544 Ca -0.09 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.40 3dlb s LEU 544 Cb -0.15 -1.32 -0.00 0.00 0.03 0.00 0.00 46.19 44.74 3dlb s LEU 544 CO 0.05 0.24 0.38 0.00 0.23 0.00 0.00 176.35 177.25 3dlb s ARG 545 N -0.17 1.32 0.02 1.70 1.70 -1.04 -1.43 118.95 121.06 3dlb s ARG 545 Ca -0.03 -1.17 -0.22 0.00 -0.47 0.00 0.00 55.73 53.84 3dlb s ARG 545 Cb -0.13 0.43 -0.05 0.00 -0.57 0.00 0.00 34.95 34.62 3dlb s ARG 545 CO 0.03 -0.52 0.67 0.34 -1.08 0.00 0.00 175.30 174.74 3dlb s ASP 546 N -2.98 7.08 0.44 -2.89 -1.08 -1.26 -0.23 116.67 115.75 3dlb s ASP 546 Ca 0.19 1.29 0.30 0.00 -0.52 0.00 0.00 52.55 53.81 3dlb s ASP 546 Cb 0.01 -2.41 1.55 0.00 -1.46 0.00 0.00 42.92 40.61 3dlb s ASP 546 CO 0.03 0.07 1.92 1.23 0.52 0.00 0.00 175.17 178.94 3dlb h GLY 547 N 5.64 0.00 2.00 2.66 0.00 -1.36 -2.32 103.07 109.69 3dlb h GLY 547 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3dlb h GLY 547 CO 0.70 0.00 0.00 3.21 0.00 0.00 0.00 176.54 180.45 3dlb h ARG 548 N 0.00 0.00 -5.10 4.80 3.08 -1.93 -3.40 114.38 111.84 3dlb h ARG 548 Ca 0.00 0.00 -0.63 0.00 0.07 0.00 0.00 59.98 59.42 3dlb h ARG 548 Cb 0.12 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 29.99 3dlb h ARG 548 CO 0.00 0.00 -0.57 0.14 -1.07 0.00 0.00 179.97 178.47 3dlb s VAL 549 N -3.82 4.78 0.05 2.04 -7.23 -0.87 -4.53 120.40 110.82 3dlb s VAL 549 Ca -0.03 -0.02 -0.38 0.00 -1.81 0.00 0.00 61.98 59.74 3dlb s VAL 549 Cb 0.10 -3.21 -0.18 0.00 0.56 0.00 0.00 36.38 33.65 3dlb s VAL 549 CO 0.34 0.38 1.26 -2.65 -0.31 0.00 0.00 175.10 174.12 3dlb n PRO 550 N 4.29 0.76 0.33 4.82 -0.02 -1.26 -4.81 135.00 139.11 3dlb n PRO 550 Ca -0.16 0.27 0.19 0.00 -2.02 0.00 0.00 63.50 61.79 3dlb n PRO 550 Cb 0.52 -1.87 1.04 0.00 -0.02 0.00 0.00 33.50 33.17 3dlb n PRO 550 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3dlb h GLN 551 N 4.09 0.00 0.00 -0.52 4.15 -1.94 -2.43 115.11 118.46 3dlb h GLN 551 Ca -0.49 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 58.85 3dlb h GLN 551 Cb 1.37 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.04 3dlb h GLN 551 CO 0.74 0.00 -0.40 -0.44 -1.93 0.00 0.00 178.83 176.80 3dlb h ASP 552 N 0.00 0.00 0.00 -0.69 5.19 -2.03 -2.90 116.42 115.99 3dlb h ASP 552 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 3dlb h ASP 552 Cb 0.29 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.80 3dlb h ASP 552 CO 0.00 0.40 0.04 -0.62 -3.12 0.00 0.00 179.24 175.94 3dlb n GLU 553 N -3.71 0.01 0.00 3.56 1.02 -0.91 -0.37 120.64 120.23 3dlb n GLU 553 Ca -0.01 0.47 0.11 0.00 -0.02 0.00 0.00 57.16 57.72 3dlb n GLU 553 Cb 0.48 -1.56 0.05 0.00 -0.02 0.00 0.00 31.44 30.39 3dlb n GLU 553 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3dlb n PHE 554 N -1.51 0.00 -0.28 -0.32 3.01 -1.09 -4.12 117.46 113.15 3dlb n PHE 554 Ca -0.00 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.52 3dlb n PHE 554 Cb 0.04 -0.03 0.17 0.00 -0.01 0.00 0.00 39.48 39.65 3dlb n PHE 554 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3dlb h ALA 555 N 3.69 0.79 -0.32 4.37 0.00 -0.87 -0.98 119.26 125.94 3dlb h ALA 555 Ca 0.00 0.27 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 3dlb h ALA 555 Cb 0.67 0.49 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 3dlb h ALA 555 CO 0.00 -0.44 -0.29 1.25 0.00 0.00 0.00 179.25 179.77 3dlb h LEU 556 N 0.07 0.81 -0.48 0.00 6.46 -1.80 -1.74 115.31 118.63 3dlb h LEU 556 Ca 0.44 -0.46 0.01 0.00 -0.12 0.00 0.00 57.88 57.75 3dlb h LEU 556 Cb 0.78 -0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 40.45 3dlb h LEU 556 CO -0.74 1.10 0.30 0.00 -0.62 0.00 0.00 178.44 178.48 3dlb h ALA 557 N 0.73 0.60 -0.66 1.25 0.00 -1.60 0.10 119.26 119.68 3dlb h ALA 557 Ca 0.05 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 3dlb h ALA 557 Cb 0.86 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.46 3dlb h ALA 557 CO 0.07 0.01 0.15 -0.07 0.00 0.00 0.00 179.25 179.41 3dlb h LEU 558 N 0.60 1.00 -1.03 0.00 3.38 -1.15 0.20 115.31 118.32 3dlb h LEU 558 Ca 0.18 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 3dlb h LEU 558 Cb -0.03 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 3dlb h LEU 558 CO -0.06 0.97 -0.10 -0.08 0.09 0.00 0.00 178.44 179.26 3dlb h GLU 559 N 1.01 0.58 -0.18 1.13 4.81 -0.78 -1.27 114.58 119.88 3dlb h GLU 559 Ca 0.21 -0.17 -0.08 0.00 -0.13 0.00 0.00 59.36 59.19 3dlb h GLU 559 Cb 0.37 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 3dlb h GLU 559 CO 0.00 0.68 -0.21 0.00 -0.73 0.00 0.00 179.01 178.75 3dlb h ALA 560 N 1.36 0.26 -0.96 2.92 0.00 -0.23 -2.57 119.26 120.03 3dlb h ALA 560 Ca 0.10 -0.36 0.06 0.00 0.00 0.00 0.00 54.91 54.71 3dlb h ALA 560 Cb 0.50 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 3dlb h ALA 560 CO 0.03 0.20 0.63 -0.07 0.00 0.00 0.00 179.25 180.04 3dlb h LEU 561 N 0.10 0.99 -0.66 0.00 3.38 -0.25 -2.52 115.31 116.35 3dlb h LEU 561 Ca 0.02 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 3dlb h LEU 561 Cb 0.76 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 3dlb h LEU 561 CO 0.05 0.64 0.31 0.00 0.09 0.00 0.00 178.44 179.52 3dlb h ALA 562 N 1.48 0.85 0.00 1.53 0.00 -1.05 -1.59 119.26 120.47 3dlb h ALA 562 Ca 0.41 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 3dlb h ALA 562 Cb 0.17 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3dlb h ALA 562 CO -0.16 0.43 -0.01 0.00 0.00 0.00 0.00 179.25 179.51 3dlb h ARG 563 N 0.92 0.00 0.00 0.00 3.08 -1.05 -1.27 114.38 116.06 3dlb h ARG 563 Ca 0.23 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.21 3dlb h ARG 563 Cb 0.14 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 3dlb h ARG 563 CO -0.03 0.01 -0.94 0.93 -1.07 0.00 0.00 179.97 178.87 3dlb h GLU 564 N 0.00 0.00 0.00 0.04 4.39 -1.27 -3.48 114.58 114.26 3dlb h GLU 564 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3dlb h GLU 564 Cb 0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 3dlb h GLU 564 CO 0.00 0.15 0.00 0.41 -1.16 0.00 0.00 179.01 178.41 3dlb n GLY 565 N 1.24 0.76 3.58 -3.84 0.00 -0.48 -5.01 105.19 101.44 3dlb n GLY 565 Ca -0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3dlb n GLY 565 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dlb s ILE 566 N -2.31 3.83 0.91 -0.61 -1.09 -0.81 -4.99 121.20 116.13 3dlb s ILE 566 Ca 0.00 0.76 -0.10 0.00 -2.23 0.00 0.00 60.65 59.08 3dlb s ILE 566 Cb 0.00 -4.36 0.15 0.00 -1.58 0.00 0.00 42.46 36.67 3dlb s ILE 566 CO 0.00 -1.03 1.13 0.00 -1.23 0.00 0.00 174.94 173.81 3dlb s ALA 567 N 5.87 1.43 0.24 9.38 0.00 -0.72 -4.44 121.76 133.52 3dlb s ALA 567 Ca 0.55 0.50 -0.21 0.00 0.00 0.00 0.00 51.96 52.80 3dlb s ALA 567 Cb -0.12 -3.41 0.03 0.00 0.00 0.00 0.00 23.12 19.63 3dlb s ALA 567 CO 0.28 -2.72 0.68 1.52 0.00 0.00 0.00 175.76 175.51 3dlb s TYR 568 N -2.67 -0.27 -0.03 0.00 1.13 -1.26 -1.92 117.35 112.33 3dlb s TYR 568 Ca 0.66 -0.11 -0.00 0.00 -1.41 0.00 0.00 57.07 56.21 3dlb s TYR 568 Cb -0.22 0.65 0.03 0.00 -1.10 0.00 0.00 41.96 41.32 3dlb s TYR 568 CO 0.58 -1.12 0.02 -0.51 -2.51 0.00 0.00 175.55 172.01 3dlb s ASP 569 N -2.87 0.45 -0.24 -0.18 1.01 -0.96 -3.84 116.67 110.03 3dlb s ASP 569 Ca 0.08 0.00 -0.08 0.00 0.71 0.00 0.00 52.55 53.27 3dlb s ASP 569 Cb -0.04 -0.18 -0.04 0.00 1.01 0.00 0.00 42.92 43.67 3dlb s ASP 569 CO 0.01 -0.13 0.09 -0.22 0.21 0.00 0.00 175.17 175.13 3dlb s LEU 570 N 1.20 3.62 -0.10 1.23 2.96 0.93 -1.97 118.68 126.55 3dlb s LEU 570 Ca -0.07 -0.11 0.02 0.00 -0.22 0.00 0.00 54.13 53.75 3dlb s LEU 570 Cb -0.13 -1.96 0.01 0.00 0.50 0.00 0.00 46.19 44.61 3dlb s LEU 570 CO -0.02 0.01 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.17 3dlb s VAL 571 N 1.34 1.53 0.19 1.68 1.01 -0.65 -0.91 120.40 124.59 3dlb s VAL 571 Ca 0.05 -0.68 -0.14 0.00 0.00 0.00 0.00 61.98 61.21 3dlb s VAL 571 Cb -0.15 -1.38 -0.07 0.00 0.00 0.00 0.00 36.38 34.78 3dlb s VAL 571 CO 0.04 0.45 0.59 -0.44 0.00 0.00 0.00 175.10 175.74 3dlb s SER 572 N 0.83 6.83 0.19 3.32 0.01 0.30 -2.49 113.70 122.69 3dlb s SER 572 Ca -0.10 1.12 0.09 0.00 1.31 0.00 0.00 55.95 58.37 3dlb s SER 572 Cb -0.16 -2.31 -0.04 0.00 0.21 0.00 0.00 66.02 63.72 3dlb s SER 572 CO 0.01 0.04 -0.17 -0.69 0.41 0.00 0.00 173.24 172.84 3dlb s VAL 573 N -1.57 1.88 -0.30 3.43 1.01 0.68 -1.86 120.40 123.66 3dlb s VAL 573 Ca 0.42 -2.09 -0.10 0.00 0.00 0.00 0.00 61.98 60.20 3dlb s VAL 573 Cb -0.14 -1.98 0.17 0.00 0.00 0.00 0.00 36.38 34.43 3dlb s VAL 573 CO 0.20 -0.43 0.90 -0.60 0.00 0.00 0.00 175.10 175.17 3dlb s ARG 574 N -3.20 0.33 0.00 2.72 3.00 -1.05 -0.90 118.95 119.85 3dlb s ARG 574 Ca 0.20 0.66 0.00 0.00 -1.00 0.00 0.00 55.73 55.59 3dlb s ARG 574 Cb -0.04 0.38 0.00 0.00 0.00 0.00 0.00 34.95 35.29 3dlb s ARG 574 CO 0.08 -0.28 0.48 1.63 0.00 0.00 0.00 175.30 177.21 3dlb n LYS 575 N 5.33 0.00 -2.62 5.12 4.76 -1.26 -1.81 118.16 127.67 3dlb n LYS 575 Ca -0.06 0.24 -0.36 0.00 -2.87 0.00 0.00 58.31 55.26 3dlb n LYS 575 Cb 0.52 -1.07 -0.05 0.00 -1.84 0.00 0.00 35.03 32.60 3dlb n LYS 575 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 3dlb s SER 576 N -1.99 6.91 0.00 4.39 0.01 -1.26 -3.83 113.70 117.93 3dlb s SER 576 Ca 0.00 1.96 0.00 0.00 1.31 0.00 0.00 55.95 59.22 3dlb s SER 576 Cb 0.00 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.65 3dlb s SER 576 CO 0.00 -0.38 0.00 0.61 0.41 0.00 0.00 173.24 173.88 3dlb n GLY 577 N 0.31 0.79 0.20 3.44 0.00 -1.26 -4.97 105.19 103.69 3dlb n GLY 577 Ca 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.99 3dlb n GLY 577 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dlb h GLY 578 N 0.00 0.50 0.00 -0.02 0.00 -1.79 -3.48 103.07 98.29 3dlb h GLY 578 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.75 3dlb h GLY 578 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 176.54 177.67 3dlb n GLY 579 N 0.23 0.45 3.35 4.60 0.00 -1.26 -4.93 105.19 107.63 3dlb n GLY 579 Ca -0.03 -1.52 -0.14 0.00 0.00 0.00 0.00 46.02 44.32 3dlb n GLY 579 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dlb s ARG 580 N 0.00 0.87 -0.08 1.61 1.81 -1.26 -4.64 118.95 117.26 3dlb s ARG 580 Ca 0.00 -0.13 0.01 0.00 -1.72 0.00 0.00 55.73 53.89 3dlb s ARG 580 Cb 0.00 0.40 0.02 0.00 -0.45 0.00 0.00 34.95 34.92 3dlb s ARG 580 CO 0.00 -0.28 -0.10 0.08 -0.68 0.00 0.00 175.30 174.33 3dlb s VAL 581 N -1.71 1.02 0.05 3.52 1.01 -1.26 -2.63 120.40 120.40 3dlb s VAL 581 Ca -0.10 -0.36 0.07 0.00 0.00 0.00 0.00 61.98 61.59 3dlb s VAL 581 Cb -0.02 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 3dlb s VAL 581 CO 0.03 0.34 -0.20 -0.31 0.00 0.00 0.00 175.10 174.97 3dlb s TYR 582 N 1.08 1.72 0.52 5.22 2.02 0.24 -4.90 117.35 123.24 3dlb s TYR 582 Ca -0.07 -0.38 -0.17 0.00 -0.37 0.00 0.00 57.07 56.08 3dlb s TYR 582 Cb -0.14 -1.01 -0.08 0.00 -0.40 0.00 0.00 41.96 40.33 3dlb s TYR 582 CO -0.01 0.10 0.99 -1.25 -1.57 0.00 0.00 175.55 173.81 3dlb s PRO 583 N -1.28 3.88 0.05 -1.71 0.04 -1.26 0.46 135.00 135.19 3dlb s PRO 583 Ca 0.06 1.01 -0.34 0.00 0.04 0.00 0.00 61.00 61.77 3dlb s PRO 583 Cb -0.09 -2.12 -0.19 0.00 0.04 0.00 0.00 34.50 32.14 3dlb s PRO 583 CO 0.02 -0.33 1.49 0.28 0.04 0.00 0.00 177.00 178.50 3dlb h VAL 584 N 0.94 0.13 0.00 -0.36 2.07 -1.92 -3.44 116.25 113.67 3dlb h VAL 584 Ca -0.47 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 66.97 3dlb h VAL 584 Cb 1.19 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 3dlb h VAL 584 CO 0.61 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.20 3dlb n GLN 585 N -5.55 0.00 0.00 1.57 1.13 -1.26 -5.08 117.38 108.19 3dlb n GLN 585 Ca -0.15 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.91 3dlb n GLN 585 Cb 0.45 -0.41 0.00 0.00 0.11 0.00 0.00 30.24 30.39 3dlb n GLN 585 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dlb n GLY 586 N 0.58 0.22 3.13 1.08 0.00 -1.26 -5.10 105.19 103.84 3dlb n GLY 586 Ca 0.00 -0.07 -0.12 0.00 0.00 0.00 0.00 46.02 45.84 3dlb n GLY 586 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3dlb s ARG 587 N 0.00 0.51 0.17 1.61 1.70 -1.26 -4.93 118.95 116.75 3dlb s ARG 587 Ca 0.00 -0.35 -0.30 0.00 -0.47 0.00 0.00 55.73 54.61 3dlb s ARG 587 Cb 0.00 0.22 -0.08 0.00 -0.57 0.00 0.00 34.95 34.52 3dlb s ARG 587 CO 0.00 -0.12 1.13 -0.51 -1.08 0.00 0.00 175.30 174.71 3dlb s LEU 588 N -1.34 4.47 1.08 -1.89 1.43 -1.26 -5.03 118.68 116.14 3dlb s LEU 588 Ca -0.14 2.12 -0.14 0.00 -1.03 0.00 0.00 54.13 54.94 3dlb s LEU 588 Cb -0.07 -3.60 0.23 0.00 0.03 0.00 0.00 46.19 42.78 3dlb s LEU 588 CO 0.02 -0.27 1.08 0.00 0.23 0.00 0.00 176.35 177.41 3dlb s ALA 589 N -0.13 0.49 0.13 4.21 0.00 -1.26 -4.97 121.76 120.23 3dlb s ALA 589 Ca 0.51 -0.42 -0.19 0.00 0.00 0.00 0.00 51.96 51.86 3dlb s ALA 589 Cb -0.30 -3.11 -0.01 0.00 0.00 0.00 0.00 23.12 19.70 3dlb s ALA 589 CO 0.35 -3.24 1.75 -0.44 0.00 0.00 0.00 175.76 174.18 3dlb h ASP 590 N -2.21 0.07 -3.24 0.00 5.19 -1.94 -3.41 116.42 110.89 3dlb h ASP 590 Ca -0.55 0.03 -0.50 0.00 -0.62 0.00 0.00 57.03 55.39 3dlb h ASP 590 Cb 1.33 0.02 -0.37 0.00 0.18 0.00 0.00 39.33 40.50 3dlb h ASP 590 CO 0.53 0.08 -0.79 -0.83 -3.12 0.00 0.00 179.24 175.11 3dlb s GLY 591 N -2.55 0.71 0.13 2.75 0.00 -1.26 0.99 107.32 108.09 3dlb s GLY 591 Ca -0.13 -0.40 0.09 0.00 0.00 0.00 0.00 44.72 44.28 3dlb s GLY 591 CO 0.70 0.79 -0.21 1.08 0.00 0.00 0.00 173.10 175.46 3dlb s LEU 592 N 1.61 2.36 -0.29 0.66 1.02 0.96 -1.84 118.68 123.17 3dlb s LEU 592 Ca 0.02 -0.76 0.02 0.00 0.02 0.00 0.00 54.13 53.42 3dlb s LEU 592 Cb -0.13 -0.92 0.08 0.00 0.02 0.00 0.00 46.19 45.24 3dlb s LEU 592 CO -0.06 0.05 0.00 -0.47 0.02 0.00 0.00 176.35 175.89 3dlb s TYR 593 N -1.48 2.79 -0.41 0.29 5.04 -0.43 -1.34 117.35 121.81 3dlb s TYR 593 Ca 0.11 -2.21 -0.09 0.00 -2.44 0.00 0.00 57.07 52.44 3dlb s TYR 593 Cb -0.08 -2.07 0.07 0.00 0.35 0.00 0.00 41.96 40.22 3dlb s TYR 593 CO 0.06 -0.86 0.25 0.08 -1.34 0.00 0.00 175.55 173.73 3dlb s VAL 594 N 1.25 4.24 0.65 3.14 1.01 -0.63 -0.92 120.40 129.14 3dlb s VAL 594 Ca 0.02 -1.34 -0.17 0.00 0.00 0.00 0.00 61.98 60.49 3dlb s VAL 594 Cb -0.19 -3.57 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 3dlb s VAL 594 CO -0.10 -0.47 1.18 -2.84 0.00 0.00 0.00 175.10 172.86 3dlb s PRO 595 N 1.44 2.72 0.00 2.72 0.02 -1.26 -0.02 135.00 140.61 3dlb s PRO 595 Ca 0.03 1.69 0.00 0.00 0.02 0.00 0.00 61.00 62.73 3dlb s PRO 595 Cb -0.23 -1.91 0.00 0.00 0.02 0.00 0.00 34.50 32.38 3dlb s PRO 595 CO 0.02 -1.37 0.00 1.28 -0.33 0.00 0.00 177.00 176.60 3dlb n LEU 596 N -2.10 0.00 -4.57 -5.54 4.77 0.33 -4.83 117.00 105.06 3dlb n LEU 596 Ca 0.13 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.69 3dlb n LEU 596 Cb 0.50 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.57 3dlb n LEU 596 CO 0.46 0.00 1.26 -1.83 -1.33 0.00 0.00 177.39 175.95 3dlb s GLU 597 N 1.98 3.25 -0.16 3.23 1.03 -1.26 -4.61 118.70 122.15 3dlb s GLU 597 Ca 0.00 0.35 -0.03 0.00 0.03 0.00 0.00 54.97 55.32 3dlb s GLU 597 Cb 0.00 -4.15 0.01 0.00 -0.80 0.00 0.00 34.13 29.20 3dlb s GLU 597 CO 0.00 -2.01 0.06 -3.47 -1.33 0.00 0.00 175.26 168.51 3dlb n ASP 598 N 9.71 -5.77 -1.68 0.83 2.03 -1.26 -3.91 116.55 116.49 3dlb n ASP 598 Ca 0.11 1.11 -0.19 0.00 0.52 0.00 0.00 54.79 56.34 3dlb n ASP 598 Cb 0.49 -3.91 -0.07 0.00 -0.72 0.00 0.00 41.12 36.91 3dlb n ASP 598 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 3dlb n LYS 599 N 1.36 -1.48 -4.79 -0.67 4.76 -1.26 -4.93 118.16 111.16 3dlb n LYS 599 Ca -0.11 1.10 -0.29 0.00 -2.87 0.00 0.00 58.31 56.15 3dlb n LYS 599 Cb 0.28 -5.50 -0.14 0.00 -1.84 0.00 0.00 35.03 27.82 3dlb n LYS 599 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 3dlb s THR 600 N -2.68 2.04 0.08 -0.18 2.01 -1.25 -1.46 115.64 114.20 3dlb s THR 600 Ca 0.00 -1.39 -0.24 0.00 0.31 0.00 0.00 61.69 60.37 3dlb s THR 600 Cb 0.00 -1.76 0.06 0.00 0.01 0.00 0.00 72.50 70.82 3dlb s THR 600 CO 0.00 0.30 0.59 0.72 -0.69 0.00 0.00 174.62 175.53 3dlb s PHE 601 N -0.84 -0.52 0.21 4.92 -0.71 -0.65 -0.51 117.98 119.89 3dlb s PHE 601 Ca 0.11 0.53 0.01 0.00 -1.04 0.00 0.00 56.93 56.55 3dlb s PHE 601 Cb -0.10 0.45 -0.04 0.00 -1.21 0.00 0.00 43.02 42.13 3dlb s PHE 601 CO 0.02 -0.73 0.38 -0.51 -1.34 0.00 0.00 175.22 173.04 3dlb s LEU 602 N -2.18 4.25 -0.07 -1.99 1.43 0.98 -1.48 118.68 119.61 3dlb s LEU 602 Ca -0.03 0.28 0.00 0.00 -1.03 0.00 0.00 54.13 53.34 3dlb s LEU 602 Cb -0.01 -3.06 0.02 0.00 0.03 0.00 0.00 46.19 43.18 3dlb s LEU 602 CO -0.05 -0.06 -0.04 -0.22 0.23 0.00 0.00 176.35 176.21 3dlb s LEU 603 N -3.57 1.08 -0.07 1.79 2.96 -0.68 -1.60 118.68 118.60 3dlb s LEU 603 Ca 0.37 -0.17 0.04 0.00 -0.22 0.00 0.00 54.13 54.14 3dlb s LEU 603 Cb -0.10 -0.58 0.00 0.00 0.50 0.00 0.00 46.19 46.01 3dlb s LEU 603 CO 0.30 -0.11 -0.17 -0.22 -1.32 0.00 0.00 176.35 174.83 3dlb s LEU 604 N 1.44 1.86 -0.02 -0.68 2.96 -0.45 -1.44 118.68 122.36 3dlb s LEU 604 Ca -0.02 -0.39 0.03 0.00 -0.22 0.00 0.00 54.13 53.53 3dlb s LEU 604 Cb -0.13 -1.04 -0.00 0.00 0.50 0.00 0.00 46.19 45.51 3dlb s LEU 604 CO -0.03 0.11 -0.09 0.28 -1.32 0.00 0.00 176.35 175.30 3dlb s THR 605 N 0.34 0.75 0.00 3.68 -1.32 -1.25 -0.03 115.64 117.81 3dlb s THR 605 Ca -0.12 -0.38 0.00 0.00 -1.21 0.00 0.00 61.69 59.99 3dlb s THR 605 Cb -0.15 -0.65 0.00 0.00 -1.51 0.00 0.00 72.50 70.20 3dlb s THR 605 CO 0.05 0.22 0.00 0.55 -2.21 0.00 0.00 174.62 173.23 3dlb n VAL 606 N 3.05 0.00 -1.85 5.08 3.14 0.28 -4.96 118.33 123.07 3dlb n VAL 606 Ca -0.16 0.00 -0.40 0.00 -2.96 0.00 0.00 64.34 60.82 3dlb n VAL 606 Cb 0.56 0.00 0.01 0.00 -1.06 0.00 0.00 33.84 33.34 3dlb n VAL 606 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 3dlb s THR 613 N 0.00 2.17 0.50 1.55 -4.23 -1.26 -4.99 115.64 109.37 3dlb s THR 613 Ca 0.00 0.16 -0.02 0.00 -1.18 0.00 0.00 61.69 60.64 3dlb s THR 613 Cb 0.00 -3.10 -0.00 0.00 1.34 0.00 0.00 72.50 70.74 3dlb s THR 613 CO 0.00 0.03 0.76 -2.16 -0.54 0.00 0.00 174.62 172.71 3dlb s PRO 614 N -2.26 3.08 -0.25 3.99 0.04 -1.26 -5.07 135.00 133.26 3dlb s PRO 614 Ca 0.57 -0.24 -0.06 0.00 0.04 0.00 0.00 61.00 61.30 3dlb s PRO 614 Cb -0.44 -2.44 -0.01 0.00 0.04 0.00 0.00 34.50 31.65 3dlb s PRO 614 CO 0.58 -0.40 0.04 0.50 0.04 0.00 0.00 177.00 177.75 3dlb s ARG 615 N -4.72 3.42 0.76 4.56 6.06 -1.26 -4.77 118.95 122.99 3dlb s ARG 615 Ca 0.50 -0.63 -0.11 0.00 -2.50 0.00 0.00 55.73 52.99 3dlb s ARG 615 Cb -0.10 -3.24 0.05 0.00 0.06 0.00 0.00 34.95 31.71 3dlb s ARG 615 CO 0.41 -0.26 1.10 -2.14 -2.50 0.00 0.00 175.30 171.91 3dlb s PRO 616 N 1.54 2.42 -0.23 5.12 0.02 -1.26 -4.83 135.00 137.78 3dlb s PRO 616 Ca 0.05 0.56 -0.05 0.00 0.02 0.00 0.00 61.00 61.58 3dlb s PRO 616 Cb -0.15 -1.96 -0.02 0.00 0.02 0.00 0.00 34.50 32.39 3dlb s PRO 616 CO 0.01 -1.37 -0.00 -0.51 -0.33 0.00 0.00 177.00 174.80 3dlb s LEU 617 N -5.60 3.10 -0.06 -5.54 1.43 -0.52 -4.48 118.68 107.01 3dlb s LEU 617 Ca 0.60 -0.32 -0.20 0.00 -1.03 0.00 0.00 54.13 53.17 3dlb s LEU 617 Cb -0.13 -1.81 -0.05 0.00 0.03 0.00 0.00 46.19 44.24 3dlb s LEU 617 CO 0.53 -0.02 0.58 -0.75 0.23 0.00 0.00 176.35 176.92 3dlb s LYS 618 N 1.51 4.35 0.05 1.70 2.20 -0.75 -1.68 119.74 127.12 3dlb s LYS 618 Ca 0.06 0.68 0.05 0.00 -0.36 0.00 0.00 55.97 56.40 3dlb s LYS 618 Cb -0.15 -3.40 -0.02 0.00 -1.51 0.00 0.00 37.83 32.75 3dlb s LYS 618 CO -0.01 0.22 -0.15 -0.51 -0.36 0.00 0.00 175.35 174.55 3dlb s LEU 619 N 0.33 2.20 -0.06 5.43 1.02 -0.55 -2.52 118.68 124.53 3dlb s LEU 619 Ca 0.31 -0.51 0.01 0.00 0.02 0.00 0.00 54.13 53.96 3dlb s LEU 619 Cb -0.17 -0.62 0.02 0.00 0.02 0.00 0.00 46.19 45.44 3dlb s LEU 619 CO 0.15 0.02 -0.07 -0.69 0.02 0.00 0.00 176.35 175.78 3dlb s VAL 620 N -0.96 0.77 -0.90 -1.59 1.01 -0.77 -1.63 120.40 116.32 3dlb s VAL 620 Ca 0.01 -0.24 -0.18 0.00 0.00 0.00 0.00 61.98 61.58 3dlb s VAL 620 Cb -0.08 -0.77 0.14 0.00 0.00 0.00 0.00 36.38 35.67 3dlb s VAL 620 CO 0.02 0.29 1.06 -2.28 0.00 0.00 0.00 175.10 174.18 3dlb s HIS 621 N 1.00 3.21 -0.48 5.22 2.46 -0.53 -0.54 115.29 125.63 3dlb s HIS 621 Ca -0.09 -1.46 0.24 0.00 0.47 0.00 0.00 55.06 54.21 3dlb s HIS 621 Cb -0.14 -4.21 0.44 0.00 -0.13 0.00 0.00 32.58 28.54 3dlb s HIS 621 CO -0.00 -1.41 1.64 0.93 -2.47 0.00 0.00 174.74 173.43 3dlb h GLU 622 N 8.69 0.00 -1.92 2.88 5.08 -1.33 -3.47 114.58 124.50 3dlb h GLU 622 Ca 0.13 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.46 3dlb h GLU 622 Cb 1.03 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 30.08 3dlb h GLU 622 CO 1.05 0.00 0.25 0.00 -1.00 0.00 0.00 179.01 179.31 3dlb s ALA 623 N -3.20 -1.80 0.00 3.43 0.00 -1.16 -4.91 121.76 114.12 3dlb s ALA 623 Ca 0.08 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.42 3dlb s ALA 623 Cb 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.02 3dlb s ALA 623 CO 0.65 -0.36 0.00 0.41 0.00 0.00 0.00 175.76 176.47 3dlb n GLY 624 N 0.94 3.36 2.41 0.00 0.00 -1.25 -0.05 105.19 110.60 3dlb n GLY 624 Ca -0.17 -1.78 -0.32 0.00 0.00 0.00 0.00 46.02 43.74 3dlb n GLY 624 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3dlb n ASP 625 N 0.00 6.44 -4.19 1.61 4.64 -1.26 -4.98 116.55 118.81 3dlb n ASP 625 Ca 0.00 -3.78 -0.30 0.00 -1.38 0.00 0.00 54.79 49.33 3dlb n ASP 625 Cb 0.00 -0.75 -0.17 0.00 -1.04 0.00 0.00 41.12 39.17 3dlb n ASP 625 CO 0.00 0.00 0.00 -0.89 -0.82 0.00 0.00 177.20 175.49 3dlb s THR 626 N -4.95 1.86 0.38 5.18 2.01 -1.26 -5.12 115.64 113.73 3dlb s THR 626 Ca 0.55 -0.92 -0.26 0.00 0.31 0.00 0.00 61.69 61.38 3dlb s THR 626 Cb 0.45 -1.61 -0.11 0.00 0.01 0.00 0.00 72.50 71.24 3dlb s THR 626 CO -0.12 0.52 1.13 -2.65 -0.69 0.00 0.00 174.62 172.80 3dlb n PRO 627 N 3.42 1.65 0.01 4.92 -0.02 -1.26 -4.84 135.00 138.88 3dlb n PRO 627 Ca -0.19 0.59 0.04 0.00 -2.02 0.00 0.00 63.50 61.91 3dlb n PRO 627 Cb 0.53 -2.14 0.43 0.00 -0.02 0.00 0.00 33.50 32.29 3dlb n PRO 627 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3dlb h LEU 628 N 1.97 0.46 -0.21 2.45 3.38 -2.00 -2.51 115.31 118.85 3dlb h LEU 628 Ca -0.45 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 3dlb h LEU 628 Cb 1.32 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 3dlb h LEU 628 CO 0.59 0.34 0.06 -0.33 0.09 0.00 0.00 178.44 179.19 3dlb h GLU 629 N 0.54 0.32 -0.25 1.13 4.39 -1.98 0.20 114.58 118.93 3dlb h GLU 629 Ca 0.14 -0.07 0.05 0.00 0.34 0.00 0.00 59.36 59.82 3dlb h GLU 629 Cb -0.05 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.51 3dlb h GLU 629 CO -0.03 0.42 -0.07 0.00 -1.16 0.00 0.00 179.01 178.17 3dlb h ALA 630 N 0.89 0.15 -0.13 3.43 0.00 -1.84 0.14 119.26 121.90 3dlb h ALA 630 Ca 0.07 0.10 0.01 0.00 0.00 0.00 0.00 54.91 55.09 3dlb h ALA 630 Cb 0.24 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3dlb h ALA 630 CO -0.00 -0.48 0.03 -0.07 0.00 0.00 0.00 179.25 178.73 3dlb h LEU 631 N -0.01 0.03 -0.71 0.00 4.07 -1.31 -1.44 115.31 115.93 3dlb h LEU 631 Ca 0.12 0.02 0.08 0.00 0.08 0.00 0.00 57.88 58.18 3dlb h LEU 631 Cb 0.20 0.02 -0.07 0.00 1.08 0.00 0.00 40.66 41.89 3dlb h LEU 631 CO -0.27 0.04 0.37 0.00 -1.08 0.00 0.00 178.44 177.50 3dlb h ALA 632 N 1.09 0.97 -0.61 1.53 0.00 0.16 -0.76 119.26 121.64 3dlb h ALA 632 Ca 0.06 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 3dlb h ALA 632 Cb 0.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 3dlb h ALA 632 CO -0.07 -0.00 0.09 0.45 0.00 0.00 0.00 179.25 179.71 3dlb h HIS 633 N 0.64 1.09 -0.19 0.00 3.86 -0.40 -1.76 115.15 118.39 3dlb h HIS 633 Ca 0.34 -0.16 -0.15 0.00 -1.16 0.00 0.00 60.37 59.24 3dlb h HIS 633 Cb 0.31 -0.30 -0.01 0.00 1.06 0.00 0.00 27.41 28.48 3dlb h HIS 633 CO -0.09 0.94 -0.52 0.37 0.86 0.00 0.00 177.93 179.49 3dlb h GLN 634 N 0.93 0.55 -0.03 2.45 4.15 -0.63 -0.72 115.11 121.81 3dlb h GLN 634 Ca 0.18 -0.33 -0.01 0.00 0.77 0.00 0.00 58.65 59.26 3dlb h GLN 634 Cb 0.45 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.17 3dlb h GLN 634 CO 0.01 0.93 -0.03 0.82 -1.93 0.00 0.00 178.83 178.64 3dlb h ILE 635 N 0.43 1.39 -0.35 2.39 1.08 -1.13 -1.63 117.51 119.68 3dlb h ILE 635 Ca 0.01 -1.19 0.07 0.00 -0.39 0.00 0.00 64.86 63.36 3dlb h ILE 635 Cb 1.05 2.13 -0.06 0.00 -3.07 0.00 0.00 36.82 36.87 3dlb h ILE 635 CO 0.10 0.32 -0.05 0.15 -0.69 0.00 0.00 178.15 177.98 3dlb h PHE 636 N -0.41 -0.11 -0.16 1.37 3.57 -1.31 0.17 116.94 120.06 3dlb h PHE 636 Ca 0.00 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 3dlb h PHE 636 Cb 0.53 0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.36 3dlb h PHE 636 CO 0.10 -0.11 -0.08 0.45 -2.23 0.00 0.00 178.31 176.44 3dlb h HIS 637 N 0.04 0.24 0.00 0.41 3.86 -1.12 0.96 115.15 119.54 3dlb h HIS 637 Ca 0.17 -0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.31 3dlb h HIS 637 Cb 0.25 -0.07 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 3dlb h HIS 637 CO -0.29 0.32 -0.26 -0.07 0.86 0.00 0.00 177.93 178.49 3dlb h LEU 638 N 0.23 0.00 0.00 2.43 3.38 0.00 -2.63 115.31 118.73 3dlb h LEU 638 Ca 0.05 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.82 3dlb h LEU 638 Cb 0.29 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 3dlb h LEU 638 CO 0.01 0.26 -1.02 0.74 0.09 0.00 0.00 178.44 178.52 3dlb h THR 639 N 0.00 1.49 -0.02 0.22 2.02 0.13 -3.27 112.91 113.48 3dlb h THR 639 Ca -0.00 -3.17 -0.08 0.00 0.77 0.00 0.00 66.41 63.93 3dlb h THR 639 Cb 0.72 2.73 -0.01 0.00 -1.74 0.00 0.00 68.15 69.85 3dlb h THR 639 CO 0.03 0.85 -0.37 0.03 0.37 0.00 0.00 175.52 176.43 3dlb h ARG 640 N 0.00 0.05 -4.83 6.66 2.47 -0.53 -3.35 114.38 114.85 3dlb h ARG 640 Ca -0.04 -0.02 -0.68 0.00 -1.26 0.00 0.00 59.98 57.98 3dlb h ARG 640 Cb 1.74 -0.00 -0.29 0.00 -1.65 0.00 0.00 29.97 29.78 3dlb h ARG 640 CO 0.11 0.41 -0.67 -0.48 0.56 0.00 0.00 179.97 179.91 3dlb s LEU 641 N -8.22 3.66 0.00 3.04 0.05 -1.19 -4.69 118.68 111.33 3dlb s LEU 641 Ca -0.03 -0.81 0.00 0.00 0.05 0.00 0.00 54.13 53.34 3dlb s LEU 641 Cb 0.14 -1.80 0.00 0.00 -2.05 0.00 0.00 46.19 42.48 3dlb s LEU 641 CO 0.73 -0.18 0.34 0.00 -0.55 0.00 0.00 176.35 176.69