#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3duy h PHE 47 N 0.00 0.00 -0.32 1.43 0.04 -1.98 -3.23 116.94 112.88 3duy h PHE 47 Ca 0.00 0.00 0.09 0.00 2.80 0.00 0.00 57.97 60.86 3duy h PHE 47 Cb 0.00 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.14 3duy h PHE 47 CO 0.00 0.00 0.24 -0.24 -0.60 0.00 0.00 178.31 177.71 3duy h VAL 48 N 0.00 0.79 0.00 -0.55 3.04 -2.01 0.16 116.25 117.68 3duy h VAL 48 Ca 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3duy h VAL 48 Cb 0.91 0.83 -0.00 0.00 -2.01 0.00 0.00 31.29 31.02 3duy h VAL 48 CO 0.00 0.00 -0.01 -0.33 -1.01 0.00 0.00 177.57 176.22 3duy h GLU 1 N 0.00 0.00 0.00 4.17 5.08 -1.96 -2.89 114.58 118.98 3duy h GLU 1 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3duy h GLU 1 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 3duy h GLU 1 CO -0.00 0.01 -1.17 -1.33 -1.00 0.00 0.00 179.01 175.52 3duy n MET 2 N -3.12 0.68 -1.82 2.33 2.81 0.54 -4.71 117.12 113.83 3duy n MET 2 Ca -0.01 -0.05 -0.41 0.00 -1.81 0.00 0.00 57.70 55.42 3duy n MET 2 Cb 0.18 -1.42 -0.00 0.00 -0.71 0.00 0.00 33.22 31.27 3duy n MET 2 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3duy s VAL 3 N -2.95 2.10 -0.91 2.03 1.01 -1.09 -2.50 120.40 118.09 3duy s VAL 3 Ca 0.03 0.10 0.00 0.00 0.00 0.00 0.00 61.98 62.11 3duy s VAL 3 Cb 0.14 -3.06 0.00 0.00 0.00 0.00 0.00 36.38 33.46 3duy s VAL 3 CO 0.79 0.02 0.00 -0.67 0.00 0.00 0.00 175.10 175.24 3duy n ASP 4 N 0.67 -3.89 -0.52 3.32 4.64 -1.21 -4.90 116.55 114.66 3duy n ASP 4 Ca 0.02 0.18 0.12 0.00 -1.38 0.00 0.00 54.79 53.73 3duy n ASP 4 Cb 0.39 -2.35 0.44 0.00 -1.04 0.00 0.00 41.12 38.57 3duy n ASP 4 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 3duy n ASN 5 N 0.53 1.59 -4.66 1.67 6.94 -1.04 -4.84 115.26 115.45 3duy n ASN 5 Ca -0.09 -1.61 -0.33 0.00 -0.02 0.00 0.00 54.58 52.52 3duy n ASN 5 Cb 0.34 -0.06 -0.10 0.00 -2.36 0.00 0.00 39.78 37.61 3duy n ASN 5 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3duy s LEU 6 N -1.76 3.43 0.21 -4.53 1.43 -0.68 -4.35 118.68 112.43 3duy s LEU 6 Ca 0.35 0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.49 3duy s LEU 6 Cb 0.19 -1.89 -0.05 0.00 0.03 0.00 0.00 46.19 44.47 3duy s LEU 6 CO 0.30 0.32 -0.00 -0.13 0.23 0.00 0.00 176.35 177.06 3duy s ARG 7 N -1.24 1.25 0.14 1.70 0.52 -0.75 -2.24 118.95 118.33 3duy s ARG 7 Ca 0.16 -1.62 -0.24 0.00 -0.52 0.00 0.00 55.73 53.51 3duy s ARG 7 Cb -0.11 -0.49 0.08 0.00 0.52 0.00 0.00 34.95 34.94 3duy s ARG 7 CO 0.06 -0.10 1.07 0.20 0.02 0.00 0.00 175.30 176.55 3duy s GLY 8 N -3.26 -0.05 -0.04 -3.53 0.00 0.95 -0.48 107.32 100.91 3duy s GLY 8 Ca 0.27 -0.08 0.05 0.00 0.00 0.00 0.00 44.72 44.95 3duy s GLY 8 CO 0.07 1.91 -0.17 0.54 0.00 0.00 0.00 173.10 175.44 3duy s LYS 9 N -2.44 2.42 0.11 2.90 1.02 -1.25 -0.85 119.74 121.65 3duy s LYS 9 Ca 0.19 -0.75 -0.36 0.00 0.02 0.00 0.00 55.97 55.08 3duy s LYS 9 Cb -0.01 -2.30 -0.16 0.00 -0.52 0.00 0.00 37.83 34.84 3duy s LYS 9 CO 0.03 0.60 1.34 0.45 -0.92 0.00 0.00 175.35 176.85 3duy n SER 10 N 2.36 1.80 0.00 2.83 2.88 -1.26 -0.40 113.62 121.82 3duy n SER 10 Ca -0.17 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.49 3duy n SER 10 Cb 0.52 -1.23 0.00 0.00 -0.75 0.00 0.00 64.21 62.75 3duy n SER 10 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3duy n GLY 11 N 2.54 0.36 0.00 0.46 0.00 -1.26 -4.80 105.19 102.49 3duy n GLY 11 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3duy n GLY 11 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3duy n GLN 12 N -1.45 2.03 0.00 1.61 6.02 0.46 -4.95 117.38 121.10 3duy n GLN 12 Ca 0.00 -1.24 0.00 0.00 -0.01 0.00 0.00 57.00 55.75 3duy n GLN 12 Cb 0.16 -0.98 0.00 0.00 1.02 0.00 0.00 30.24 30.44 3duy n GLN 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3duy n GLY 13 N -0.37 1.04 3.61 1.08 0.00 -1.23 -4.79 105.19 104.53 3duy n GLY 13 Ca 0.00 -1.82 -0.34 0.00 0.00 0.00 0.00 46.02 43.85 3duy n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3duy s TYR 14 N -2.75 3.10 0.14 1.61 1.51 -1.26 -3.75 117.35 115.96 3duy s TYR 14 Ca 0.00 0.01 0.07 0.00 -1.01 0.00 0.00 57.07 56.14 3duy s TYR 14 Cb 0.00 -1.86 -0.04 0.00 -0.11 0.00 0.00 41.96 39.95 3duy s TYR 14 CO 0.00 0.26 -0.17 1.52 -1.11 0.00 0.00 175.55 176.06 3duy s TYR 15 N -0.36 1.65 0.19 2.71 -0.85 0.36 -1.01 117.35 120.05 3duy s TYR 15 Ca 0.07 -0.50 0.11 0.00 -0.52 0.00 0.00 57.07 56.23 3duy s TYR 15 Cb -0.12 -0.84 -0.04 0.00 0.38 0.00 0.00 41.96 41.33 3duy s TYR 15 CO 0.02 0.25 -0.22 0.54 -1.52 0.00 0.00 175.55 174.62 3duy s VAL 16 N -2.03 2.49 0.07 -3.49 0.11 -0.11 -1.81 120.40 115.63 3duy s VAL 16 Ca 0.12 -1.97 -0.24 0.00 -2.93 0.00 0.00 61.98 56.96 3duy s VAL 16 Cb -0.06 -2.20 -0.06 0.00 -1.53 0.00 0.00 36.38 32.53 3duy s VAL 16 CO 0.05 -0.12 0.74 -0.70 -3.33 0.00 0.00 175.10 171.74 3duy s GLU 17 N -2.70 4.47 0.14 1.54 2.12 -1.26 -0.60 118.70 122.42 3duy s GLU 17 Ca 0.21 1.03 0.01 0.00 0.36 0.00 0.00 54.97 56.58 3duy s GLU 17 Cb -0.08 -3.32 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 3duy s GLU 17 CO 0.11 0.40 0.01 -1.64 -0.54 0.00 0.00 175.26 173.59 3duy s MET 18 N -0.45 0.98 0.04 4.30 -1.94 -0.27 -4.09 119.30 117.87 3duy s MET 18 Ca 0.36 -1.45 0.07 0.00 -1.71 0.00 0.00 55.69 52.96 3duy s MET 18 Cb -0.21 -0.06 -0.02 0.00 2.01 0.00 0.00 34.83 36.55 3duy s MET 18 CO 0.23 -0.16 -0.19 0.95 -0.01 0.00 0.00 175.02 175.84 3duy s THR 19 N -3.80 1.55 0.00 2.05 -4.23 -0.39 -1.19 115.64 109.63 3duy s THR 19 Ca 0.21 -1.13 0.05 0.00 -1.18 0.00 0.00 61.69 59.64 3duy s THR 19 Cb 0.07 -1.35 -0.01 0.00 1.34 0.00 0.00 72.50 72.54 3duy s THR 19 CO 0.01 0.19 -0.14 0.68 -0.54 0.00 0.00 174.62 174.81 3duy s VAL 20 N -0.78 1.12 0.00 2.29 -7.23 -0.22 -1.29 120.40 114.30 3duy s VAL 20 Ca 0.06 -0.70 0.00 0.00 -1.81 0.00 0.00 61.98 59.53 3duy s VAL 20 Cb -0.08 -0.96 0.00 0.00 0.56 0.00 0.00 36.38 35.90 3duy s VAL 20 CO 0.01 0.24 0.00 0.61 -0.31 0.00 0.00 175.10 175.66 3duy n GLY 21 N 2.53 -0.75 2.86 2.32 0.00 -0.00 -1.09 105.19 111.05 3duy n GLY 21 Ca -0.15 -1.69 -0.26 0.00 0.00 0.00 0.00 46.02 43.91 3duy n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3duy s SER 22 N -2.86 2.28 0.79 1.61 0.01 -1.26 -2.62 113.70 111.65 3duy s SER 22 Ca 0.00 -0.38 -0.11 0.00 1.31 0.00 0.00 55.95 56.77 3duy s SER 22 Cb 0.00 -0.77 0.07 0.00 0.21 0.00 0.00 66.02 65.53 3duy s SER 22 CO 0.00 -0.16 1.10 -2.16 0.41 0.00 0.00 173.24 172.43 3duy s PRO 23 N 1.75 2.09 0.10 12.44 0.04 -1.26 -1.60 135.00 148.57 3duy s PRO 23 Ca 0.04 1.25 -0.33 0.00 0.04 0.00 0.00 61.00 62.00 3duy s PRO 23 Cb -0.13 -1.87 -0.12 0.00 0.04 0.00 0.00 34.50 32.41 3duy s PRO 23 CO -0.07 -1.78 1.75 -2.30 0.04 0.00 0.00 177.00 174.64 3duy n PRO 24 N -3.56 2.46 -3.86 0.56 -0.02 -1.08 -4.91 135.00 124.60 3duy n PRO 24 Ca 0.10 0.89 -0.36 0.00 -2.02 0.00 0.00 63.50 62.11 3duy n PRO 24 Cb 0.53 -2.73 -0.11 0.00 -0.02 0.00 0.00 33.50 31.17 3duy n PRO 24 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3duy s GLN 25 N 2.25 3.88 -0.02 -0.52 -0.21 -0.25 -4.90 119.66 119.89 3duy s GLN 25 Ca 0.82 -0.37 -0.21 0.00 0.02 0.00 0.00 55.36 55.62 3duy s GLN 25 Cb -0.59 -3.33 -0.05 0.00 1.00 0.00 0.00 33.01 30.04 3duy s GLN 25 CO 0.40 0.06 0.60 0.99 -2.12 0.00 0.00 175.29 175.23 3duy s THR 26 N 0.97 4.95 -0.02 -0.19 2.01 -1.26 -1.05 115.64 121.05 3duy s THR 26 Ca 0.05 1.26 -0.08 0.00 0.31 0.00 0.00 61.69 63.22 3duy s THR 26 Cb -0.14 -3.94 0.01 0.00 0.01 0.00 0.00 72.50 68.44 3duy s THR 26 CO 0.03 0.38 0.18 -0.76 -0.69 0.00 0.00 174.62 173.76 3duy s LEU 27 N 0.05 1.36 -0.15 4.42 1.43 -0.34 -4.98 118.68 120.48 3duy s LEU 27 Ca 0.32 -0.01 -0.19 0.00 -1.03 0.00 0.00 54.13 53.22 3duy s LEU 27 Cb -0.18 0.78 -0.04 0.00 0.03 0.00 0.00 46.19 46.78 3duy s LEU 27 CO 0.17 -0.31 0.51 0.20 0.23 0.00 0.00 176.35 177.14 3duy s ASN 28 N -1.02 6.65 -0.15 2.29 0.01 -1.26 -1.12 114.94 120.34 3duy s ASN 28 Ca -0.11 0.78 0.01 0.00 -0.71 0.00 0.00 52.86 52.83 3duy s ASN 28 Cb -0.06 -2.30 0.02 0.00 0.41 0.00 0.00 41.25 39.33 3duy s ASN 28 CO 0.02 -0.08 -0.18 -0.63 -1.51 0.00 0.00 177.10 174.72 3duy s ILE 29 N 1.06 1.82 0.28 0.60 -1.09 0.23 -0.56 121.20 123.54 3duy s ILE 29 Ca 0.26 -0.80 -0.30 0.00 -2.23 0.00 0.00 60.65 57.58 3duy s ILE 29 Cb -0.15 -1.66 -0.10 0.00 -1.58 0.00 0.00 42.46 38.97 3duy s ILE 29 CO 0.10 0.50 1.46 -0.22 -1.23 0.00 0.00 174.94 175.55 3duy s LEU 30 N 1.26 4.38 -0.33 2.97 2.96 -0.20 -0.94 118.68 128.77 3duy s LEU 30 Ca 0.02 2.77 -0.18 0.00 -0.22 0.00 0.00 54.13 56.52 3duy s LEU 30 Cb -0.14 -3.63 -0.01 0.00 0.50 0.00 0.00 46.19 42.91 3duy s LEU 30 CO -0.09 -0.74 0.51 0.68 -1.32 0.00 0.00 176.35 175.38 3duy s VAL 31 N -0.29 5.03 -0.33 1.68 -7.23 -0.18 -0.09 120.40 118.99 3duy s VAL 31 Ca 0.58 0.42 0.01 0.00 -1.81 0.00 0.00 61.98 61.18 3duy s VAL 31 Cb -0.43 -3.93 0.10 0.00 0.56 0.00 0.00 36.38 32.68 3duy s VAL 31 CO 0.48 -0.16 0.09 -0.62 -0.31 0.00 0.00 175.10 174.58 3duy s ASP 32 N 1.73 4.31 0.00 4.85 2.15 -0.64 -4.12 116.67 124.95 3duy s ASP 32 Ca 0.19 -1.92 0.27 0.00 0.43 0.00 0.00 52.55 51.52 3duy s ASP 32 Cb -0.15 -1.19 1.49 0.00 -0.30 0.00 0.00 42.92 42.77 3duy s ASP 32 CO 0.13 -0.39 1.93 0.35 -0.17 0.00 0.00 175.17 177.01 3duy n THR 33 N 4.52 0.07 1.15 1.71 -2.24 -1.26 -1.04 114.28 117.18 3duy n THR 33 Ca 0.01 0.02 0.11 0.00 -2.27 0.00 0.00 64.05 61.91 3duy n THR 33 Cb 0.41 -0.59 0.36 0.00 -2.10 0.00 0.00 70.33 68.41 3duy n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3duy n GLY 34 N 0.77 0.42 3.52 3.38 0.00 -1.26 -4.24 105.19 107.79 3duy n GLY 34 Ca 0.17 -0.45 -0.14 0.00 0.00 0.00 0.00 46.02 45.60 3duy n GLY 34 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3duy n SER 35 N 0.44 -1.59 0.00 1.61 3.41 -1.21 -4.98 113.62 111.30 3duy n SER 35 Ca 0.16 -2.87 0.00 0.00 -0.26 0.00 0.00 58.87 55.90 3duy n SER 35 Cb 0.36 2.88 0.00 0.00 -0.26 0.00 0.00 64.21 67.19 3duy n SER 35 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3duy n SER 36 N -1.59 0.30 -4.74 4.04 7.64 -1.26 -0.56 113.62 117.44 3duy n SER 36 Ca -0.01 -1.13 -0.35 0.00 1.01 0.00 0.00 58.87 58.38 3duy n SER 36 Cb 0.60 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.72 3duy n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3duy s ASN 37 N -0.13 5.92 -0.26 6.43 -0.87 -1.26 -4.51 114.94 120.25 3duy s ASN 37 Ca 0.00 0.25 -0.18 0.00 -1.57 0.00 0.00 52.86 51.36 3duy s ASN 37 Cb 0.00 -1.94 -0.03 0.00 -0.02 0.00 0.00 41.25 39.27 3duy s ASN 37 CO 0.00 0.29 0.51 0.12 -2.57 0.00 0.00 177.10 175.45 3duy s PHE 38 N -0.31 3.26 -0.02 2.20 5.99 -1.26 -1.63 117.98 126.22 3duy s PHE 38 Ca 0.10 0.62 -0.06 0.00 0.00 0.00 0.00 56.93 57.59 3duy s PHE 38 Cb -0.12 -2.72 0.01 0.00 0.00 0.00 0.00 43.02 40.19 3duy s PHE 38 CO 0.01 -0.28 0.14 0.00 -0.00 0.00 0.00 175.22 175.09 3duy s ALA 39 N 2.30 -0.32 0.01 11.12 0.00 -0.65 -1.39 121.76 132.84 3duy s ALA 39 Ca 0.21 0.08 0.01 0.00 0.00 0.00 0.00 51.96 52.26 3duy s ALA 39 Cb -0.16 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.91 3duy s ALA 39 CO 0.09 -0.15 -0.05 0.14 0.00 0.00 0.00 175.76 175.79 3duy s VAL 40 N -0.77 0.36 0.18 0.00 -7.23 -0.61 0.01 120.40 112.34 3duy s VAL 40 Ca -0.09 -0.55 -0.33 0.00 -1.81 0.00 0.00 61.98 59.20 3duy s VAL 40 Cb -0.05 -0.38 -0.15 0.00 0.56 0.00 0.00 36.38 36.37 3duy s VAL 40 CO 0.01 -0.14 1.40 0.61 -0.31 0.00 0.00 175.10 176.68 3duy n GLY 41 N 2.32 0.70 0.22 2.32 0.00 0.44 -0.93 105.19 110.25 3duy n GLY 41 Ca -0.17 0.59 0.03 0.00 0.00 0.00 0.00 46.02 46.46 3duy n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3duy n ALA 42 N 2.39 1.90 -3.10 4.61 0.00 -0.73 -0.24 120.51 125.34 3duy n ALA 42 Ca 0.15 -1.41 -0.11 0.00 0.00 0.00 0.00 53.44 52.07 3duy n ALA 42 Cb 0.27 -0.31 -0.05 0.00 0.00 0.00 0.00 19.45 19.37 3duy n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3duy s ALA 43 N -1.01 -1.06 0.45 0.00 0.00 -1.24 -4.76 121.76 114.14 3duy s ALA 43 Ca 0.10 0.14 -0.24 0.00 0.00 0.00 0.00 51.96 51.95 3duy s ALA 43 Cb 0.08 0.62 -0.09 0.00 0.00 0.00 0.00 23.12 23.74 3duy s ALA 43 CO 0.01 -0.61 1.16 -2.30 0.00 0.00 0.00 175.76 174.02 3duy n PRO 44 N -0.05 1.62 -3.66 0.00 -0.02 -1.26 -4.93 135.00 126.70 3duy n PRO 44 Ca -0.17 0.58 -0.14 0.00 -2.02 0.00 0.00 63.50 61.75 3duy n PRO 44 Cb 0.63 -2.26 -0.08 0.00 -0.02 0.00 0.00 33.50 31.77 3duy n PRO 44 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3duy s HIS 45 N -1.26 -0.61 0.51 6.00 2.46 -1.26 -5.04 115.29 116.09 3duy s HIS 45 Ca 0.64 1.42 0.24 0.00 0.47 0.00 0.00 55.06 57.83 3duy s HIS 45 Cb -0.51 0.24 1.35 0.00 -0.13 0.00 0.00 32.58 33.52 3duy s HIS 45 CO 0.56 -0.36 1.98 -1.35 -2.47 0.00 0.00 174.74 173.10 3duy h PRO 46 N 4.81 0.07 -0.02 2.88 0.11 -2.03 -1.39 132.00 136.42 3duy h PRO 46 Ca -0.28 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3duy h PRO 46 Cb 1.17 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3duy h PRO 46 CO 0.19 0.04 -0.19 1.19 -0.21 0.00 0.00 178.00 179.03 3duy n PHE 47 N -4.39 0.00 -3.75 0.65 0.99 -1.26 -4.88 117.46 104.82 3duy n PHE 47 Ca 0.11 0.00 -0.35 0.00 -0.00 0.00 0.00 57.45 57.21 3duy n PHE 47 Cb 0.62 -0.01 -0.08 0.00 -1.00 0.00 0.00 39.48 39.00 3duy n PHE 47 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3duy s LEU 48 N -2.21 4.20 0.17 4.37 1.43 -0.53 -4.64 118.68 121.48 3duy s LEU 48 Ca 0.26 0.23 0.21 0.00 -1.03 0.00 0.00 54.13 53.81 3duy s LEU 48 Cb 0.19 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 3duy s LEU 48 CO 0.42 0.19 0.98 1.41 0.23 0.00 0.00 176.35 179.58 3duy n HIS 49 N 3.44 0.95 -3.80 0.29 8.25 -1.26 -4.64 115.22 118.44 3duy n HIS 49 Ca -0.16 0.28 -0.09 0.00 -0.26 0.00 0.00 57.72 57.49 3duy n HIS 49 Cb 0.52 -0.97 -0.04 0.00 1.12 0.00 0.00 29.99 30.62 3duy n HIS 49 CO 0.00 0.00 0.00 -0.98 0.64 0.00 0.00 176.34 176.00 3duy s ARG 50 N -3.29 1.38 0.30 -0.41 1.70 -1.26 -5.15 118.95 112.22 3duy s ARG 50 Ca -0.01 -0.96 -0.16 0.00 -0.47 0.00 0.00 55.73 54.14 3duy s ARG 50 Cb 0.09 0.50 0.02 0.00 -0.57 0.00 0.00 34.95 34.99 3duy s ARG 50 CO 0.80 -0.58 0.64 1.52 -1.08 0.00 0.00 175.30 176.60 3duy s TYR 51 N -3.90 0.17 -0.09 5.89 -0.85 -1.26 -4.90 117.35 112.40 3duy s TYR 51 Ca 0.12 -0.63 -0.30 0.00 -0.52 0.00 0.00 57.07 55.75 3duy s TYR 51 Cb -0.01 0.51 -0.02 0.00 0.38 0.00 0.00 41.96 42.83 3duy s TYR 51 CO -0.01 -1.24 1.01 -0.47 -1.52 0.00 0.00 175.55 173.33 3duy s TYR 52 N -3.49 3.52 -0.43 -3.49 5.04 0.66 -4.95 117.35 114.21 3duy s TYR 52 Ca 0.17 1.60 -0.04 0.00 -2.44 0.00 0.00 57.07 56.36 3duy s TYR 52 Cb -0.04 -3.19 0.11 0.00 0.35 0.00 0.00 41.96 39.20 3duy s TYR 52 CO 0.10 -0.24 0.25 -0.65 -1.34 0.00 0.00 175.55 173.67 3duy s GLN 53 N 1.87 2.13 0.43 4.97 -0.21 -1.26 -4.40 119.66 123.18 3duy s GLN 53 Ca 0.49 -1.84 0.11 0.00 0.02 0.00 0.00 55.36 54.15 3duy s GLN 53 Cb -0.19 -3.67 0.93 0.00 1.00 0.00 0.00 33.01 31.08 3duy s GLN 53 CO 0.20 -1.11 2.00 0.00 -2.12 0.00 0.00 175.29 174.26 3duy h ARG 54 N 8.10 0.19 0.00 2.91 3.08 -1.95 -2.30 114.38 124.42 3duy h ARG 54 Ca -0.14 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 3duy h ARG 54 Cb 1.05 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.06 3duy h ARG 54 CO 0.74 0.26 -0.06 -0.56 -1.07 0.00 0.00 179.97 179.28 3duy h GLN 55 N 0.19 0.00 -0.09 0.04 -0.00 -2.01 -2.46 115.11 110.78 3duy h GLN 55 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.69 3duy h GLN 55 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.71 3duy h GLN 55 CO 0.01 0.06 0.00 1.28 -0.00 0.00 0.00 178.83 180.18 3duy n LEU 56 N -3.17 1.64 -4.36 0.06 4.77 -0.87 -4.82 117.00 110.26 3duy n LEU 56 Ca 0.01 -0.61 -0.35 0.00 -0.03 0.00 0.00 56.01 55.03 3duy n LEU 56 Cb 0.36 -0.05 -0.14 0.00 -2.33 0.00 0.00 43.42 41.26 3duy n LEU 56 CO 0.29 0.31 -0.38 -0.55 -1.33 0.00 0.00 177.39 175.73 3duy s SER 57 N -1.80 4.39 0.27 -1.43 0.15 -0.93 -4.25 113.70 110.10 3duy s SER 57 Ca 0.35 -0.33 0.25 0.00 0.70 0.00 0.00 55.95 56.93 3duy s SER 57 Cb 0.19 -1.74 0.67 0.00 -1.71 0.00 0.00 66.02 63.44 3duy s SER 57 CO 0.30 0.04 1.72 0.77 1.20 0.00 0.00 173.24 177.27 3duy h SER 58 N 7.69 0.00 -0.01 5.45 4.64 -1.59 -3.17 113.55 126.56 3duy h SER 58 Ca -0.37 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 3duy h SER 58 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 3duy h SER 58 CO 0.60 0.00 -0.21 0.35 -0.87 0.00 0.00 176.83 176.70 3duy n THR 59 N -2.48 0.00 -1.98 2.95 -2.24 -1.26 -4.96 114.28 104.31 3duy n THR 59 Ca 0.05 -0.37 -0.41 0.00 -2.27 0.00 0.00 64.05 61.05 3duy n THR 59 Cb 0.46 1.30 -0.02 0.00 -2.10 0.00 0.00 70.33 69.97 3duy n THR 59 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3duy s TYR 60 N -2.22 2.93 -0.06 4.78 5.04 -1.20 -4.53 117.35 122.08 3duy s TYR 60 Ca 0.24 1.11 0.02 0.00 -2.44 0.00 0.00 57.07 56.01 3duy s TYR 60 Cb 0.19 -3.85 0.01 0.00 0.35 0.00 0.00 41.96 38.67 3duy s TYR 60 CO 0.43 -2.63 -0.13 1.03 -1.34 0.00 0.00 175.55 172.91 3duy s ARG 61 N -1.00 1.73 0.13 4.97 0.52 -0.08 -5.00 118.95 120.22 3duy s ARG 61 Ca 0.56 -0.44 -0.27 0.00 -0.52 0.00 0.00 55.73 55.06 3duy s ARG 61 Cb -0.43 -1.43 -0.07 0.00 0.52 0.00 0.00 34.95 33.54 3duy s ARG 61 CO 0.49 0.05 0.86 0.34 0.02 0.00 0.00 175.30 177.06 3duy s ASP 62 N 0.59 7.42 0.00 0.23 -1.08 -1.26 -0.88 116.67 121.70 3duy s ASP 62 Ca -0.14 1.69 0.23 0.00 -0.52 0.00 0.00 52.55 53.81 3duy s ASP 62 Cb -0.15 -2.54 0.03 0.00 -1.46 0.00 0.00 42.92 38.80 3duy s ASP 62 CO 0.04 0.07 1.10 0.18 0.52 0.00 0.00 175.17 177.08 3duy n LEU 63 N 2.25 1.69 -3.75 -1.34 4.77 -0.69 -4.91 117.00 115.01 3duy n LEU 63 Ca -0.02 -0.64 -0.25 0.00 -0.03 0.00 0.00 56.01 55.07 3duy n LEU 63 Cb 0.49 -0.02 0.04 0.00 -2.33 0.00 0.00 43.42 41.61 3duy n LEU 63 CO 0.49 0.33 0.09 0.54 -1.33 0.00 0.00 177.39 177.50 3duy n ARG 64 N -0.43 -5.97 -3.81 3.23 5.12 -1.25 -4.99 116.66 108.56 3duy n ARG 64 Ca 0.08 0.67 -0.12 0.00 -1.93 0.00 0.00 57.85 56.55 3duy n ARG 64 Cb 0.43 -5.52 -0.12 0.00 -1.16 0.00 0.00 32.46 26.08 3duy n ARG 64 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3duy s LYS 65 N -6.26 0.20 0.79 5.56 1.02 -1.26 -5.05 119.74 114.73 3duy s LYS 65 Ca 0.40 0.25 -0.10 0.00 0.02 0.00 0.00 55.97 56.54 3duy s LYS 65 Cb -0.19 0.09 0.10 0.00 -0.52 0.00 0.00 37.83 37.30 3duy s LYS 65 CO 0.80 -0.03 1.13 0.20 -0.92 0.00 0.00 175.35 176.52 3duy s GLY 66 N 0.12 1.67 -0.03 -3.33 0.00 -1.26 -0.88 107.32 103.61 3duy s GLY 66 Ca -0.00 -0.92 -0.25 0.00 0.00 0.00 0.00 44.72 43.54 3duy s GLY 66 CO 0.00 -0.41 0.55 0.54 0.00 0.00 0.00 173.10 173.77 3duy s VAL 67 N -3.47 0.02 -0.02 1.40 0.11 -0.05 -4.75 120.40 113.64 3duy s VAL 67 Ca 0.64 -0.17 0.00 0.00 -2.93 0.00 0.00 61.98 59.52 3duy s VAL 67 Cb -0.09 -0.86 0.02 0.00 -1.53 0.00 0.00 36.38 33.91 3duy s VAL 67 CO 0.48 -0.10 -0.00 -0.47 -3.33 0.00 0.00 175.10 171.68 3duy s TYR 68 N -1.28 0.21 -0.11 1.54 5.04 -1.26 -0.92 117.35 120.56 3duy s TYR 68 Ca -0.12 0.02 -0.01 0.00 -2.44 0.00 0.00 57.07 54.52 3duy s TYR 68 Cb -0.02 -0.27 0.03 0.00 0.35 0.00 0.00 41.96 42.05 3duy s TYR 68 CO 0.08 -0.08 -0.02 0.08 -1.34 0.00 0.00 175.55 174.27 3duy s VAL 69 N 0.67 0.64 -0.11 3.14 1.01 -0.56 -4.82 120.40 120.37 3duy s VAL 69 Ca -0.06 -0.15 -0.13 0.00 0.00 0.00 0.00 61.98 61.64 3duy s VAL 69 Cb -0.09 -0.81 -0.05 0.00 0.00 0.00 0.00 36.38 35.43 3duy s VAL 69 CO -0.01 0.22 0.31 -2.16 0.00 0.00 0.00 175.10 173.45 3duy s PRO 70 N 1.86 4.04 0.47 2.72 0.04 -1.26 -1.90 135.00 140.97 3duy s PRO 70 Ca 0.04 0.17 0.06 0.00 0.04 0.00 0.00 61.00 61.31 3duy s PRO 70 Cb -0.13 -3.33 -0.01 0.00 0.04 0.00 0.00 34.50 31.07 3duy s PRO 70 CO -0.07 0.44 0.29 0.71 0.04 0.00 0.00 177.00 178.41 3duy s TYR 71 N -0.17 2.17 0.23 0.56 2.02 -0.06 -5.01 117.35 117.09 3duy s TYR 71 Ca 0.19 -0.70 -0.08 0.00 -0.37 0.00 0.00 57.07 56.11 3duy s TYR 71 Cb -0.14 -1.95 0.39 0.00 -0.40 0.00 0.00 41.96 39.86 3duy s TYR 71 CO 0.07 -0.12 1.68 1.15 -1.57 0.00 0.00 175.55 176.75 3duy h THR 72 N 1.08 0.50 -3.36 -0.71 2.02 -2.00 -3.37 112.91 107.08 3duy h THR 72 Ca -0.40 -0.07 -0.45 0.00 0.77 0.00 0.00 66.41 66.26 3duy h THR 72 Cb 1.28 0.29 -0.35 0.00 -1.74 0.00 0.00 68.15 67.62 3duy h THR 72 CO 0.63 0.04 -0.78 -1.10 0.37 0.00 0.00 175.52 174.67 3duy s GLN 73 N -6.09 1.06 0.00 6.66 -0.21 -1.26 -5.10 119.66 114.72 3duy s GLN 73 Ca -0.13 -0.14 0.00 0.00 0.02 0.00 0.00 55.36 55.11 3duy s GLN 73 Cb 0.20 -1.09 0.00 0.00 1.00 0.00 0.00 33.01 33.12 3duy s GLN 73 CO 0.75 -0.14 0.00 0.41 -2.12 0.00 0.00 175.29 174.19 3duy n GLY 74 N 4.38 2.22 3.48 3.09 0.00 -1.25 -4.83 105.19 112.27 3duy n GLY 74 Ca -0.19 -1.79 -0.12 0.00 0.00 0.00 0.00 46.02 43.91 3duy n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3duy s LYS 75 N -3.67 1.05 0.14 1.61 -2.85 -0.81 -0.88 119.74 114.33 3duy s LYS 75 Ca 0.00 -0.19 -0.09 0.00 -1.00 0.00 0.00 55.97 54.68 3duy s LYS 75 Cb 0.00 0.49 -0.00 0.00 -2.06 0.00 0.00 37.83 36.26 3duy s LYS 75 CO 0.00 -0.42 0.26 1.67 0.10 0.00 0.00 175.35 176.96 3duy s TRP 76 N -2.73 0.26 0.14 1.78 1.48 -0.80 -1.41 118.94 117.67 3duy s TRP 76 Ca -0.01 -0.65 0.05 0.00 -1.06 0.00 0.00 56.10 54.43 3duy s TRP 76 Cb -0.01 -0.03 -0.04 0.00 -1.16 0.00 0.00 33.47 32.23 3duy s TRP 76 CO -0.05 -0.66 -0.12 -1.83 -4.06 0.00 0.00 176.95 170.23 3duy s GLU 77 N -3.92 1.05 0.00 3.25 -1.05 -0.23 -1.49 118.70 116.32 3duy s GLU 77 Ca 0.12 -1.35 0.00 0.00 -0.15 0.00 0.00 54.97 53.58 3duy s GLU 77 Cb 0.04 -0.78 0.00 0.00 -0.44 0.00 0.00 34.13 32.95 3duy s GLU 77 CO -0.05 0.13 0.00 0.41 0.95 0.00 0.00 175.26 176.70 3duy n GLY 78 N 0.14 1.28 3.46 -3.83 0.00 -0.10 -1.88 105.19 104.27 3duy n GLY 78 Ca -0.13 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 44.80 3duy n GLY 78 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3duy s GLU 79 N -0.47 3.01 0.35 1.61 2.56 -0.64 -0.87 118.70 124.24 3duy s GLU 79 Ca 0.00 -0.64 -0.21 0.00 0.00 0.00 0.00 54.97 54.12 3duy s GLU 79 Cb 0.00 -2.58 -0.10 0.00 2.00 0.00 0.00 34.13 33.46 3duy s GLU 79 CO 0.00 0.44 0.88 -0.51 -0.56 0.00 0.00 175.26 175.51 3duy s LEU 80 N -0.24 4.14 0.00 2.70 1.43 -0.06 -0.93 118.68 125.72 3duy s LEU 80 Ca 0.02 1.63 -0.08 0.00 -1.03 0.00 0.00 54.13 54.67 3duy s LEU 80 Cb -0.13 -4.18 0.03 0.00 0.03 0.00 0.00 46.19 41.94 3duy s LEU 80 CO 0.03 -0.19 0.39 0.61 0.23 0.00 0.00 176.35 177.42 3duy n GLY 81 N -0.05 1.14 3.20 -3.19 0.00 -0.56 -1.71 105.19 104.01 3duy n GLY 81 Ca 0.04 -1.03 -0.13 0.00 0.00 0.00 0.00 46.02 44.89 3duy n GLY 81 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3duy s THR 82 N -2.42 0.95 0.16 2.61 -4.23 -0.06 -0.54 115.64 112.10 3duy s THR 82 Ca 0.09 -1.88 -0.24 0.00 -1.18 0.00 0.00 61.69 58.47 3duy s THR 82 Cb -0.01 -1.63 0.07 0.00 1.34 0.00 0.00 72.50 72.27 3duy s THR 82 CO 0.03 -0.72 1.00 -0.62 -0.54 0.00 0.00 174.62 173.77 3duy s ASP 83 N -2.88 -0.12 0.18 3.99 -1.08 -1.01 -0.90 116.67 114.85 3duy s ASP 83 Ca 0.11 -0.48 -0.26 0.00 -0.52 0.00 0.00 52.55 51.40 3duy s ASP 83 Cb 0.01 0.48 -0.08 0.00 -1.46 0.00 0.00 42.92 41.87 3duy s ASP 83 CO -0.01 -0.91 0.81 -0.76 0.52 0.00 0.00 175.17 174.82 3duy s LEU 84 N -3.07 4.61 -0.01 -1.34 1.43 -1.26 -1.67 118.68 117.37 3duy s LEU 84 Ca 0.15 1.71 0.02 0.00 -1.03 0.00 0.00 54.13 54.98 3duy s LEU 84 Cb -0.01 -3.36 0.00 0.00 0.03 0.00 0.00 46.19 42.84 3duy s LEU 84 CO 0.03 0.20 -0.06 -0.69 0.23 0.00 0.00 176.35 176.06 3duy s VAL 85 N -1.15 0.51 0.12 -1.59 1.01 0.69 -0.82 120.40 119.17 3duy s VAL 85 Ca 0.37 -0.24 0.04 0.00 0.00 0.00 0.00 61.98 62.14 3duy s VAL 85 Cb -0.24 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.65 3duy s VAL 85 CO 0.28 0.16 -0.10 -0.44 0.00 0.00 0.00 175.10 175.00 3duy s SER 86 N 0.06 1.59 -0.33 3.32 0.01 -0.42 -1.94 113.70 115.99 3duy s SER 86 Ca -0.00 -0.96 0.03 0.00 1.31 0.00 0.00 55.95 56.33 3duy s SER 86 Cb -0.05 0.01 0.10 0.00 0.21 0.00 0.00 66.02 66.29 3duy s SER 86 CO -0.00 -0.34 0.05 -0.63 0.41 0.00 0.00 173.24 172.73 3duy s ILE 87 N -3.15 2.07 0.23 1.44 1.01 -1.26 -1.26 121.20 120.28 3duy s ILE 87 Ca 0.13 -2.17 -0.06 0.00 0.00 0.00 0.00 60.65 58.55 3duy s ILE 87 Cb 0.02 -2.51 0.20 0.00 0.01 0.00 0.00 42.46 40.17 3duy s ILE 87 CO -0.01 -0.58 1.72 -0.65 0.00 0.00 0.00 174.94 175.43 3duy h PRO 88 N 7.69 0.35 -1.82 2.79 0.11 -1.90 0.13 132.00 139.34 3duy h PRO 88 Ca -0.06 -0.02 -0.74 0.00 0.11 0.00 0.00 66.00 65.29 3duy h PRO 88 Cb 1.02 -0.08 -0.29 0.00 0.11 0.00 0.00 31.00 31.76 3duy h PRO 88 CO 0.51 0.23 0.84 0.72 -0.21 0.00 0.00 178.00 180.09 3duy n HIS 89 N -5.06 3.05 -2.42 0.65 8.25 -1.26 -4.91 115.22 113.52 3duy n HIS 89 Ca 0.12 -2.48 0.00 0.00 -0.26 0.00 0.00 57.72 55.10 3duy n HIS 89 Cb 0.38 -1.09 0.00 0.00 1.12 0.00 0.00 29.99 30.40 3duy n HIS 89 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3duy n GLY 90 N -0.58 5.46 3.76 -1.41 0.00 0.44 -4.46 105.19 108.39 3duy n GLY 90 Ca 0.53 -1.35 -0.35 0.00 0.00 0.00 0.00 46.02 44.86 3duy n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3duy s PRO 91 N 1.58 2.80 -1.30 1.61 0.04 -1.26 -4.90 135.00 133.57 3duy s PRO 91 Ca 0.00 1.64 -0.15 0.00 0.04 0.00 0.00 61.00 62.53 3duy s PRO 91 Cb 0.00 -1.93 0.10 0.00 0.04 0.00 0.00 34.50 32.71 3duy s PRO 91 CO 0.00 -1.29 1.74 0.09 0.04 0.00 0.00 177.00 177.58 3duy n ASN 92 N -2.03 4.87 -3.95 6.66 3.02 -1.26 -4.62 115.26 117.95 3duy n ASN 92 Ca 0.12 -2.94 -0.09 0.00 -0.03 0.00 0.00 54.58 51.64 3duy n ASN 92 Cb 0.51 -1.66 -0.08 0.00 -0.61 0.00 0.00 39.78 37.94 3duy n ASN 92 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3duy s VAL 93 N 2.97 0.12 -0.06 2.41 -7.23 -1.26 -5.16 120.40 112.19 3duy s VAL 93 Ca 0.48 -1.40 0.02 0.00 -1.81 0.00 0.00 61.98 59.28 3duy s VAL 93 Cb 0.04 -1.61 0.01 0.00 0.56 0.00 0.00 36.38 35.38 3duy s VAL 93 CO 0.03 -0.54 -0.11 -0.89 -0.31 0.00 0.00 175.10 173.28 3duy s THR 94 N -3.93 1.02 0.10 5.32 2.01 -1.26 -4.47 115.64 114.43 3duy s THR 94 Ca 0.12 -0.42 0.08 0.00 0.31 0.00 0.00 61.69 61.77 3duy s THR 94 Cb 0.05 -0.94 -0.03 0.00 0.01 0.00 0.00 72.50 71.59 3duy s THR 94 CO -0.06 0.33 -0.19 0.68 -0.69 0.00 0.00 174.62 174.69 3duy s VAL 95 N 0.64 1.62 -0.28 3.82 -7.23 -0.82 -4.93 120.40 113.22 3duy s VAL 95 Ca -0.13 -1.55 -0.19 0.00 -1.81 0.00 0.00 61.98 58.30 3duy s VAL 95 Cb -0.15 -1.51 -0.02 0.00 0.56 0.00 0.00 36.38 35.26 3duy s VAL 95 CO 0.03 -0.12 0.57 -0.60 -0.31 0.00 0.00 175.10 174.67 3duy s ARG 96 N -1.99 3.97 0.17 4.82 3.52 -1.26 -0.22 118.95 127.95 3duy s ARG 96 Ca 0.06 0.30 0.07 0.00 -0.13 0.00 0.00 55.73 56.03 3duy s ARG 96 Cb -0.09 -3.69 -0.04 0.00 -1.56 0.00 0.00 34.95 29.56 3duy s ARG 96 CO 0.04 -0.47 -0.15 0.00 -0.81 0.00 0.00 175.30 173.92 3duy s ALA 97 N 2.45 1.80 0.26 6.12 0.00 -0.67 -4.93 121.76 126.80 3duy s ALA 97 Ca 0.23 -1.50 -0.30 0.00 0.00 0.00 0.00 51.96 50.40 3duy s ALA 97 Cb -0.15 -0.09 -0.10 0.00 0.00 0.00 0.00 23.12 22.78 3duy s ALA 97 CO 0.10 0.10 1.30 -0.80 0.00 0.00 0.00 175.76 176.46 3duy s ASN 98 N -2.91 6.86 -0.03 0.00 0.01 -1.26 -2.41 114.94 115.20 3duy s ASN 98 Ca 0.16 2.52 0.00 0.00 -0.71 0.00 0.00 52.86 54.84 3duy s ASN 98 Cb -0.03 -2.63 0.03 0.00 0.41 0.00 0.00 41.25 39.03 3duy s ASN 98 CO 0.05 -0.51 0.00 -0.63 -1.51 0.00 0.00 177.10 174.50 3duy s ILE 99 N -0.49 0.17 -0.30 0.60 1.01 0.30 -4.63 121.20 117.85 3duy s ILE 99 Ca 0.53 0.10 -0.19 0.00 0.00 0.00 0.00 60.65 61.09 3duy s ILE 99 Cb -0.38 -0.27 -0.01 0.00 0.01 0.00 0.00 42.46 41.80 3duy s ILE 99 CO 0.44 0.15 0.55 0.00 0.00 0.00 0.00 174.94 176.08 3duy s ALA 100 N 1.08 3.54 -0.46 9.38 0.00 -0.49 -1.50 121.76 133.31 3duy s ALA 100 Ca -0.09 -0.75 -0.27 0.00 0.00 0.00 0.00 51.96 50.86 3duy s ALA 100 Cb -0.13 -2.99 0.03 0.00 0.00 0.00 0.00 23.12 20.03 3duy s ALA 100 CO -0.02 -0.99 0.99 0.00 0.00 0.00 0.00 175.76 175.74 3duy s ALA 101 N 2.43 3.22 -0.18 0.00 0.00 -0.11 -1.57 121.76 125.56 3duy s ALA 101 Ca 0.21 -0.67 -0.29 0.00 0.00 0.00 0.00 51.96 51.21 3duy s ALA 101 Cb -0.15 -3.71 -0.01 0.00 0.00 0.00 0.00 23.12 19.25 3duy s ALA 101 CO 0.11 -2.08 1.15 0.42 0.00 0.00 0.00 175.76 175.36 3duy s ILE 102 N 3.94 4.47 -0.05 0.00 1.01 -0.11 -1.62 121.20 128.85 3duy s ILE 102 Ca 0.40 1.78 0.09 0.00 0.00 0.00 0.00 60.65 62.92 3duy s ILE 102 Cb -0.09 -4.15 -0.13 0.00 0.01 0.00 0.00 42.46 38.10 3duy s ILE 102 CO 0.27 -0.13 0.12 0.35 0.00 0.00 0.00 174.94 175.56 3duy n THR 103 N 5.22 0.27 -3.80 2.92 -2.24 -0.79 -1.77 114.28 114.10 3duy n THR 103 Ca 0.13 -0.28 -0.13 0.00 -2.27 0.00 0.00 64.05 61.50 3duy n THR 103 Cb 0.46 -0.20 -0.10 0.00 -2.10 0.00 0.00 70.33 68.39 3duy n THR 103 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3duy s GLU 104 N -2.44 0.51 0.18 -0.78 2.12 -1.11 -4.92 118.70 112.24 3duy s GLU 104 Ca -0.04 -0.07 -0.14 0.00 0.36 0.00 0.00 54.97 55.08 3duy s GLU 104 Cb 0.04 0.22 0.02 0.00 0.26 0.00 0.00 34.13 34.68 3duy s GLU 104 CO 0.37 -0.12 0.43 -1.54 -0.54 0.00 0.00 175.26 173.86 3duy s SER 105 N -0.88 -0.15 -0.18 -1.70 1.04 -1.26 -1.06 113.70 109.50 3duy s SER 105 Ca -0.10 -0.59 -0.04 0.00 0.48 0.00 0.00 55.95 55.71 3duy s SER 105 Cb -0.05 0.52 0.09 0.00 0.10 0.00 0.00 66.02 66.67 3duy s SER 105 CO 0.02 -0.97 0.24 -0.62 0.98 0.00 0.00 173.24 172.89 3duy s ASP 106 N -2.89 0.97 -1.64 7.02 3.68 -0.50 -4.88 116.67 118.42 3duy s ASP 106 Ca 0.11 0.07 0.00 0.00 2.13 0.00 0.00 52.55 54.85 3duy s ASP 106 Cb 0.01 0.52 0.00 0.00 -1.45 0.00 0.00 42.92 42.00 3duy s ASP 106 CO -0.03 -0.30 0.00 0.29 0.13 0.00 0.00 175.17 175.26 3duy n LYS 107 N 5.33 -1.78 -0.05 4.34 5.02 -1.26 -1.92 118.16 127.84 3duy n LYS 107 Ca -0.05 0.93 -0.05 0.00 -2.02 0.00 0.00 58.31 57.12 3duy n LYS 107 Cb 0.50 -5.55 -0.02 0.00 -0.02 0.00 0.00 35.03 29.94 3duy n LYS 107 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3duy n PHE 108 N -3.67 0.22 -2.16 2.13 7.35 -1.26 -3.80 117.46 116.27 3duy n PHE 108 Ca -0.22 0.10 -0.40 0.00 -0.76 0.00 0.00 57.45 56.17 3duy n PHE 108 Cb 0.66 -0.41 -0.02 0.00 0.35 0.00 0.00 39.48 40.07 3duy n PHE 108 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 3duy s PHE 109 N -2.04 3.00 -0.10 -5.13 0.40 -1.26 -5.01 117.98 107.84 3duy s PHE 109 Ca -0.15 1.46 -0.02 0.00 -0.60 0.00 0.00 56.93 57.62 3duy s PHE 109 Cb 0.02 -3.58 -0.03 0.00 0.51 0.00 0.00 43.02 39.93 3duy s PHE 109 CO 0.22 -1.74 -0.01 0.42 0.70 0.00 0.00 175.22 174.82 3duy s ILE 110 N -1.25 4.24 -0.08 0.64 -1.09 -1.26 -5.03 121.20 117.37 3duy s ILE 110 Ca 0.53 -0.27 -0.30 0.00 -2.23 0.00 0.00 60.65 58.39 3duy s ILE 110 Cb -0.36 -2.79 -0.04 0.00 -1.58 0.00 0.00 42.46 37.68 3duy s ILE 110 CO 0.47 0.58 1.48 0.21 -1.23 0.00 0.00 174.94 176.46 3duy s ASN 111 N -0.63 6.79 0.00 3.58 2.47 -1.26 -2.93 114.94 122.96 3duy s ASN 111 Ca 0.10 2.04 0.00 0.00 0.42 0.00 0.00 52.86 55.42 3duy s ASN 111 Cb -0.12 -2.54 0.00 0.00 -1.45 0.00 0.00 41.25 37.14 3duy s ASN 111 CO 0.02 -0.84 0.00 0.61 -3.72 0.00 0.00 177.10 173.17 3duy n GLY 112 N 3.88 0.49 0.08 1.21 0.00 -1.26 -4.94 105.19 104.65 3duy n GLY 112 Ca 0.15 -0.72 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 3duy n GLY 112 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3duy h SER 113 N 0.00 0.13 0.00 1.61 4.64 -1.87 -3.48 113.55 114.58 3duy h SER 113 Ca 0.00 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3duy h SER 113 Cb 0.00 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 3duy h SER 113 CO 0.00 1.14 0.00 -3.20 -0.87 0.00 0.00 176.83 173.90 3duy n ASN 114 N -3.32 -2.64 -4.55 4.97 4.05 -1.26 -4.58 115.26 107.92 3duy n ASN 114 Ca -0.08 0.00 -0.28 0.00 0.45 0.00 0.00 54.58 54.67 3duy n ASN 114 Cb 1.00 -0.44 -0.10 0.00 1.23 0.00 0.00 39.78 41.47 3duy n ASN 114 CO 0.00 0.00 0.00 -1.66 -3.05 0.00 0.00 177.26 172.55 3duy s TRP 115 N -2.23 2.63 0.00 1.20 1.48 -1.26 -4.64 118.94 116.11 3duy s TRP 115 Ca 0.00 -0.22 0.00 0.00 -1.06 0.00 0.00 56.10 54.82 3duy s TRP 115 Cb 0.00 -1.33 0.00 0.00 -1.16 0.00 0.00 33.47 30.98 3duy s TRP 115 CO 0.00 0.47 0.52 0.39 -4.06 0.00 0.00 176.95 174.27 3duy n GLU 116 N 0.36 -0.12 -3.64 3.25 4.71 0.28 -4.87 120.64 120.61 3duy n GLU 116 Ca -0.12 -0.61 -0.09 0.00 -0.01 0.00 0.00 57.16 56.32 3duy n GLU 116 Cb 0.54 -0.91 0.02 0.00 -1.01 0.00 0.00 31.44 30.08 3duy n GLU 116 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3duy n GLY 117 N -0.09 1.25 2.90 0.62 0.00 -1.12 -0.42 105.19 108.34 3duy n GLY 117 Ca 0.00 -1.31 -0.13 0.00 0.00 0.00 0.00 46.02 44.58 3duy n GLY 117 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3duy s ILE 118 N -2.28 0.14 -0.43 -0.61 2.07 0.10 -1.03 121.20 119.16 3duy s ILE 118 Ca 0.17 -0.10 -0.02 0.00 -1.41 0.00 0.00 60.65 59.29 3duy s ILE 118 Cb -0.04 -0.13 0.12 0.00 0.13 0.00 0.00 42.46 42.53 3duy s ILE 118 CO 0.13 0.03 0.23 -0.22 -1.91 0.00 0.00 174.94 173.19 3duy s LEU 119 N -0.08 5.22 -0.23 8.50 2.96 0.87 -1.63 118.68 134.29 3duy s LEU 119 Ca 0.00 -2.15 -0.29 0.00 -0.22 0.00 0.00 54.13 51.47 3duy s LEU 119 Cb -0.01 -1.82 -0.01 0.00 0.50 0.00 0.00 46.19 44.85 3duy s LEU 119 CO -0.00 -0.51 1.31 -0.83 -1.32 0.00 0.00 176.35 175.00 3duy s GLY 120 N 1.62 1.49 0.00 7.98 0.00 -0.64 -1.62 107.32 116.14 3duy s GLY 120 Ca 0.10 0.29 0.22 0.00 0.00 0.00 0.00 44.72 45.33 3duy s GLY 120 CO -0.04 2.58 1.24 1.04 0.00 0.00 0.00 173.10 177.92 3duy n LEU 121 N 7.24 2.97 0.00 0.66 4.77 -0.21 -4.31 117.00 128.12 3duy n LEU 121 Ca 0.15 -1.11 0.00 0.00 -0.03 0.00 0.00 56.01 55.02 3duy n LEU 121 Cb 0.46 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 3duy n LEU 121 CO 0.60 0.53 0.00 0.00 -1.33 0.00 0.00 177.39 177.19 3duy n ALA 122 N 1.29 0.00 -2.38 -1.18 0.00 0.28 -4.94 120.51 113.57 3duy n ALA 122 Ca 0.14 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.34 3duy n ALA 122 Cb 0.56 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.02 3duy n ALA 122 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3duy s TYR 123 N -0.52 3.32 0.56 0.00 1.51 -0.69 -4.66 117.35 116.86 3duy s TYR 123 Ca 0.00 0.33 0.24 0.00 -1.01 0.00 0.00 57.07 56.63 3duy s TYR 123 Cb 0.00 -2.24 1.57 0.00 -0.11 0.00 0.00 41.96 41.19 3duy s TYR 123 CO 0.00 -0.26 2.20 0.00 -1.11 0.00 0.00 175.55 176.38 3duy h ALA 124 N 0.44 1.76 -0.76 3.71 0.00 -1.87 -2.67 119.26 119.86 3duy h ALA 124 Ca -0.47 -0.00 0.20 0.00 0.00 0.00 0.00 54.91 54.64 3duy h ALA 124 Cb 1.24 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.99 3duy h ALA 124 CO 0.59 -0.02 0.53 1.49 0.00 0.00 0.00 179.25 181.84 3duy h GLU 125 N 0.00 0.10 -0.49 0.00 4.57 -1.86 -0.05 114.58 116.86 3duy h GLU 125 Ca 0.01 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3duy h GLU 125 Cb 0.03 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.60 3duy h GLU 125 CO -0.00 0.07 0.00 0.44 -1.18 0.00 0.00 179.01 178.34 3duy n ILE 126 N -4.36 1.27 -2.09 2.32 -5.35 -1.01 -4.70 119.36 105.45 3duy n ILE 126 Ca 0.15 -1.13 -0.38 0.00 -0.27 0.00 0.00 62.75 61.13 3duy n ILE 126 Cb 0.76 0.36 0.01 0.00 -1.74 0.00 0.00 39.64 39.03 3duy n ILE 126 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3duy s ALA 127 N -1.33 2.95 0.07 -1.28 0.00 -0.03 -4.65 121.76 117.50 3duy s ALA 127 Ca 0.36 1.09 0.03 0.00 0.00 0.00 0.00 51.96 53.45 3duy s ALA 127 Cb 0.21 -3.45 -0.04 0.00 0.00 0.00 0.00 23.12 19.84 3duy s ALA 127 CO 0.21 -0.90 0.06 1.03 0.00 0.00 0.00 175.76 176.16 3duy s ARG 128 N -2.71 2.82 0.48 0.00 1.81 -1.26 -3.09 118.95 116.99 3duy s ARG 128 Ca 0.65 -0.70 0.27 0.00 -1.72 0.00 0.00 55.73 54.23 3duy s ARG 128 Cb -0.33 -2.69 1.00 0.00 -0.45 0.00 0.00 34.95 32.48 3duy s ARG 128 CO 0.40 0.57 1.85 -1.00 -0.68 0.00 0.00 175.30 176.44 3duy h PRO 129 N 3.44 0.00 -2.99 3.54 0.13 -1.88 -3.47 132.00 130.76 3duy h PRO 129 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 3duy h PRO 129 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 3duy h PRO 129 CO 0.64 0.13 0.28 0.16 -0.23 0.00 0.00 178.00 178.98 3duy s ASP 130 N -6.02 -0.02 0.00 1.44 -4.77 -1.18 -5.04 116.67 101.09 3duy s ASP 130 Ca 0.01 -1.10 0.14 0.00 -3.30 0.00 0.00 52.55 48.31 3duy s ASP 130 Cb 0.09 0.84 0.83 0.00 -1.09 0.00 0.00 42.92 43.59 3duy s ASP 130 CO 0.61 -1.65 1.33 -0.90 0.70 0.00 0.00 175.17 175.25 3duy n ASP 131 N -1.33 0.00 0.02 2.11 5.68 -1.25 -2.00 116.55 119.77 3duy n ASP 131 Ca -0.08 -0.95 0.13 0.00 -0.50 0.00 0.00 54.79 53.39 3duy n ASP 131 Cb 0.60 0.00 0.37 0.00 -1.14 0.00 0.00 41.12 40.95 3duy n ASP 131 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3duy n SER 132 N -0.81 0.39 -4.53 -1.12 3.41 -1.26 -4.66 113.62 105.03 3duy n SER 132 Ca 0.10 0.12 -0.42 0.00 -0.26 0.00 0.00 58.87 58.42 3duy n SER 132 Cb 0.05 -0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 63.87 3duy n SER 132 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3duy s LEU 133 N -3.31 3.70 0.06 1.04 2.96 -0.85 -4.99 118.68 117.29 3duy s LEU 133 Ca 0.11 -0.40 -0.30 0.00 -0.22 0.00 0.00 54.13 53.32 3duy s LEU 133 Cb 0.17 -2.74 -0.09 0.00 0.50 0.00 0.00 46.19 44.03 3duy s LEU 133 CO 0.64 -1.53 1.80 -0.70 -1.32 0.00 0.00 176.35 175.24 3duy s GLU 134 N 4.79 4.16 0.75 1.98 2.12 -1.26 -4.90 118.70 126.34 3duy s GLU 134 Ca 0.33 2.48 -0.12 0.00 0.36 0.00 0.00 54.97 58.02 3duy s GLU 134 Cb -0.11 -3.82 0.05 0.00 0.26 0.00 0.00 34.13 30.52 3duy s GLU 134 CO 0.18 -0.85 1.11 -2.14 -0.54 0.00 0.00 175.26 173.01 3duy s PRO 135 N 3.40 2.28 0.17 4.30 0.02 -1.26 -4.50 135.00 139.41 3duy s PRO 135 Ca 0.80 1.30 -0.15 0.00 0.02 0.00 0.00 61.00 62.97 3duy s PRO 135 Cb -0.42 -1.89 0.13 0.00 0.02 0.00 0.00 34.50 32.34 3duy s PRO 135 CO 0.36 -1.64 1.70 0.35 -0.33 0.00 0.00 177.00 177.43 3duy h PHE 136 N -0.83 -0.02 -0.27 6.54 3.57 -1.81 -2.36 116.94 121.76 3duy h PHE 136 Ca -0.45 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.00 3duy h PHE 136 Cb 1.24 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 3duy h PHE 136 CO 0.56 -0.08 -0.19 0.35 -2.23 0.00 0.00 178.31 176.71 3duy h PHE 137 N 0.11 0.53 -0.85 0.41 3.57 -1.92 0.37 116.94 119.16 3duy h PHE 137 Ca 0.21 -0.10 -0.01 0.00 3.53 0.00 0.00 57.97 61.60 3duy h PHE 137 Cb 0.30 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.86 3duy h PHE 137 CO -0.28 0.65 0.49 -0.44 -2.23 0.00 0.00 178.31 176.50 3duy h ASP 138 N 0.43 1.05 -0.36 0.41 3.32 -1.83 -0.86 116.42 118.58 3duy h ASP 138 Ca 0.07 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 3duy h ASP 138 Cb 0.59 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3duy h ASP 138 CO 0.04 0.83 0.10 0.28 -1.72 0.00 0.00 179.24 178.77 3duy h SER 139 N 1.18 0.54 -0.07 6.45 0.02 -0.80 -1.11 113.55 119.76 3duy h SER 139 Ca 0.30 -0.22 0.03 0.00 -0.84 0.00 0.00 61.79 61.06 3duy h SER 139 Cb -0.00 -0.14 -0.04 0.00 0.14 0.00 0.00 62.40 62.36 3duy h SER 139 CO -0.05 0.62 -0.15 0.25 -1.14 0.00 0.00 176.83 176.36 3duy h LEU 140 N 0.43 -0.45 -1.13 5.07 5.85 -0.59 -0.07 115.31 124.43 3duy h LEU 140 Ca 0.11 0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.84 3duy h LEU 140 Cb 0.28 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3duy h LEU 140 CO -0.00 -0.20 -0.15 0.58 -0.34 0.00 0.00 178.44 178.33 3duy h VAL 141 N -0.21 1.23 -0.04 1.05 2.07 -1.12 -1.71 116.25 117.53 3duy h VAL 141 Ca 0.07 -1.02 -0.21 0.00 0.82 0.00 0.00 66.70 66.37 3duy h VAL 141 Cb 0.32 1.20 -0.00 0.00 -1.52 0.00 0.00 31.29 31.28 3duy h VAL 141 CO -0.19 0.33 -0.85 0.50 0.02 0.00 0.00 177.57 177.37 3duy h LYS 142 N 0.40 0.41 0.00 1.57 3.64 -0.61 -3.33 116.57 118.66 3duy h LYS 142 Ca 0.07 -0.40 0.00 0.00 -1.27 0.00 0.00 60.65 59.06 3duy h LYS 142 Cb 0.50 0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.42 3duy h LYS 142 CO 0.03 1.05 -1.05 1.04 -2.27 0.00 0.00 179.45 178.25 3duy n GLN 143 N -3.78 0.29 -2.60 1.90 6.02 -0.09 -4.98 117.38 114.13 3duy n GLN 143 Ca -0.06 -0.01 -0.07 0.00 -0.01 0.00 0.00 57.00 56.86 3duy n GLN 143 Cb 0.78 -1.59 -0.02 0.00 1.02 0.00 0.00 30.24 30.43 3duy n GLN 143 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3duy n THR 144 N -1.97 0.00 0.39 5.09 -2.24 -0.66 -5.04 114.28 109.86 3duy n THR 144 Ca 0.02 -0.59 0.11 0.00 -2.27 0.00 0.00 64.05 61.33 3duy n THR 144 Cb 0.44 0.19 0.25 0.00 -2.10 0.00 0.00 70.33 69.11 3duy n THR 144 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3duy n HIS 145 N -0.24 0.53 -1.72 4.78 8.25 -1.26 -4.81 115.22 120.75 3duy n HIS 145 Ca -0.02 -0.26 -0.42 0.00 -0.26 0.00 0.00 57.72 56.75 3duy n HIS 145 Cb 0.15 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.23 3duy n HIS 145 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3duy s VAL 146 N -1.47 2.50 0.70 1.59 1.01 -1.26 -4.95 120.40 118.51 3duy s VAL 146 Ca 0.39 0.05 -0.16 0.00 0.00 0.00 0.00 61.98 62.26 3duy s VAL 146 Cb 0.22 -3.03 0.02 0.00 0.00 0.00 0.00 36.38 33.59 3duy s VAL 146 CO 0.30 0.00 1.22 -2.84 0.00 0.00 0.00 175.10 173.78 3duy s PRO 147 N 2.62 2.28 -1.46 2.72 0.02 -1.26 -4.64 135.00 135.28 3duy s PRO 147 Ca 0.80 1.82 -0.12 0.00 0.02 0.00 0.00 61.00 63.52 3duy s PRO 147 Cb -0.46 -1.84 0.04 0.00 0.02 0.00 0.00 34.50 32.25 3duy s PRO 147 CO 0.36 -1.74 2.35 -1.71 -0.33 0.00 0.00 177.00 175.93 3duy n ASN 148 N -2.48 5.52 -3.52 2.53 5.15 -1.26 -4.34 115.26 116.86 3duy n ASN 148 Ca 0.14 -2.85 -0.09 0.00 -0.60 0.00 0.00 54.58 51.18 3duy n ASN 148 Cb 0.50 -1.58 -0.03 0.00 -0.53 0.00 0.00 39.78 38.14 3duy n ASN 148 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 3duy s LEU 149 N 1.00 -0.37 0.17 1.20 2.34 -1.26 -1.64 118.68 120.12 3duy s LEU 149 Ca 0.51 0.12 -0.06 0.00 0.06 0.00 0.00 54.13 54.77 3duy s LEU 149 Cb 0.14 1.99 -0.02 0.00 -0.56 0.00 0.00 46.19 47.74 3duy s LEU 149 CO -0.07 -0.55 0.22 0.72 -1.06 0.00 0.00 176.35 175.62 3duy s PHE 150 N -2.57 0.66 0.02 3.48 -0.71 -1.00 -0.62 117.98 117.25 3duy s PHE 150 Ca 0.03 -1.00 -0.01 0.00 -1.04 0.00 0.00 56.93 54.91 3duy s PHE 150 Cb -0.01 -0.24 -0.02 0.00 -1.21 0.00 0.00 43.02 41.55 3duy s PHE 150 CO -0.06 -0.68 -0.01 -1.54 -1.34 0.00 0.00 175.22 171.59 3duy s SER 151 N -3.03 0.21 -0.09 1.98 1.04 -0.44 -0.24 113.70 113.12 3duy s SER 151 Ca 0.24 -0.45 0.02 0.00 0.48 0.00 0.00 55.95 56.24 3duy s SER 151 Cb 0.05 0.11 0.01 0.00 0.10 0.00 0.00 66.02 66.29 3duy s SER 151 CO 0.04 -0.29 -0.14 -0.76 0.98 0.00 0.00 173.24 173.07 3duy s LEU 152 N -1.39 1.65 -0.34 2.42 1.43 0.44 -1.20 118.68 121.68 3duy s LEU 152 Ca -0.15 -0.37 -0.01 0.00 -1.03 0.00 0.00 54.13 52.57 3duy s LEU 152 Cb -0.09 -0.97 0.08 0.00 0.03 0.00 0.00 46.19 45.23 3duy s LEU 152 CO -0.01 0.01 0.07 -1.58 0.23 0.00 0.00 176.35 175.08 3duy s GLN 153 N 0.91 2.12 -0.26 1.70 0.74 0.05 -1.50 119.66 123.42 3duy s GLN 153 Ca -0.09 -1.55 -0.11 0.00 0.05 0.00 0.00 55.36 53.65 3duy s GLN 153 Cb -0.15 -3.30 -0.05 0.00 1.10 0.00 0.00 33.01 30.61 3duy s GLN 153 CO 0.00 -0.82 0.18 -0.51 -0.55 0.00 0.00 175.29 173.60 3duy s LEU 154 N 1.15 4.07 -0.19 3.68 1.43 -1.26 -0.36 118.68 127.20 3duy s LEU 154 Ca 0.02 0.07 -0.06 0.00 -1.03 0.00 0.00 54.13 53.13 3duy s LEU 154 Cb -0.21 -2.13 -0.03 0.00 0.03 0.00 0.00 46.19 43.85 3duy s LEU 154 CO -0.03 0.00 0.02 0.00 0.23 0.00 0.00 176.35 176.56 3duy s GLY 156 N 0.70 1.47 0.00 0.00 0.00 -1.26 -3.64 107.32 104.59 3duy s GLY 156 Ca 0.01 -0.93 0.00 0.00 0.00 0.00 0.00 44.72 43.80 3duy s GLY 156 CO 0.02 2.01 0.00 1.44 0.00 0.00 0.00 173.10 176.57 3duy n SER 169 N 7.20 0.00 -4.34 1.64 7.64 -1.26 -4.89 113.62 119.60 3duy n SER 169 Ca 0.05 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.74 3duy n SER 169 Cb 0.48 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.58 3duy n SER 169 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 3duy s VAL 170 N 0.00 1.72 0.19 0.44 -7.23 -0.03 -4.88 120.40 110.61 3duy s VAL 170 Ca 0.00 -2.15 0.04 0.00 -1.81 0.00 0.00 61.98 58.06 3duy s VAL 170 Cb 0.00 -1.99 -0.01 0.00 0.56 0.00 0.00 36.38 34.93 3duy s VAL 170 CO 0.00 -0.56 0.14 0.61 -0.31 0.00 0.00 175.10 174.98 3duy n GLY 171 N -0.25 3.47 0.00 2.32 0.00 -1.24 -0.04 105.19 109.45 3duy n GLY 171 Ca -0.09 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.09 3duy n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3duy n GLY 172 N -0.14 -1.26 3.02 -0.02 0.00 -0.95 -1.06 105.19 104.79 3duy n GLY 172 Ca 0.03 -0.95 -0.19 0.00 0.00 0.00 0.00 46.02 44.90 3duy n GLY 172 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3duy s SER 173 N -4.00 1.10 -0.32 1.61 0.01 0.52 -1.69 113.70 110.93 3duy s SER 173 Ca 0.00 -0.17 -0.01 0.00 1.31 0.00 0.00 55.95 57.08 3duy s SER 173 Cb 0.00 -0.15 0.07 0.00 0.21 0.00 0.00 66.02 66.15 3duy s SER 173 CO 0.00 0.11 0.03 -0.32 0.41 0.00 0.00 173.24 173.46 3duy s MET 174 N -0.15 2.23 -0.42 12.44 1.75 -1.26 -0.77 119.30 133.12 3duy s MET 174 Ca 0.02 -1.44 -0.22 0.00 -1.25 0.00 0.00 55.69 52.80 3duy s MET 174 Cb -0.04 -3.21 0.02 0.00 2.84 0.00 0.00 34.83 34.43 3duy s MET 174 CO -0.00 -0.73 0.73 0.42 -0.65 0.00 0.00 175.02 174.80 3duy s ILE 175 N 1.17 4.74 -0.33 10.11 -1.09 -0.34 -4.87 121.20 130.59 3duy s ILE 175 Ca -0.02 0.47 -0.19 0.00 -2.23 0.00 0.00 60.65 58.69 3duy s ILE 175 Cb -0.20 -4.24 -0.01 0.00 -1.58 0.00 0.00 42.46 36.43 3duy s ILE 175 CO -0.03 -0.58 0.56 -0.63 -1.23 0.00 0.00 174.94 173.03 3duy s ILE 176 N 3.08 4.99 0.00 2.92 1.01 -1.26 -1.33 121.20 130.61 3duy s ILE 176 Ca 0.28 0.58 0.00 0.00 0.00 0.00 0.00 60.65 61.51 3duy s ILE 176 Cb -0.13 -3.96 0.00 0.00 0.01 0.00 0.00 42.46 38.38 3duy s ILE 176 CO 0.20 -0.16 0.00 0.61 0.00 0.00 0.00 174.94 175.58 3duy n GLY 177 N 4.63 0.86 0.00 6.18 0.00 0.21 -4.82 105.19 112.26 3duy n GLY 177 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 3duy n GLY 177 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3duy n GLY 178 N -2.08 -0.79 3.08 -0.02 0.00 -1.23 -4.42 105.19 99.73 3duy n GLY 178 Ca 0.00 -0.75 -0.27 0.00 0.00 0.00 0.00 46.02 45.01 3duy n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3duy s ILE 179 N -3.00 1.39 -0.28 -0.61 1.01 -1.26 -4.05 121.20 114.39 3duy s ILE 179 Ca 0.00 -0.63 -0.06 0.00 0.00 0.00 0.00 60.65 59.97 3duy s ILE 179 Cb 0.00 -1.24 0.01 0.00 0.01 0.00 0.00 42.46 41.24 3duy s ILE 179 CO 0.00 0.41 0.05 -0.62 0.00 0.00 0.00 174.94 174.78 3duy s ASP 180 N 0.59 4.97 0.40 3.58 3.68 -1.26 -5.00 116.67 123.63 3duy s ASP 180 Ca -0.16 -0.71 0.28 0.00 2.13 0.00 0.00 52.55 54.10 3duy s ASP 180 Cb -0.16 -1.84 1.24 0.00 -1.45 0.00 0.00 42.92 40.71 3duy s ASP 180 CO 0.05 -0.17 1.85 0.45 0.13 0.00 0.00 175.17 177.48 3duy h HIS 181 N 8.19 0.00 0.00 -5.34 3.86 -2.00 -2.02 115.15 117.84 3duy h HIS 181 Ca -0.32 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.89 3duy h HIS 181 Cb 1.13 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.60 3duy h HIS 181 CO 0.61 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 178.27 3duy n SER 182 N -2.60 0.33 -0.10 2.45 3.41 -1.26 -3.19 113.62 112.66 3duy n SER 182 Ca 0.01 0.56 0.13 0.00 -0.26 0.00 0.00 58.87 59.31 3duy n SER 182 Cb 0.22 -0.64 0.39 0.00 -0.26 0.00 0.00 64.21 63.93 3duy n SER 182 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3duy n LEU 183 N -1.85 0.62 -3.93 1.04 4.77 -0.76 -4.73 117.00 112.16 3duy n LEU 183 Ca 0.04 -0.04 -0.09 0.00 -0.03 0.00 0.00 56.01 55.90 3duy n LEU 183 Cb 0.27 -0.22 -0.08 0.00 -2.33 0.00 0.00 43.42 41.06 3duy n LEU 183 CO 0.21 0.13 -0.12 -0.72 -1.33 0.00 0.00 177.39 175.56 3duy s TYR 184 N -2.74 0.30 0.24 -1.77 1.13 -1.19 -0.86 117.35 112.45 3duy s TYR 184 Ca 0.19 -0.72 0.11 0.00 -1.41 0.00 0.00 57.07 55.23 3duy s TYR 184 Cb 0.19 -0.13 -0.05 0.00 -1.10 0.00 0.00 41.96 40.87 3duy s TYR 184 CO 0.58 -0.56 -0.19 0.95 -2.51 0.00 0.00 175.55 173.82 3duy s THR 185 N -3.90 2.23 0.00 -3.49 -4.23 -0.45 -4.81 115.64 100.98 3duy s THR 185 Ca 0.09 -2.26 0.00 0.00 -1.18 0.00 0.00 61.69 58.34 3duy s THR 185 Cb 0.05 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.72 3duy s THR 185 CO -0.08 -0.39 0.00 0.61 -0.54 0.00 0.00 174.62 174.22 3duy n GLY 186 N -0.34 -1.02 3.92 3.99 0.00 -1.26 -3.71 105.19 106.77 3duy n GLY 186 Ca -0.08 -1.21 -0.28 0.00 0.00 0.00 0.00 46.02 44.45 3duy n GLY 186 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3duy s SER 187 N -4.00 6.41 0.07 1.61 0.01 -1.26 -4.98 113.70 111.56 3duy s SER 187 Ca 0.00 0.46 -0.26 0.00 1.31 0.00 0.00 55.95 57.46 3duy s SER 187 Cb 0.00 -2.03 -0.06 0.00 0.21 0.00 0.00 66.02 64.14 3duy s SER 187 CO 0.00 -0.04 0.81 -0.76 0.41 0.00 0.00 173.24 173.66 3duy s LEU 188 N -3.23 4.48 -0.09 2.44 1.43 -1.26 -4.51 118.68 117.94 3duy s LEU 188 Ca 0.39 1.54 0.04 0.00 -1.03 0.00 0.00 54.13 55.07 3duy s LEU 188 Cb -0.11 -3.31 -0.01 0.00 0.03 0.00 0.00 46.19 42.79 3duy s LEU 188 CO 0.28 0.02 -0.21 0.26 0.23 0.00 0.00 176.35 176.94 3duy s TRP 189 N -0.18 2.59 -0.03 0.29 0.52 -0.21 -4.91 118.94 117.01 3duy s TRP 189 Ca 0.40 -0.76 0.02 0.00 0.02 0.00 0.00 56.10 55.78 3duy s TRP 189 Cb -0.21 -1.69 -0.03 0.00 -1.15 0.00 0.00 33.47 30.38 3duy s TRP 189 CO 0.25 -0.24 -0.07 0.71 0.02 0.00 0.00 176.95 177.61 3duy s TYR 190 N 0.06 2.90 0.02 -1.98 1.51 -1.26 -0.36 117.35 118.24 3duy s TYR 190 Ca -0.09 -0.02 0.07 0.00 -1.01 0.00 0.00 57.07 56.02 3duy s TYR 190 Cb -0.15 -1.65 -0.02 0.00 -0.11 0.00 0.00 41.96 40.02 3duy s TYR 190 CO 0.06 0.34 -0.22 -0.08 -1.11 0.00 0.00 175.55 174.54 3duy s THR 191 N -0.90 1.74 0.40 -0.71 -1.32 -0.17 -3.92 115.64 110.75 3duy s THR 191 Ca 0.15 -1.12 -0.26 0.00 -1.21 0.00 0.00 61.69 59.25 3duy s THR 191 Cb -0.11 -1.48 -0.09 0.00 -1.51 0.00 0.00 72.50 69.31 3duy s THR 191 CO 0.04 0.33 1.31 -2.84 -2.21 0.00 0.00 174.62 171.25 3duy s PRO 192 N -0.94 3.99 -0.34 7.08 0.02 -1.26 -0.78 135.00 142.77 3duy s PRO 192 Ca 0.08 2.18 -0.29 0.00 0.02 0.00 0.00 61.00 62.99 3duy s PRO 192 Cb -0.09 -2.78 0.01 0.00 0.02 0.00 0.00 34.50 31.66 3duy s PRO 192 CO 0.01 -0.48 1.19 0.42 -0.33 0.00 0.00 177.00 177.81 3duy s ILE 193 N -1.25 4.28 0.19 2.83 1.01 -0.56 -4.59 121.20 123.11 3duy s ILE 193 Ca 0.56 1.43 -0.09 0.00 0.00 0.00 0.00 60.65 62.55 3duy s ILE 193 Cb -0.38 -4.33 0.09 0.00 0.01 0.00 0.00 42.46 37.84 3duy s ILE 193 CO 0.50 -0.58 1.68 -0.09 0.00 0.00 0.00 174.94 176.45 3duy h ARG 194 N 8.89 1.10 -2.37 2.79 2.43 -1.28 -3.44 114.38 122.50 3duy h ARG 194 Ca -0.24 -0.29 -0.08 0.00 -0.81 0.00 0.00 59.98 58.56 3duy h ARG 194 Cb 1.08 -0.13 -0.22 0.00 -0.42 0.00 0.00 29.97 30.28 3duy h ARG 194 CO 1.05 1.01 -0.04 0.50 -1.51 0.00 0.00 179.97 180.98 3duy s ARG 195 N -5.21 0.70 -1.13 0.20 3.52 -1.26 -5.09 118.95 110.69 3duy s ARG 195 Ca -0.12 0.67 -0.17 0.00 -0.13 0.00 0.00 55.73 55.98 3duy s ARG 195 Cb 0.14 0.34 0.13 0.00 -1.56 0.00 0.00 34.95 34.00 3duy s ARG 195 CO 0.85 -0.11 1.41 -1.21 -0.81 0.00 0.00 175.30 175.43 3duy s GLU 196 N 0.04 3.89 0.00 5.12 2.02 -1.26 -4.14 118.70 124.37 3duy s GLU 196 Ca -0.02 -2.09 0.00 0.00 0.02 0.00 0.00 54.97 52.88 3duy s GLU 196 Cb -0.04 -5.15 0.00 0.00 0.10 0.00 0.00 34.13 29.05 3duy s GLU 196 CO 0.02 -1.91 0.00 -2.67 0.02 0.00 0.00 175.26 170.72 3duy n TRP 197 N 6.76 0.00 -1.22 1.61 4.27 -1.26 -4.60 117.44 123.00 3duy n TRP 197 Ca 0.35 0.00 -0.29 0.00 -3.89 0.00 0.00 57.50 53.67 3duy n TRP 197 Cb 0.46 0.00 0.18 0.00 -1.36 0.00 0.00 31.31 30.59 3duy n TRP 197 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 3duy s TYR 198 N 0.00 2.03 -1.18 -2.67 2.02 -1.26 -1.71 117.35 114.59 3duy s TYR 198 Ca 0.00 0.91 -0.20 0.00 -0.37 0.00 0.00 57.07 57.40 3duy s TYR 198 Cb 0.00 -3.31 0.05 0.00 -0.40 0.00 0.00 41.96 38.30 3duy s TYR 198 CO 0.00 -2.93 1.64 0.71 -1.57 0.00 0.00 175.55 173.40 3duy s TYR 199 N -3.03 2.62 -0.03 2.71 1.51 -1.26 -4.84 117.35 115.03 3duy s TYR 199 Ca 0.66 -1.17 -0.20 0.00 -1.01 0.00 0.00 57.07 55.35 3duy s TYR 199 Cb -0.17 -4.68 -0.05 0.00 -0.11 0.00 0.00 41.96 36.94 3duy s TYR 199 CO 0.57 -1.83 0.55 -2.00 -1.11 0.00 0.00 175.55 171.73 3duy s GLU 200 N 4.70 4.29 0.33 -0.62 2.12 -1.26 -2.09 118.70 126.17 3duy s GLU 200 Ca 0.52 0.65 0.03 0.00 0.36 0.00 0.00 54.97 56.53 3duy s GLU 200 Cb 0.02 -3.36 -0.05 0.00 0.26 0.00 0.00 34.13 31.01 3duy s GLU 200 CO 0.01 0.34 0.10 0.14 -0.54 0.00 0.00 175.26 175.31 3duy s VAL 201 N -0.05 0.81 -0.18 3.70 -7.23 -0.29 -0.76 120.40 116.39 3duy s VAL 201 Ca 0.29 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.47 3duy s VAL 201 Cb -0.17 -2.61 0.02 0.00 0.56 0.00 0.00 36.38 34.17 3duy s VAL 201 CO 0.15 0.00 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.12 3duy s ILE 202 N -3.40 2.16 -0.15 -0.62 1.01 -1.26 -4.06 121.20 114.88 3duy s ILE 202 Ca 0.33 -0.91 -0.21 0.00 0.00 0.00 0.00 60.65 59.86 3duy s ILE 202 Cb 0.06 -1.91 -0.03 0.00 0.01 0.00 0.00 42.46 40.59 3duy s ILE 202 CO 0.15 0.53 0.64 -0.63 0.00 0.00 0.00 174.94 175.63 3duy s ILE 203 N 1.29 5.04 -0.75 2.92 1.01 -1.26 -1.86 121.20 127.59 3duy s ILE 203 Ca 0.05 1.25 0.14 0.00 0.00 0.00 0.00 60.65 62.09 3duy s ILE 203 Cb -0.13 -3.97 -0.14 0.00 0.01 0.00 0.00 42.46 38.23 3duy s ILE 203 CO -0.12 0.17 0.63 1.33 0.00 0.00 0.00 174.94 176.95 3duy n VAL 204 N 4.30 0.00 -3.57 2.92 0.24 0.38 -4.76 118.33 117.84 3duy n VAL 204 Ca -0.02 -0.18 -0.12 0.00 -2.04 0.00 0.00 64.34 61.99 3duy n VAL 204 Cb 0.50 1.02 -0.05 0.00 -1.47 0.00 0.00 33.84 33.84 3duy n VAL 204 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3duy s ARG 205 N -2.30 0.66 -0.04 7.34 3.52 -1.21 -4.86 118.95 122.06 3duy s ARG 205 Ca 0.06 0.17 0.02 0.00 -0.13 0.00 0.00 55.73 55.85 3duy s ARG 205 Cb 0.11 0.31 0.01 0.00 -1.56 0.00 0.00 34.95 33.82 3duy s ARG 205 CO 0.57 -0.20 -0.09 0.08 -0.81 0.00 0.00 175.30 174.85 3duy s VAL 206 N -1.10 0.81 -0.03 7.11 1.01 -1.26 -1.35 120.40 125.59 3duy s VAL 206 Ca -0.03 -0.33 0.06 0.00 0.00 0.00 0.00 61.98 61.68 3duy s VAL 206 Cb -0.00 -0.75 -0.01 0.00 0.00 0.00 0.00 36.38 35.62 3duy s VAL 206 CO 0.03 0.27 -0.20 -1.61 0.00 0.00 0.00 175.10 173.59 3duy s GLU 207 N 0.50 1.74 -0.08 2.72 2.02 -0.54 -1.56 118.70 123.51 3duy s GLU 207 Ca -0.08 -0.70 0.03 0.00 0.02 0.00 0.00 54.97 54.24 3duy s GLU 207 Cb -0.12 -1.62 0.00 0.00 0.10 0.00 0.00 34.13 32.50 3duy s GLU 207 CO 0.01 0.38 -0.18 0.42 0.02 0.00 0.00 175.26 175.91 3duy s ILE 208 N -0.31 1.59 -1.70 -1.63 1.01 -0.47 -0.70 121.20 118.99 3duy s ILE 208 Ca 0.04 -0.76 0.00 0.00 0.00 0.00 0.00 60.65 59.93 3duy s ILE 208 Cb -0.09 -1.40 0.00 0.00 0.01 0.00 0.00 42.46 40.98 3duy s ILE 208 CO 0.00 0.46 0.00 -3.20 0.00 0.00 0.00 174.94 172.20 3duy n ASN 209 N 3.58 -5.63 0.00 3.58 5.15 -0.67 -1.91 115.26 119.36 3duy n ASN 209 Ca -0.20 0.01 0.00 0.00 -0.60 0.00 0.00 54.58 53.78 3duy n ASN 209 Cb 0.52 -4.67 0.00 0.00 -0.53 0.00 0.00 39.78 35.10 3duy n ASN 209 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3duy n GLY 210 N -1.00 1.12 3.38 8.20 0.00 -1.26 -5.01 105.19 110.63 3duy n GLY 210 Ca -0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 3duy n GLY 210 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3duy s GLN 211 N -0.18 3.00 0.32 1.61 -0.21 -0.80 -5.03 119.66 118.36 3duy s GLN 211 Ca 0.00 -0.72 -0.29 0.00 0.02 0.00 0.00 55.36 54.37 3duy s GLN 211 Cb 0.00 -2.48 -0.11 0.00 1.00 0.00 0.00 33.01 31.42 3duy s GLN 211 CO 0.00 0.36 1.42 0.34 -2.12 0.00 0.00 175.29 175.29 3duy s ASP 212 N -0.05 6.58 0.17 5.90 3.68 -1.26 -1.37 116.67 130.33 3duy s ASP 212 Ca -0.04 2.81 0.23 0.00 2.13 0.00 0.00 52.55 57.68 3duy s ASP 212 Cb -0.14 -2.65 0.90 0.00 -1.45 0.00 0.00 42.92 39.58 3duy s ASP 212 CO 0.04 -0.71 1.70 0.18 0.13 0.00 0.00 175.17 176.51 3duy n LEU 213 N 1.28 0.50 -3.85 -1.34 4.77 -0.60 -4.90 117.00 112.85 3duy n LEU 213 Ca 0.03 0.59 -0.25 0.00 -0.03 0.00 0.00 56.01 56.35 3duy n LEU 213 Cb 0.40 -0.49 0.01 0.00 -2.33 0.00 0.00 43.42 41.01 3duy n LEU 213 CO 0.61 -0.35 -0.07 0.29 -1.33 0.00 0.00 177.39 176.55 3duy n LYS 214 N -2.02 -4.51 -4.10 3.23 5.02 -1.26 -4.98 118.16 109.54 3duy n LYS 214 Ca 0.04 0.54 -0.24 0.00 -2.02 0.00 0.00 58.31 56.62 3duy n LYS 214 Cb 0.28 -5.07 -0.05 0.00 -0.02 0.00 0.00 35.03 30.16 3duy n LYS 214 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3duy s MET 215 N -6.34 2.90 -0.01 1.97 -1.94 -1.26 -5.07 119.30 109.54 3duy s MET 215 Ca 0.21 -0.95 -0.34 0.00 -1.71 0.00 0.00 55.69 52.90 3duy s MET 215 Cb -0.11 -2.61 -0.12 0.00 2.01 0.00 0.00 34.83 34.01 3duy s MET 215 CO 0.84 0.45 1.82 -3.47 -0.01 0.00 0.00 175.02 174.65 3duy n ASP 216 N -0.67 3.44 0.29 3.03 -0.08 -1.26 -4.84 116.55 116.46 3duy n ASP 216 Ca -0.08 0.99 0.19 0.00 -1.51 0.00 0.00 54.79 54.39 3duy n ASP 216 Cb 0.56 -1.40 0.93 0.00 2.34 0.00 0.00 41.12 43.55 3duy n ASP 216 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3duy h LYS 218 N 0.00 0.00 -0.16 0.00 1.57 -1.82 -1.72 116.57 114.44 3duy h LYS 218 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 3duy h LYS 218 Cb 0.22 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 3duy h LYS 218 CO 0.00 0.00 -0.10 0.93 -0.57 0.00 0.00 179.45 179.71 3duy h GLU 219 N 0.00 0.25 0.00 3.15 4.39 -0.97 -2.10 114.58 119.30 3duy h GLU 219 Ca 0.07 -0.05 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 3duy h GLU 219 Cb 0.27 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 3duy h GLU 219 CO -0.00 0.36 -0.19 1.88 -1.16 0.00 0.00 179.01 179.91 3duy h TYR 220 N 0.24 0.00 -0.01 4.33 0.99 -1.45 -3.15 116.97 117.93 3duy h TYR 220 Ca 0.05 0.00 -0.00 0.00 2.00 0.00 0.00 58.73 60.78 3duy h TYR 220 Cb 0.33 0.00 -0.00 0.00 1.00 0.00 0.00 36.73 38.06 3duy h TYR 220 CO 0.01 0.19 -0.40 0.09 -0.00 0.00 0.00 178.16 178.04 3duy n ASN 221 N -3.70 1.84 -4.53 3.88 3.02 -0.82 -4.43 115.26 110.53 3duy n ASN 221 Ca -0.01 -3.76 -0.41 0.00 -0.03 0.00 0.00 54.58 50.37 3duy n ASN 221 Cb 0.30 -0.51 -0.10 0.00 -0.61 0.00 0.00 39.78 38.86 3duy n ASN 221 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3duy s TYR 222 N -3.17 3.21 -2.12 3.10 5.04 -1.03 -0.99 117.35 121.39 3duy s TYR 222 Ca 0.37 -0.15 0.21 0.00 -2.44 0.00 0.00 57.07 55.06 3duy s TYR 222 Cb 0.35 -2.64 0.43 0.00 0.35 0.00 0.00 41.96 40.46 3duy s TYR 222 CO -0.05 -0.45 1.38 -0.40 -1.34 0.00 0.00 175.55 174.69 3duy n ASP 223 N 5.32 3.42 -3.59 4.32 5.75 -1.26 -3.50 116.55 127.01 3duy n ASP 223 Ca -0.10 -1.96 -0.08 0.00 -0.01 0.00 0.00 54.79 52.64 3duy n ASP 223 Cb 0.49 -0.28 -0.02 0.00 -1.03 0.00 0.00 41.12 40.28 3duy n ASP 223 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 3duy s LYS 224 N -1.29 1.09 -0.08 0.11 -2.85 -0.16 -4.79 119.74 111.77 3duy s LYS 224 Ca 0.37 -0.49 0.04 0.00 -1.00 0.00 0.00 55.97 54.89 3duy s LYS 224 Cb 0.21 0.45 0.00 0.00 -2.06 0.00 0.00 37.83 36.43 3duy s LYS 224 CO 0.29 -0.49 -0.19 -1.12 0.10 0.00 0.00 175.35 173.94 3duy s SER 225 N -2.69 2.50 0.12 0.03 0.01 -1.26 -0.41 113.70 112.00 3duy s SER 225 Ca 0.07 -0.44 0.04 0.00 1.31 0.00 0.00 55.95 56.93 3duy s SER 225 Cb -0.02 -1.04 -0.04 0.00 0.21 0.00 0.00 66.02 65.14 3duy s SER 225 CO -0.05 0.12 -0.10 0.27 0.41 0.00 0.00 173.24 173.89 3duy s ILE 226 N 0.36 1.08 -0.25 1.44 -4.36 -0.62 -1.14 121.20 117.70 3duy s ILE 226 Ca -0.14 -1.85 -0.10 0.00 -0.26 0.00 0.00 60.65 58.30 3duy s ILE 226 Cb -0.16 -1.61 -0.05 0.00 1.25 0.00 0.00 42.46 41.89 3duy s ILE 226 CO 0.06 -0.64 0.16 -0.69 0.24 0.00 0.00 174.94 174.07 3duy s VAL 227 N -2.85 5.27 -0.26 8.37 1.01 -0.89 -0.66 120.40 130.39 3duy s VAL 227 Ca 0.11 0.15 -0.03 0.00 0.00 0.00 0.00 61.98 62.21 3duy s VAL 227 Cb -0.00 -3.47 0.09 0.00 0.00 0.00 0.00 36.38 32.99 3duy s VAL 227 CO 0.00 0.31 0.10 -0.62 0.00 0.00 0.00 175.10 174.90 3duy s ASP 228 N 1.32 3.35 0.49 3.32 2.15 -0.76 -4.36 116.67 122.18 3duy s ASP 228 Ca 0.07 -1.18 0.33 0.00 0.43 0.00 0.00 52.55 52.20 3duy s ASP 228 Cb -0.14 -0.48 1.68 0.00 -0.30 0.00 0.00 42.92 43.68 3duy s ASP 228 CO 0.07 -0.40 2.00 0.77 -0.17 0.00 0.00 175.17 177.44 3duy h SER 229 N 8.32 0.00 -0.33 -0.34 4.64 -1.84 -2.40 113.55 121.60 3duy h SER 229 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 3duy h SER 229 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 3duy h SER 229 CO 0.41 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.98 3duy n GLY 230 N -0.81 1.01 3.48 -0.77 0.00 -1.26 -4.65 105.19 102.19 3duy n GLY 230 Ca -0.01 -0.55 -0.33 0.00 0.00 0.00 0.00 46.02 45.13 3duy n GLY 230 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3duy s THR 231 N -1.58 3.48 -0.03 2.61 2.01 -0.90 -5.00 115.64 116.23 3duy s THR 231 Ca 0.34 -0.53 -0.26 0.00 0.31 0.00 0.00 61.69 61.55 3duy s THR 231 Cb 0.19 -2.46 -0.21 0.00 0.01 0.00 0.00 72.50 70.03 3duy s THR 231 CO 0.27 0.55 1.21 0.74 -0.69 0.00 0.00 174.62 176.70 3duy h THR 232 N 4.85 1.40 -3.94 -0.82 2.02 -1.87 0.27 112.91 114.81 3duy h THR 232 Ca -0.37 -1.24 -0.48 0.00 0.77 0.00 0.00 66.41 65.10 3duy h THR 232 Cb 1.19 2.23 0.07 0.00 -1.74 0.00 0.00 68.15 69.90 3duy h THR 232 CO 0.56 0.32 0.26 0.20 0.37 0.00 0.00 175.52 177.23 3duy s ASN 233 N -5.72 5.36 -0.33 4.18 0.01 -1.26 -1.53 114.94 115.65 3duy s ASN 233 Ca -0.16 0.79 -0.27 0.00 -0.71 0.00 0.00 52.86 52.50 3duy s ASN 233 Cb 0.01 -1.64 0.01 0.00 0.41 0.00 0.00 41.25 40.04 3duy s ASN 233 CO 0.67 -1.27 0.99 -0.22 -1.51 0.00 0.00 177.10 175.76 3duy s LEU 234 N -5.16 3.97 -0.14 0.60 2.96 -0.76 -2.35 118.68 117.79 3duy s LEU 234 Ca 0.56 0.86 -0.04 0.00 -0.22 0.00 0.00 54.13 55.30 3duy s LEU 234 Cb -0.11 -3.40 -0.03 0.00 0.50 0.00 0.00 46.19 43.15 3duy s LEU 234 CO 0.47 -0.84 -0.02 -0.13 -1.32 0.00 0.00 176.35 174.51 3duy s ARG 235 N 3.51 3.54 0.04 1.98 0.52 -0.60 -1.51 118.95 126.43 3duy s ARG 235 Ca 0.42 -0.48 0.08 0.00 -0.52 0.00 0.00 55.73 55.22 3duy s ARG 235 Cb -0.12 -2.91 -0.03 0.00 0.52 0.00 0.00 34.95 32.41 3duy s ARG 235 CO 0.16 0.35 -0.22 -0.51 0.02 0.00 0.00 175.30 175.10 3duy s LEU 236 N 0.09 2.16 0.51 2.53 1.43 0.05 -0.79 118.68 124.66 3duy s LEU 236 Ca 0.00 -0.53 -0.21 0.00 -1.03 0.00 0.00 54.13 52.37 3duy s LEU 236 Cb -0.13 -1.04 -0.08 0.00 0.03 0.00 0.00 46.19 44.97 3duy s LEU 236 CO 0.02 0.18 0.94 -2.65 0.23 0.00 0.00 176.35 175.08 3duy n PRO 237 N 1.88 1.09 -0.32 1.29 -0.02 -1.26 -0.40 135.00 137.26 3duy n PRO 237 Ca -0.17 0.40 -0.04 0.00 -2.02 0.00 0.00 63.50 61.67 3duy n PRO 237 Cb 0.53 -2.06 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 3duy n PRO 237 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3duy h LYS 238 N 0.98 -0.07 -0.32 -0.52 3.64 -1.89 0.27 116.57 118.66 3duy h LYS 238 Ca -0.46 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 3duy h LYS 238 Cb 1.35 0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.17 3duy h LYS 238 CO 0.53 -0.05 0.20 -0.22 -2.27 0.00 0.00 179.45 177.65 3duy h LYS 239 N -0.08 0.43 -0.62 1.90 3.64 -1.92 -1.74 116.57 118.18 3duy h LYS 239 Ca 0.27 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.54 3duy h LYS 239 Cb 0.56 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 3duy h LYS 239 CO -0.87 0.31 0.10 0.28 -2.27 0.00 0.00 179.45 177.01 3duy h VAL 240 N 0.42 1.26 -0.68 2.00 2.07 -1.41 -2.34 116.25 117.58 3duy h VAL 240 Ca 0.12 -1.01 0.04 0.00 0.82 0.00 0.00 66.70 66.66 3duy h VAL 240 Cb -0.02 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 30.42 3duy h VAL 240 CO -0.02 0.37 0.41 0.15 0.02 0.00 0.00 177.57 178.50 3duy h PHE 241 N 0.94 0.77 -0.38 1.57 3.57 -0.22 -0.44 116.94 122.74 3duy h PHE 241 Ca 0.19 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.67 3duy h PHE 241 Cb 0.43 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 3duy h PHE 241 CO 0.03 0.43 0.07 0.93 -2.23 0.00 0.00 178.31 177.54 3duy h GLU 242 N 0.80 0.62 -0.77 1.11 5.08 -1.01 -0.41 114.58 120.00 3duy h GLU 242 Ca 0.28 -0.16 -0.03 0.00 -1.00 0.00 0.00 59.36 58.45 3duy h GLU 242 Cb 0.06 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 3duy h GLU 242 CO -0.12 0.67 0.35 0.00 -1.00 0.00 0.00 179.01 178.91 3duy h ALA 243 N 0.93 1.18 -0.20 3.43 0.00 -1.15 -1.31 119.26 122.13 3duy h ALA 243 Ca 0.12 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 3duy h ALA 243 Cb 0.34 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3duy h ALA 243 CO 0.01 0.62 -0.15 0.00 0.00 0.00 0.00 179.25 179.72 3duy h ALA 244 N 1.29 0.28 -0.77 0.00 0.00 -0.72 -2.27 119.26 117.07 3duy h ALA 244 Ca 0.26 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3duy h ALA 244 Cb 0.13 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 3duy h ALA 244 CO -0.03 0.17 0.29 0.28 0.00 0.00 0.00 179.25 179.95 3duy h VAL 245 N 0.12 1.26 -0.81 0.00 2.07 -0.98 -0.81 116.25 117.11 3duy h VAL 245 Ca 0.04 -0.85 0.01 0.00 0.82 0.00 0.00 66.70 66.72 3duy h VAL 245 Cb 0.67 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 3duy h VAL 245 CO 0.04 0.34 0.54 0.50 0.02 0.00 0.00 177.57 179.01 3duy h LYS 246 N 1.14 1.06 -0.12 1.57 3.64 -1.15 0.20 116.57 122.92 3duy h LYS 246 Ca 0.26 -0.06 -0.17 0.00 -1.27 0.00 0.00 60.65 59.40 3duy h LYS 246 Cb 0.25 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 3duy h LYS 246 CO -0.02 0.70 -0.66 1.03 -2.27 0.00 0.00 179.45 178.24 3duy h SER 247 N 1.10 0.53 0.27 4.20 0.87 -1.06 -2.47 113.55 116.99 3duy h SER 247 Ca 0.30 -0.32 -0.21 0.00 -1.23 0.00 0.00 61.79 60.33 3duy h SER 247 Cb -0.12 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.69 3duy h SER 247 CO -0.07 1.04 -0.86 0.40 -0.53 0.00 0.00 176.83 176.82 3duy h ILE 248 N 0.33 1.38 -0.23 2.23 2.04 -0.69 -2.59 117.51 119.98 3duy h ILE 248 Ca -0.02 -2.31 0.01 0.00 1.00 0.00 0.00 64.86 63.54 3duy h ILE 248 Cb 1.22 2.28 -0.01 0.00 -0.74 0.00 0.00 36.82 39.57 3duy h ILE 248 CO 0.12 0.69 0.13 0.11 0.00 0.00 0.00 178.15 179.20 3duy h LYS 249 N 0.27 0.27 -0.65 2.37 1.57 -0.60 -2.43 116.57 117.36 3duy h LYS 249 Ca -0.06 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 3duy h LYS 249 Cb 1.48 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.69 3duy h LYS 249 CO 0.15 0.18 0.37 0.00 -0.57 0.00 0.00 179.45 179.57 3duy h ALA 250 N 1.10 1.42 0.00 3.86 0.00 -1.39 0.15 119.26 124.40 3duy h ALA 250 Ca 0.09 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 3duy h ALA 250 Cb -0.01 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3duy h ALA 250 CO -0.04 0.48 -0.51 0.00 0.00 0.00 0.00 179.25 179.18 3duy h ALA 251 N 1.50 0.95 -0.40 0.00 0.00 -1.28 -3.15 119.26 116.88 3duy h ALA 251 Ca 0.23 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.68 3duy h ALA 251 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3duy h ALA 251 CO -0.04 0.64 0.00 -1.13 0.00 0.00 0.00 179.25 178.72 3duy n SER 252 N -3.63 3.76 0.32 0.00 3.41 -0.76 -4.63 113.62 112.08 3duy n SER 252 Ca -0.01 -2.45 0.20 0.00 -0.26 0.00 0.00 58.87 56.35 3duy n SER 252 Cb 0.58 -0.43 1.07 0.00 -0.26 0.00 0.00 64.21 65.17 3duy n SER 252 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3duy h SER 253 N 2.54 0.00 -0.97 4.04 4.64 -0.95 -0.75 113.55 122.09 3duy h SER 253 Ca 0.00 0.00 0.21 0.00 -0.47 0.00 0.00 61.79 61.53 3duy h SER 253 Cb 1.16 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 63.14 3duy h SER 253 CO 0.14 0.00 0.56 0.74 -0.87 0.00 0.00 176.83 177.39 3duy h THR 254 N 0.00 0.62 -1.62 2.95 2.02 -1.86 -3.42 112.91 111.59 3duy h THR 254 Ca 0.00 -0.22 -0.50 0.00 0.77 0.00 0.00 66.41 66.46 3duy h THR 254 Cb 0.16 -0.08 -0.04 0.00 -1.74 0.00 0.00 68.15 66.46 3duy h THR 254 CO 0.00 0.12 -0.41 -1.61 0.37 0.00 0.00 175.52 173.98 3duy s GLU 255 N -5.84 2.54 -0.04 6.66 2.02 -0.29 -5.13 118.70 118.62 3duy s GLU 255 Ca -0.11 -1.50 0.06 0.00 0.02 0.00 0.00 54.97 53.43 3duy s GLU 255 Cb 0.25 -2.36 -0.01 0.00 0.10 0.00 0.00 34.13 32.12 3duy s GLU 255 CO 0.79 -0.10 -0.22 0.21 0.02 0.00 0.00 175.26 175.96 3duy s LYS 256 N -4.06 2.12 0.10 1.61 2.47 -1.26 -5.00 119.74 115.73 3duy s LYS 256 Ca 0.45 -0.80 0.06 0.00 -1.56 0.00 0.00 55.97 54.12 3duy s LYS 256 Cb -0.03 -1.88 -0.03 0.00 -1.46 0.00 0.00 37.83 34.42 3duy s LYS 256 CO 0.27 0.38 -0.14 -0.06 0.16 0.00 0.00 175.35 175.95 3duy s PHE 257 N -0.23 1.35 0.53 4.03 0.40 -1.26 -5.13 117.98 117.67 3duy s PHE 257 Ca 0.00 -0.52 -0.22 0.00 -0.60 0.00 0.00 56.93 55.59 3duy s PHE 257 Cb -0.12 -0.73 -0.06 0.00 0.51 0.00 0.00 43.02 42.63 3duy s PHE 257 CO 0.02 0.11 1.30 -2.30 0.70 0.00 0.00 175.22 175.05 3duy n PRO 258 N 0.82 1.65 0.20 0.24 -0.02 -1.26 -4.89 135.00 131.74 3duy n PRO 258 Ca -0.18 0.60 0.14 0.00 -2.02 0.00 0.00 63.50 62.05 3duy n PRO 258 Cb 0.56 -2.49 0.54 0.00 -0.02 0.00 0.00 33.50 32.08 3duy n PRO 258 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 3duy h ASP 259 N 1.44 0.00 1.30 2.55 1.82 -2.00 -1.63 116.42 119.91 3duy h ASP 259 Ca -0.50 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.14 3duy h ASP 259 Cb 1.31 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.32 3duy h ASP 259 CO 0.57 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 178.81 3duy n GLY 260 N 0.23 -1.61 0.19 -0.78 0.00 -1.26 -3.12 105.19 98.84 3duy n GLY 260 Ca 0.02 0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 3duy n GLY 260 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3duy h PHE 261 N 0.00 0.61 0.00 1.61 3.57 -1.41 0.97 116.94 122.29 3duy h PHE 261 Ca 0.00 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.41 3duy h PHE 261 Cb 0.65 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.22 3duy h PHE 261 CO 0.00 0.65 0.00 0.91 -2.23 0.00 0.00 178.31 177.64 3duy n TRP 262 N -4.57 0.73 1.00 0.41 7.02 -1.18 -1.17 117.44 119.68 3duy n TRP 262 Ca -0.02 0.27 0.12 0.00 -1.02 0.00 0.00 57.50 56.86 3duy n TRP 262 Cb 0.23 -0.94 0.26 0.00 -2.42 0.00 0.00 31.31 28.44 3duy n TRP 262 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 3duy n LEU 263 N -2.15 2.57 0.00 -0.99 4.77 -1.09 -4.94 117.00 115.16 3duy n LEU 263 Ca 0.03 -0.95 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 3duy n LEU 263 Cb 0.25 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.27 3duy n LEU 263 CO 0.21 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.35 3duy n GLY 264 N 1.31 0.93 0.07 -0.72 0.00 -0.31 -4.91 105.19 101.56 3duy n GLY 264 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 3duy n GLY 264 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3duy h GLU 265 N 2.97 0.00 -5.96 1.61 5.08 -1.06 -3.45 114.58 113.76 3duy h GLU 265 Ca 0.00 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.75 3duy h GLU 265 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 3duy h GLU 265 CO 0.00 0.77 -0.34 -0.65 -1.00 0.00 0.00 179.01 177.79 3duy s GLN 266 N -2.10 3.63 0.17 2.33 -0.21 -0.49 -4.95 119.66 118.05 3duy s GLN 266 Ca -0.16 -0.00 0.03 0.00 0.02 0.00 0.00 55.36 55.25 3duy s GLN 266 Cb -0.01 -3.06 -0.03 0.00 1.00 0.00 0.00 33.01 30.91 3duy s GLN 266 CO 0.53 0.62 0.29 -0.48 -2.12 0.00 0.00 175.29 174.14 3duy s LEU 267 N -1.80 4.31 0.07 2.90 2.34 -1.26 -3.95 118.68 121.28 3duy s LEU 267 Ca 0.29 0.13 0.07 0.00 0.06 0.00 0.00 54.13 54.69 3duy s LEU 267 Cb -0.13 -2.88 -0.04 0.00 -0.56 0.00 0.00 46.19 42.58 3duy s LEU 267 CO 0.17 0.03 -0.15 0.54 -1.06 0.00 0.00 176.35 175.87 3duy s VAL 268 N -1.80 3.01 0.19 1.48 0.11 -0.67 -4.91 120.40 117.82 3duy s VAL 268 Ca 0.34 -1.26 0.07 0.00 -2.93 0.00 0.00 61.98 58.21 3duy s VAL 268 Cb -0.11 -2.34 -0.05 0.00 -1.53 0.00 0.00 36.38 32.36 3duy s VAL 268 CO 0.28 0.22 -0.14 0.00 -3.33 0.00 0.00 175.10 172.14 3duy s TRP 270 N -2.96 0.46 0.43 0.00 0.51 -0.05 -4.98 118.94 112.35 3duy s TRP 270 Ca 0.21 -0.98 -0.25 0.00 -2.12 0.00 0.00 56.10 52.96 3duy s TRP 270 Cb -0.01 -0.33 -0.10 0.00 -0.81 0.00 0.00 33.47 32.23 3duy s TRP 270 CO 0.06 -0.41 1.15 0.94 -0.51 0.00 0.00 176.95 178.18 3duy n GLN 271 N 0.07 1.64 -1.57 4.98 7.27 -1.26 -0.93 117.38 127.58 3duy n GLN 271 Ca -0.14 0.59 -0.51 0.00 0.07 0.00 0.00 57.00 57.00 3duy n GLN 271 Cb 0.61 -2.23 -0.06 0.00 2.41 0.00 0.00 30.24 30.97 3duy n GLN 271 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3duy n ALA 272 N -0.39 0.79 0.00 1.69 0.00 -1.26 -1.26 120.51 120.08 3duy n ALA 272 Ca 0.08 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.63 3duy n ALA 272 Cb 0.40 -2.48 0.00 0.00 0.00 0.00 0.00 19.45 17.36 3duy n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3duy n GLY 273 N 5.50 0.55 0.49 0.00 0.00 -1.26 -4.95 105.19 105.52 3duy n GLY 273 Ca 0.33 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.40 3duy n GLY 273 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3duy n THR 274 N -1.77 1.26 -1.68 2.61 -2.24 -0.39 -5.01 114.28 107.07 3duy n THR 274 Ca 0.00 -1.22 -0.46 0.00 -2.27 0.00 0.00 64.05 60.10 3duy n THR 274 Cb 0.00 0.33 -0.04 0.00 -2.10 0.00 0.00 70.33 68.52 3duy n THR 274 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3duy n THR 275 N -0.02 0.58 -1.23 4.28 -1.04 -1.26 -4.83 114.28 110.77 3duy n THR 275 Ca 0.11 -0.10 -0.36 0.00 -2.04 0.00 0.00 64.05 61.65 3duy n THR 275 Cb 0.47 -1.99 -0.02 0.00 -1.82 0.00 0.00 70.33 66.97 3duy n THR 275 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3duy n PRO 276 N 6.60 2.74 -0.07 -2.82 -0.04 -1.26 -4.71 135.00 135.44 3duy n PRO 276 Ca 0.21 -2.04 0.19 0.00 -0.04 0.00 0.00 63.50 61.83 3duy n PRO 276 Cb 0.33 -2.84 0.64 0.00 -0.04 0.00 0.00 33.50 31.59 3duy n PRO 276 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3duy h TRP 277 N 6.03 0.15 0.00 0.54 4.06 -1.96 -2.28 115.95 122.49 3duy h TRP 277 Ca 0.64 0.00 -0.03 0.00 2.06 0.00 0.00 58.89 61.56 3duy h TRP 277 Cb 0.39 -0.05 -0.00 0.00 -1.00 0.00 0.00 29.16 28.50 3duy h TRP 277 CO 1.71 0.06 -0.15 -2.95 -3.56 0.00 0.00 178.44 173.54 3duy h ASN 278 N 0.13 0.00 0.86 -3.49 -0.00 -2.00 -2.38 115.58 108.69 3duy h ASN 278 Ca 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.61 3duy h ASN 278 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.35 3duy h ASN 278 CO -0.04 0.15 -0.07 2.30 -0.00 0.00 0.00 177.43 179.77 3duy n ILE 279 N -4.29 0.00 -3.60 6.14 -5.35 -0.86 -4.73 119.36 106.66 3duy n ILE 279 Ca -0.02 -0.00 -0.36 0.00 -0.27 0.00 0.00 62.75 62.09 3duy n ILE 279 Cb 0.22 -0.38 -0.08 0.00 -1.74 0.00 0.00 39.64 37.67 3duy n ILE 279 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 3duy s PHE 280 N -2.93 3.43 0.68 4.28 0.08 -0.90 -3.33 117.98 119.29 3duy s PHE 280 Ca 0.16 0.48 -0.12 0.00 0.12 0.00 0.00 56.93 57.57 3duy s PHE 280 Cb 0.19 -2.28 0.00 0.00 -0.57 0.00 0.00 43.02 40.36 3duy s PHE 280 CO 0.54 0.24 1.06 -1.25 -0.10 0.00 0.00 175.22 175.71 3duy s PRO 281 N 0.50 2.93 0.31 0.24 0.04 -1.26 -4.74 135.00 133.02 3duy s PRO 281 Ca 0.13 1.05 -0.17 0.00 0.04 0.00 0.00 61.00 62.06 3duy s PRO 281 Cb -0.12 -1.99 -0.09 0.00 0.04 0.00 0.00 34.50 32.34 3duy s PRO 281 CO 0.02 -1.11 0.75 0.14 0.04 0.00 0.00 177.00 176.84 3duy s VAL 282 N -2.87 4.62 -0.12 -0.36 -7.23 -1.26 -4.30 120.40 108.87 3duy s VAL 282 Ca 0.60 1.09 0.01 0.00 -1.81 0.00 0.00 61.98 61.86 3duy s VAL 282 Cb -0.15 -3.67 -0.01 0.00 0.56 0.00 0.00 36.38 33.10 3duy s VAL 282 CO 0.51 -0.10 -0.15 -0.63 -0.31 0.00 0.00 175.10 174.41 3duy s ILE 283 N -1.89 2.84 -0.21 -0.62 1.01 -0.91 -1.67 121.20 119.76 3duy s ILE 283 Ca 0.52 -0.74 -0.02 0.00 0.00 0.00 0.00 60.65 60.41 3duy s ILE 283 Cb -0.12 -2.17 -0.00 0.00 0.01 0.00 0.00 42.46 40.18 3duy s ILE 283 CO 0.18 0.53 -0.09 -0.44 0.00 0.00 0.00 174.94 175.13 3duy s SER 284 N 0.34 3.99 -0.25 3.58 0.01 0.12 -1.29 113.70 120.21 3duy s SER 284 Ca -0.13 -0.45 -0.10 0.00 1.31 0.00 0.00 55.95 56.58 3duy s SER 284 Cb -0.16 -1.67 -0.05 0.00 0.21 0.00 0.00 66.02 64.35 3duy s SER 284 CO 0.06 -0.01 0.14 -0.76 0.41 0.00 0.00 173.24 173.09 3duy s LEU 285 N 1.38 3.93 -0.16 2.44 1.43 -0.67 -1.46 118.68 125.57 3duy s LEU 285 Ca 0.05 0.01 -0.15 0.00 -1.03 0.00 0.00 54.13 53.01 3duy s LEU 285 Cb -0.14 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.97 3duy s LEU 285 CO -0.05 0.02 0.33 -0.31 0.23 0.00 0.00 176.35 176.57 3duy s TYR 286 N 1.32 3.45 0.05 0.29 1.51 -0.46 -1.21 117.35 122.30 3duy s TYR 286 Ca 0.07 0.63 0.05 0.00 -1.01 0.00 0.00 57.07 56.80 3duy s TYR 286 Cb -0.15 -2.40 -0.04 0.00 -0.11 0.00 0.00 41.96 39.27 3duy s TYR 286 CO 0.06 0.19 -0.08 -0.51 -1.11 0.00 0.00 175.55 174.10 3duy s LEU 287 N 0.63 3.12 0.25 -1.29 1.43 0.20 -0.47 118.68 122.56 3duy s LEU 287 Ca 0.18 -0.24 -0.31 0.00 -1.03 0.00 0.00 54.13 52.73 3duy s LEU 287 Cb -0.13 -1.84 -0.13 0.00 0.03 0.00 0.00 46.19 44.11 3duy s LEU 287 CO 0.05 0.24 1.40 0.80 0.23 0.00 0.00 176.35 179.07 3duy n MET 288 N 1.20 2.05 -0.21 1.70 0.00 -0.78 -2.41 117.12 118.67 3duy n MET 288 Ca -0.14 0.73 0.00 0.00 -0.00 0.00 0.00 57.70 58.29 3duy n MET 288 Cb 0.52 -2.38 0.00 0.00 0.00 0.00 0.00 33.22 31.36 3duy n MET 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3duy n GLY 289 N 2.06 1.55 0.00 -5.12 0.00 0.02 -4.10 105.19 99.61 3duy n GLY 289 Ca 0.11 -2.01 0.09 0.00 0.00 0.00 0.00 46.02 44.21 3duy n GLY 289 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3duy n GLU 290 N -0.24 0.81 -4.38 1.61 -0.58 -1.25 -4.50 120.64 112.10 3duy n GLU 290 Ca 0.00 -0.08 -0.26 0.00 -0.42 0.00 0.00 57.16 56.40 3duy n GLU 290 Cb 0.00 -1.40 -0.09 0.00 -0.57 0.00 0.00 31.44 29.38 3duy n GLU 290 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 3duy s VAL 291 N -2.97 2.13 0.20 2.62 -7.23 -1.26 -5.08 120.40 108.80 3duy s VAL 291 Ca 0.01 -1.85 -0.32 0.00 -1.81 0.00 0.00 61.98 58.01 3duy s VAL 291 Cb 0.13 -2.98 -0.12 0.00 0.56 0.00 0.00 36.38 33.97 3duy s VAL 291 CO 0.76 0.00 1.71 -0.89 -0.31 0.00 0.00 175.10 176.38 3duy s THR 292 N -2.66 2.11 -2.09 5.32 2.01 -1.26 -2.19 115.64 116.88 3duy s THR 292 Ca 0.37 0.06 0.00 0.00 0.31 0.00 0.00 61.69 62.43 3duy s THR 292 Cb 0.07 -3.04 0.00 0.00 0.01 0.00 0.00 72.50 69.54 3duy s THR 292 CO 0.20 0.00 0.00 0.59 -0.69 0.00 0.00 174.62 174.72 3duy n ASN 293 N 4.08 -5.45 -4.41 3.53 5.03 -1.26 -4.97 115.26 111.81 3duy n ASN 293 Ca 0.16 0.45 -0.33 0.00 0.87 0.00 0.00 54.58 55.73 3duy n ASN 293 Cb 0.36 -4.69 -0.14 0.00 -1.02 0.00 0.00 39.78 34.28 3duy n ASN 293 CO 0.00 0.00 0.00 -1.58 -1.83 0.00 0.00 177.26 173.85 3duy s GLN 294 N -3.83 3.14 0.45 3.52 -0.44 -0.93 -1.12 119.66 120.46 3duy s GLN 294 Ca 0.00 -0.68 0.03 0.00 -2.50 0.00 0.00 55.36 52.21 3duy s GLN 294 Cb 0.00 -2.57 -0.02 0.00 -1.64 0.00 0.00 33.01 28.78 3duy s GLN 294 CO 0.00 0.33 0.08 -1.54 0.50 0.00 0.00 175.29 174.67 3duy s SER 295 N 0.04 3.34 0.24 6.67 1.04 0.18 -0.80 113.70 124.41 3duy s SER 295 Ca -0.04 -1.68 -0.04 0.00 0.48 0.00 0.00 55.95 54.67 3duy s SER 295 Cb -0.14 0.53 -0.02 0.00 0.10 0.00 0.00 66.02 66.48 3duy s SER 295 CO 0.04 -0.91 0.28 0.72 0.98 0.00 0.00 173.24 174.35 3duy s PHE 296 N -3.07 0.98 0.05 5.02 -0.12 -1.01 -0.68 117.98 119.16 3duy s PHE 296 Ca 0.16 -1.22 0.05 0.00 -0.05 0.00 0.00 56.93 55.88 3duy s PHE 296 Cb 0.02 -0.32 -0.02 0.00 -0.63 0.00 0.00 43.02 42.07 3duy s PHE 296 CO 0.10 -0.81 -0.15 -0.98 -0.05 0.00 0.00 175.22 173.33 3duy s ARG 297 N -3.94 0.93 -0.08 1.99 1.70 -0.33 -0.63 118.95 118.59 3duy s ARG 297 Ca 0.34 -0.84 0.02 0.00 -0.47 0.00 0.00 55.73 54.77 3duy s ARG 297 Cb 0.04 -0.95 -0.02 0.00 -0.57 0.00 0.00 34.95 33.44 3duy s ARG 297 CO 0.13 0.23 -0.12 0.96 -1.08 0.00 0.00 175.30 175.43 3duy s ILE 298 N -0.98 3.24 -0.14 4.99 -4.36 -0.35 -1.21 121.20 122.38 3duy s ILE 298 Ca 0.01 -0.64 0.01 0.00 -0.26 0.00 0.00 60.65 59.77 3duy s ILE 298 Cb -0.09 -2.32 -0.00 0.00 1.25 0.00 0.00 42.46 41.31 3duy s ILE 298 CO 0.02 0.57 -0.17 -0.89 0.24 0.00 0.00 174.94 174.71 3duy s THR 299 N -0.37 2.56 0.17 8.37 2.01 -0.09 -1.67 115.64 126.62 3duy s THR 299 Ca 0.04 -0.82 0.07 0.00 0.31 0.00 0.00 61.69 61.30 3duy s THR 299 Cb -0.12 -2.06 -0.04 0.00 0.01 0.00 0.00 72.50 70.29 3duy s THR 299 CO 0.02 0.53 0.01 0.27 -0.69 0.00 0.00 174.62 174.76 3duy s ILE 300 N 0.70 3.79 0.30 1.82 -4.36 -0.41 -2.85 121.20 120.18 3duy s ILE 300 Ca -0.08 -1.37 0.07 0.00 -0.26 0.00 0.00 60.65 59.01 3duy s ILE 300 Cb -0.16 -2.90 -0.03 0.00 1.25 0.00 0.00 42.46 40.63 3duy s ILE 300 CO 0.01 -0.09 0.28 -0.76 0.24 0.00 0.00 174.94 174.62 3duy s LEU 301 N -2.90 3.79 0.58 0.37 1.43 -1.26 -2.13 118.68 118.55 3duy s LEU 301 Ca 0.27 -0.32 0.27 0.00 -1.03 0.00 0.00 54.13 53.33 3duy s LEU 301 Cb -0.10 -2.38 1.69 0.00 0.03 0.00 0.00 46.19 45.43 3duy s LEU 301 CO 0.19 -0.22 2.18 1.55 0.23 0.00 0.00 176.35 180.28 3duy h PRO 302 N 1.29 0.00 0.00 1.29 0.13 -1.85 0.10 132.00 132.96 3duy h PRO 302 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3duy h PRO 302 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 3duy h PRO 302 CO 0.59 0.00 0.00 1.96 -0.23 0.00 0.00 178.00 180.32 3duy h GLN 303 N 0.00 0.00 0.08 0.86 7.50 -1.90 -0.09 115.11 121.57 3duy h GLN 303 Ca 0.04 0.00 -0.37 0.00 0.50 0.00 0.00 58.65 58.82 3duy h GLN 303 Cb 0.19 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 27.69 3duy h GLN 303 CO -0.00 0.00 -2.11 1.04 -1.50 0.00 0.00 178.83 176.26 3duy n GLN 304 N -2.49 0.72 -0.19 1.46 6.02 0.34 -4.44 117.38 118.79 3duy n GLN 304 Ca -0.01 0.25 0.12 0.00 -0.01 0.00 0.00 57.00 57.34 3duy n GLN 304 Cb 0.08 -1.65 0.24 0.00 1.02 0.00 0.00 30.24 29.93 3duy n GLN 304 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.06 178.53 3duy n TYR 305 N -3.48 0.51 -3.68 1.08 0.18 -1.02 -4.51 117.16 106.23 3duy n TYR 305 Ca -0.36 -0.26 -0.38 0.00 1.88 0.00 0.00 57.90 58.78 3duy n TYR 305 Cb 1.01 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.87 3duy n TYR 305 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3duy s LEU 306 N -1.46 5.34 -0.08 -3.48 1.43 -0.08 -1.00 118.68 119.36 3duy s LEU 306 Ca 0.39 -1.89 -0.26 0.00 -1.03 0.00 0.00 54.13 51.34 3duy s LEU 306 Cb 0.22 -1.91 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 3duy s LEU 306 CO 0.31 -0.58 0.82 -0.60 0.23 0.00 0.00 176.35 176.53 3duy s ARG 307 N 1.26 4.43 0.06 1.70 3.52 -0.06 -4.79 118.95 125.07 3duy s ARG 307 Ca 0.06 1.08 -0.31 0.00 -0.13 0.00 0.00 55.73 56.43 3duy s ARG 307 Cb -0.24 -3.49 -0.07 0.00 -1.56 0.00 0.00 34.95 29.59 3duy s ARG 307 CO -0.02 -0.09 1.39 -1.25 -0.81 0.00 0.00 175.30 174.52 3duy s PRO 308 N 1.27 4.31 0.22 5.12 0.04 -1.26 -0.58 135.00 144.12 3duy s PRO 308 Ca 0.42 2.02 0.09 0.00 0.04 0.00 0.00 61.00 63.56 3duy s PRO 308 Cb -0.18 -3.40 -0.05 0.00 0.04 0.00 0.00 34.50 30.91 3duy s PRO 308 CO 0.19 -0.49 -0.16 0.14 0.04 0.00 0.00 177.00 176.72 3duy s VAL 309 N 1.69 1.91 -0.24 -0.36 -7.23 -0.91 -4.93 120.40 110.33 3duy s VAL 309 Ca 0.64 -2.25 -0.28 0.00 -1.81 0.00 0.00 61.98 58.28 3duy s VAL 309 Cb -0.34 -2.10 -0.04 0.00 0.56 0.00 0.00 36.38 34.46 3duy s VAL 309 CO 0.29 -0.55 2.12 -0.70 -0.31 0.00 0.00 175.10 175.95 3duy s GLU 310 N -3.60 3.20 0.00 4.82 2.56 -1.26 -4.42 118.70 120.00 3duy s GLU 310 Ca 0.24 1.91 0.00 0.00 0.00 0.00 0.00 54.97 57.12 3duy s GLU 310 Cb -0.02 -4.33 0.00 0.00 2.00 0.00 0.00 34.13 31.78 3duy s GLU 310 CO 0.09 -2.03 0.00 -0.25 -0.56 0.00 0.00 175.26 172.51 3duy n ASP 317 N 11.29 0.00 -4.07 -1.70 10.43 -1.26 -5.00 116.55 126.24 3duy n ASP 317 Ca 0.28 0.00 -0.32 0.00 2.57 0.00 0.00 54.79 57.32 3duy n ASP 317 Cb 0.45 0.00 -0.16 0.00 1.84 0.00 0.00 41.12 43.25 3duy n ASP 317 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 3duy s ASP 318 N -3.88 3.04 0.13 -2.24 -0.00 -0.11 -4.70 116.67 108.92 3duy s ASP 318 Ca 0.00 -0.64 0.10 0.00 -0.00 0.00 0.00 52.55 52.01 3duy s ASP 318 Cb 0.00 -1.36 -0.04 0.00 -0.00 0.00 0.00 42.92 41.52 3duy s ASP 318 CO 0.00 -0.04 -0.22 0.00 -0.00 0.00 0.00 175.17 174.91 3duy s TYR 320 N -1.19 0.14 0.03 0.00 1.51 0.64 -2.15 117.35 116.34 3duy s TYR 320 Ca 0.17 -0.32 0.03 0.00 -1.01 0.00 0.00 57.07 55.94 3duy s TYR 320 Cb -0.10 -0.12 -0.04 0.00 -0.11 0.00 0.00 41.96 41.60 3duy s TYR 320 CO 0.09 -0.23 -0.03 0.15 -1.11 0.00 0.00 175.55 174.41 3duy s LYS 321 N -1.39 2.61 -0.19 -0.62 1.02 0.25 -1.67 119.74 119.75 3duy s LYS 321 Ca -0.15 -0.73 -0.29 0.00 0.02 0.00 0.00 55.97 54.82 3duy s LYS 321 Cb -0.09 -2.56 -0.02 0.00 -0.52 0.00 0.00 37.83 34.65 3duy s LYS 321 CO 0.00 0.59 1.40 0.12 -0.92 0.00 0.00 175.35 176.54 3duy s PHE 322 N -1.13 2.52 -0.38 3.18 5.36 -1.26 -0.88 117.98 125.40 3duy s PHE 322 Ca 0.21 0.76 0.06 0.00 -0.96 0.00 0.00 56.93 56.99 3duy s PHE 322 Cb -0.11 -3.76 0.56 0.00 -0.34 0.00 0.00 43.02 39.37 3duy s PHE 322 CO 0.12 -2.28 1.66 0.00 -1.46 0.00 0.00 175.22 173.26 3duy n ALA 323 N 7.31 4.98 -3.12 11.12 0.00 -0.17 -4.47 120.51 136.16 3duy n ALA 323 Ca 0.16 -3.11 -0.33 0.00 0.00 0.00 0.00 53.44 50.16 3duy n ALA 323 Cb 0.45 -1.06 -0.14 0.00 0.00 0.00 0.00 19.45 18.70 3duy n ALA 323 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3duy s ILE 324 N -3.43 3.03 0.21 0.00 1.01 -1.26 -1.83 121.20 118.93 3duy s ILE 324 Ca 0.51 -0.66 -0.04 0.00 0.00 0.00 0.00 60.65 60.45 3duy s ILE 324 Cb 0.44 -2.28 -0.03 0.00 0.01 0.00 0.00 42.46 40.60 3duy s ILE 324 CO 0.04 0.52 0.21 -0.94 0.00 0.00 0.00 174.94 174.77 3duy s SER 325 N 0.42 0.10 0.26 3.58 1.04 -0.57 -4.83 113.70 113.69 3duy s SER 325 Ca -0.10 -1.25 -0.14 0.00 0.48 0.00 0.00 55.95 54.94 3duy s SER 325 Cb -0.16 0.43 -0.08 0.00 0.10 0.00 0.00 66.02 66.31 3duy s SER 325 CO 0.05 -0.91 0.66 -1.58 0.98 0.00 0.00 173.24 172.44 3duy s GLN 326 N -4.11 3.99 0.07 4.02 0.74 -1.26 -0.77 119.66 122.35 3duy s GLN 326 Ca 0.33 0.58 0.03 0.00 0.05 0.00 0.00 55.36 56.36 3duy s GLN 326 Cb 0.05 -2.64 -0.03 0.00 1.10 0.00 0.00 33.01 31.49 3duy s GLN 326 CO 0.10 0.28 -0.10 0.45 -0.55 0.00 0.00 175.29 175.48 3duy s SER 327 N -2.10 1.24 0.00 6.67 0.15 0.46 -4.72 113.70 115.40 3duy s SER 327 Ca 0.48 -0.70 0.04 0.00 0.70 0.00 0.00 55.95 56.47 3duy s SER 327 Cb -0.12 0.02 0.09 0.00 -1.71 0.00 0.00 66.02 64.30 3duy s SER 327 CO 0.19 -0.23 1.01 -1.54 1.20 0.00 0.00 173.24 173.87 3duy n SER 328 N 0.96 2.15 -0.81 5.45 3.41 -1.26 -2.89 113.62 120.63 3duy n SER 328 Ca -0.19 -1.87 0.06 0.00 -0.26 0.00 0.00 58.87 56.61 3duy n SER 328 Cb 0.56 -0.06 0.14 0.00 -0.26 0.00 0.00 64.21 64.59 3duy n SER 328 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3duy n THR 329 N -0.10 1.44 0.00 6.66 -2.24 -1.26 -4.85 114.28 113.93 3duy n THR 329 Ca 0.04 -2.37 0.00 0.00 -2.27 0.00 0.00 64.05 59.45 3duy n THR 329 Cb 0.27 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 3duy n THR 329 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3duy n GLY 330 N -0.63 0.75 3.75 3.38 0.00 -1.23 -4.47 105.19 106.75 3duy n GLY 330 Ca 0.14 -2.09 -0.40 0.00 0.00 0.00 0.00 46.02 43.67 3duy n GLY 330 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3duy s THR 331 N -1.33 3.49 -0.19 2.61 2.01 0.45 -4.36 115.64 118.31 3duy s THR 331 Ca 0.00 1.45 0.01 0.00 0.31 0.00 0.00 61.69 63.46 3duy s THR 331 Cb 0.00 -3.92 0.04 0.00 0.01 0.00 0.00 72.50 68.63 3duy s THR 331 CO 0.00 0.32 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.43 3duy s VAL 332 N -0.94 1.79 -0.86 3.82 1.01 0.03 -1.59 120.40 123.66 3duy s VAL 332 Ca 0.46 -1.02 -0.21 0.00 0.00 0.00 0.00 61.98 61.21 3duy s VAL 332 Cb -0.32 -1.78 0.09 0.00 0.00 0.00 0.00 36.38 34.37 3duy s VAL 332 CO 0.41 0.27 1.14 -0.04 0.00 0.00 0.00 175.10 176.87 3duy s MET 333 N 1.35 3.43 0.00 2.72 -1.94 0.17 -1.56 119.30 123.47 3duy s MET 333 Ca 0.00 -1.30 0.00 0.00 -1.71 0.00 0.00 55.69 52.68 3duy s MET 333 Cb -0.15 -4.75 0.00 0.00 2.01 0.00 0.00 34.83 31.93 3duy s MET 333 CO -0.09 -1.88 0.00 0.41 -0.01 0.00 0.00 175.02 173.45 3duy n GLY 334 N 5.68 1.03 0.30 -0.03 0.00 -0.99 -1.82 105.19 109.36 3duy n GLY 334 Ca 0.16 -1.82 0.05 0.00 0.00 0.00 0.00 46.02 44.41 3duy n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3duy h ALA 335 N -1.42 1.77 -1.00 4.61 0.00 -0.14 -0.18 119.26 122.90 3duy h ALA 335 Ca 0.00 -0.02 0.17 0.00 0.00 0.00 0.00 54.91 55.06 3duy h ALA 335 Cb 0.00 -0.13 -0.10 0.00 0.00 0.00 0.00 17.79 17.56 3duy h ALA 335 CO 0.00 0.21 0.62 0.28 0.00 0.00 0.00 179.25 180.36 3duy h VAL 336 N 0.45 0.76 0.01 0.00 2.07 -1.53 -0.54 116.25 117.47 3duy h VAL 336 Ca 0.12 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.35 3duy h VAL 336 Cb -0.04 -0.12 0.00 0.00 -1.52 0.00 0.00 31.29 29.62 3duy h VAL 336 CO -0.03 0.15 -0.07 0.40 0.02 0.00 0.00 177.57 178.04 3duy h ILE 337 N 0.81 1.74 -0.17 4.57 1.08 -1.37 -3.39 117.51 120.78 3duy h ILE 337 Ca 0.55 -2.26 -0.09 0.00 -0.39 0.00 0.00 64.86 62.67 3duy h ILE 337 Cb 0.81 3.27 -0.01 0.00 -3.07 0.00 0.00 36.82 37.82 3duy h ILE 337 CO -0.34 0.59 -0.28 0.24 -0.69 0.00 0.00 178.15 177.67 3duy h MET 338 N -0.90 0.32 0.00 2.37 2.86 -0.85 -2.94 114.93 115.79 3duy h MET 338 Ca -0.01 -0.12 -0.01 0.00 -2.06 0.00 0.00 59.70 57.50 3duy h MET 338 Cb 1.01 -0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.65 3duy h MET 338 CO 0.01 0.58 -0.03 0.93 1.06 0.00 0.00 176.91 179.47 3duy h GLU 339 N 0.29 0.00 0.00 1.72 5.08 -1.26 0.34 114.58 120.75 3duy h GLU 339 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3duy h GLU 339 Cb 0.65 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 3duy h GLU 339 CO 0.05 0.03 0.00 0.41 -1.00 0.00 0.00 179.01 178.50 3duy n GLY 340 N -1.21 -1.03 3.14 -3.84 0.00 -1.11 -4.62 105.19 96.52 3duy n GLY 340 Ca -0.03 -0.14 -0.08 0.00 0.00 0.00 0.00 46.02 45.77 3duy n GLY 340 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3duy s PHE 341 N -2.34 0.39 -0.23 1.61 0.40 0.11 -3.16 117.98 114.76 3duy s PHE 341 Ca 0.31 -0.89 -0.16 0.00 -0.60 0.00 0.00 56.93 55.60 3duy s PHE 341 Cb 0.18 -0.26 -0.04 0.00 0.51 0.00 0.00 43.02 43.41 3duy s PHE 341 CO 0.36 -0.45 0.39 -0.47 0.70 0.00 0.00 175.22 175.75 3duy s TYR 342 N -3.90 3.33 -0.18 0.36 5.04 0.10 -4.40 117.35 117.70 3duy s TYR 342 Ca 0.07 0.55 -0.00 0.00 -2.44 0.00 0.00 57.07 55.25 3duy s TYR 342 Cb 0.07 -2.55 0.01 0.00 0.35 0.00 0.00 41.96 39.84 3duy s TYR 342 CO -0.10 -0.09 -0.15 0.08 -1.34 0.00 0.00 175.55 173.96 3duy s VAL 343 N 1.59 2.59 -0.28 3.14 1.01 -0.56 -1.73 120.40 126.15 3duy s VAL 343 Ca 0.18 -0.77 -0.09 0.00 0.00 0.00 0.00 61.98 61.30 3duy s VAL 343 Cb -0.15 -2.11 -0.02 0.00 0.00 0.00 0.00 36.38 34.09 3duy s VAL 343 CO 0.08 0.50 0.12 -0.69 0.00 0.00 0.00 175.10 175.12 3duy s VAL 344 N 1.16 4.57 -0.96 2.92 1.01 0.16 -0.42 120.40 128.83 3duy s VAL 344 Ca 0.01 -0.25 -0.15 0.00 0.00 0.00 0.00 61.98 61.60 3duy s VAL 344 Cb -0.14 -3.23 0.19 0.00 0.00 0.00 0.00 36.38 33.19 3duy s VAL 344 CO -0.06 0.20 1.05 -0.36 0.00 0.00 0.00 175.10 175.93 3duy s PHE 345 N 1.63 3.57 -1.22 5.22 0.08 0.66 -0.63 117.98 127.30 3duy s PHE 345 Ca 0.06 -1.90 -0.12 0.00 0.12 0.00 0.00 56.93 55.08 3duy s PHE 345 Cb -0.16 -4.06 0.19 0.00 -0.57 0.00 0.00 43.02 38.41 3duy s PHE 345 CO 0.06 -1.23 1.53 -3.47 -0.10 0.00 0.00 175.22 172.01 3duy n ASP 346 N 4.96 5.27 -0.29 1.36 -0.08 -0.55 -2.38 116.55 124.85 3duy n ASP 346 Ca 0.22 -3.04 0.00 0.00 -1.51 0.00 0.00 54.79 50.47 3duy n ASP 346 Cb 0.46 -1.52 0.20 0.00 2.34 0.00 0.00 41.12 42.60 3duy n ASP 346 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 3duy h ARG 347 N 6.65 1.12 -0.69 -0.67 3.08 -1.76 -1.10 114.38 121.00 3duy h ARG 347 Ca 0.32 -0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.36 3duy h ARG 347 Cb 0.80 -0.25 -0.04 0.00 0.08 0.00 0.00 29.97 30.55 3duy h ARG 347 CO 1.33 0.74 0.45 0.00 -1.07 0.00 0.00 179.97 181.42 3duy h ALA 348 N 1.47 1.70 -0.30 0.04 0.00 -1.63 -2.16 119.26 118.38 3duy h ALA 348 Ca 0.32 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3duy h ALA 348 Cb -0.10 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.50 3duy h ALA 348 CO -0.08 0.21 0.00 0.54 0.00 0.00 0.00 179.25 179.92 3duy n ARG 349 N -4.47 2.97 -3.76 0.00 1.74 -0.93 -5.00 116.66 107.21 3duy n ARG 349 Ca 0.10 -2.61 -0.23 0.00 -0.77 0.00 0.00 57.85 54.34 3duy n ARG 349 Cb 0.20 -1.68 0.02 0.00 -1.02 0.00 0.00 32.46 29.97 3duy n ARG 349 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3duy n LYS 350 N -0.15 -4.32 -3.64 5.56 5.02 -0.46 -4.93 118.16 115.23 3duy n LYS 350 Ca 0.19 0.56 -0.12 0.00 -2.02 0.00 0.00 58.31 56.92 3duy n LYS 350 Cb 0.76 -4.98 -0.06 0.00 -0.02 0.00 0.00 35.03 30.73 3duy n LYS 350 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3duy s ARG 351 N -6.10 0.97 -0.11 1.97 1.70 -0.96 -1.49 118.95 114.94 3duy s ARG 351 Ca 0.02 -0.44 0.03 0.00 -0.47 0.00 0.00 55.73 54.88 3duy s ARG 351 Cb -0.01 0.43 0.00 0.00 -0.57 0.00 0.00 34.95 34.81 3duy s ARG 351 CO 0.83 -0.35 -0.23 0.42 -1.08 0.00 0.00 175.30 174.90 3duy s ILE 352 N -2.82 2.15 0.01 4.99 1.01 0.04 -1.48 121.20 125.11 3duy s ILE 352 Ca -0.03 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.64 3duy s ILE 352 Cb -0.00 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.60 3duy s ILE 352 CO -0.05 0.55 0.07 -0.83 0.00 0.00 0.00 174.94 174.69 3duy s GLY 353 N 0.44 2.00 -0.05 6.18 0.00 0.20 -1.00 107.32 115.08 3duy s GLY 353 Ca -0.16 -0.91 0.04 0.00 0.00 0.00 0.00 44.72 43.69 3duy s GLY 353 CO 0.07 -0.81 -0.18 -1.36 0.00 0.00 0.00 173.10 170.82 3duy s PHE 354 N -1.22 1.83 0.05 1.90 0.40 0.52 -0.66 117.98 120.79 3duy s PHE 354 Ca 0.24 -0.58 -0.02 0.00 -0.60 0.00 0.00 56.93 55.97 3duy s PHE 354 Cb -0.12 -1.24 -0.03 0.00 0.51 0.00 0.00 43.02 42.14 3duy s PHE 354 CO 0.15 -0.21 0.01 0.00 0.70 0.00 0.00 175.22 175.87 3duy s ALA 355 N 0.14 0.30 0.15 5.36 0.00 -0.71 -1.05 121.76 125.95 3duy s ALA 355 Ca -0.07 -0.98 -0.31 0.00 0.00 0.00 0.00 51.96 50.60 3duy s ALA 355 Cb -0.13 0.28 -0.11 0.00 0.00 0.00 0.00 23.12 23.16 3duy s ALA 355 CO 0.03 -0.36 1.77 0.08 0.00 0.00 0.00 175.76 177.29 3duy s VAL 356 N -3.46 2.41 0.44 0.00 1.01 -1.24 0.02 120.40 119.58 3duy s VAL 356 Ca 0.03 0.09 -0.22 0.00 0.00 0.00 0.00 61.98 61.87 3duy s VAL 356 Cb 0.04 -3.05 -0.09 0.00 0.00 0.00 0.00 36.38 33.28 3duy s VAL 356 CO -0.08 0.00 1.05 -0.55 0.00 0.00 0.00 175.10 175.52 3duy s SER 357 N 2.13 6.52 0.60 3.32 0.15 -1.19 -1.34 113.70 123.89 3duy s SER 357 Ca 0.78 2.00 0.38 0.00 0.70 0.00 0.00 55.95 59.81 3duy s SER 357 Cb -0.47 -2.57 1.83 0.00 -1.71 0.00 0.00 66.02 63.10 3duy s SER 357 CO 0.34 -0.66 2.16 0.00 1.20 0.00 0.00 173.24 176.28 3duy h ALA 358 N 2.02 1.01 -1.17 5.45 0.00 -1.29 -3.13 119.26 122.16 3duy h ALA 358 Ca -0.49 -0.01 -0.62 0.00 0.00 0.00 0.00 54.91 53.79 3duy h ALA 358 Cb 1.22 -0.00 -0.38 0.00 0.00 0.00 0.00 17.79 18.63 3duy h ALA 358 CO 0.61 0.01 -0.24 0.00 0.00 0.00 0.00 179.25 179.63 3duy s HIS 360 N -3.69 3.70 -0.61 0.00 -0.00 -1.18 -4.61 115.29 108.90 3duy s HIS 360 Ca 0.51 0.96 -0.23 0.00 -0.00 0.00 0.00 55.06 56.31 3duy s HIS 360 Cb 0.42 -2.27 0.06 0.00 -0.00 0.00 0.00 32.58 30.79 3duy s HIS 360 CO -0.15 0.62 0.93 0.08 -0.00 0.00 0.00 174.74 176.22 3duy s VAL 361 N -1.14 4.39 0.25 -5.38 1.01 -1.26 -5.02 120.40 113.25 3duy s VAL 361 Ca 0.25 -0.14 0.11 0.00 0.00 0.00 0.00 61.98 62.20 3duy s VAL 361 Cb -0.16 -4.60 -0.05 0.00 0.00 0.00 0.00 36.38 31.57 3duy s VAL 361 CO 0.14 -1.29 -0.13 -1.38 0.00 0.00 0.00 175.10 172.45 3duy s HIS 362 N 3.92 2.47 0.00 5.22 -0.00 -1.26 -4.86 115.29 120.78 3duy s HIS 362 Ca 0.25 -0.28 0.00 0.00 -0.00 0.00 0.00 55.06 55.02 3duy s HIS 362 Cb -0.15 -1.11 0.00 0.00 -0.00 0.00 0.00 32.58 31.31 3duy s HIS 362 CO 0.14 0.63 0.00 -0.40 -0.00 0.00 0.00 174.74 175.11 3duy n ASP 363 N -0.51 0.00 -0.00 7.38 5.68 -1.20 -5.05 116.55 122.85 3duy n ASP 363 Ca -0.07 0.00 -0.04 0.00 -0.50 0.00 0.00 54.79 54.18 3duy n ASP 363 Cb 0.59 0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.45 3duy n ASP 363 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 3duy n GLU 364 N 0.00 0.63 -0.10 0.11 0.28 -1.26 -4.44 120.64 115.86 3duy n GLU 364 Ca 0.00 0.22 -0.11 0.00 -0.16 0.00 0.00 57.16 57.11 3duy n GLU 364 Cb 0.00 -1.76 -0.14 0.00 1.43 0.00 0.00 31.44 30.97 3duy n GLU 364 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 3duy n PHE 365 N -2.91 0.00 -4.32 -1.84 0.99 -1.26 -5.02 117.46 103.09 3duy n PHE 365 Ca -0.15 0.00 -0.18 0.00 -0.00 0.00 0.00 57.45 57.12 3duy n PHE 365 Cb 0.94 -0.91 -0.10 0.00 -1.00 0.00 0.00 39.48 38.41 3duy n PHE 365 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 3duy s ARG 366 N -2.45 1.25 -0.02 -1.08 0.52 -1.26 -5.16 118.95 110.74 3duy s ARG 366 Ca -0.14 -1.50 -0.07 0.00 -0.52 0.00 0.00 55.73 53.50 3duy s ARG 366 Cb 0.06 -1.07 0.01 0.00 0.52 0.00 0.00 34.95 34.46 3duy s ARG 366 CO 0.71 0.19 0.16 -0.08 0.02 0.00 0.00 175.30 176.30 3duy s THR 367 N -2.74 0.05 0.32 0.02 -1.32 -1.26 -3.22 115.64 107.49 3duy s THR 367 Ca 0.19 -0.44 -0.29 0.00 -1.21 0.00 0.00 61.69 59.94 3duy s THR 367 Cb -0.02 -0.38 -0.11 0.00 -1.51 0.00 0.00 72.50 70.48 3duy s THR 367 CO 0.06 -0.24 1.48 0.00 -2.21 0.00 0.00 174.62 173.70 3duy s ALA 368 N -0.87 3.62 0.06 11.08 0.00 -1.26 -4.96 121.76 129.43 3duy s ALA 368 Ca -0.10 1.48 0.01 0.00 0.00 0.00 0.00 51.96 53.35 3duy s ALA 368 Cb -0.05 -3.59 -0.03 0.00 0.00 0.00 0.00 23.12 19.45 3duy s ALA 368 CO 0.01 -0.91 -0.06 0.00 0.00 0.00 0.00 175.76 174.80 3duy s ALA 369 N -0.59 0.65 -0.17 0.00 0.00 -1.13 -4.95 121.76 115.57 3duy s ALA 369 Ca 0.56 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 51.50 3duy s ALA 369 Cb -0.45 0.13 0.03 0.00 0.00 0.00 0.00 23.12 22.84 3duy s ALA 369 CO 0.53 -0.17 -0.11 0.08 0.00 0.00 0.00 175.76 176.09 3duy s VAL 370 N -2.60 1.52 0.00 0.00 1.01 -1.26 -0.91 120.40 118.16 3duy s VAL 370 Ca -0.00 -0.75 0.02 0.00 0.00 0.00 0.00 61.98 61.25 3duy s VAL 370 Cb -0.02 -1.52 -0.01 0.00 0.00 0.00 0.00 36.38 34.83 3duy s VAL 370 CO -0.03 0.31 -0.08 -1.61 0.00 0.00 0.00 175.10 173.69 3duy s GLU 371 N 1.48 0.59 0.04 2.72 2.02 -0.35 -4.93 118.70 120.27 3duy s GLU 371 Ca 0.02 -0.35 -0.08 0.00 0.02 0.00 0.00 54.97 54.58 3duy s GLU 371 Cb -0.14 -0.54 0.03 0.00 0.10 0.00 0.00 34.13 33.57 3duy s GLU 371 CO -0.09 0.14 0.38 0.41 0.02 0.00 0.00 175.26 176.12 3duy n GLY 372 N 2.65 0.89 3.87 -1.39 0.00 -1.26 -1.19 105.19 108.76 3duy n GLY 372 Ca -0.15 -0.97 -0.31 0.00 0.00 0.00 0.00 46.02 44.59 3duy n GLY 372 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3duy s PRO 373 N -2.01 3.72 0.28 1.61 0.04 -1.26 -5.10 135.00 132.28 3duy s PRO 373 Ca 0.09 0.71 0.10 0.00 0.04 0.00 0.00 61.00 61.94 3duy s PRO 373 Cb -0.01 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 3duy s PRO 373 CO 0.01 -0.37 -0.15 -0.06 0.04 0.00 0.00 177.00 176.47 3duy s PHE 374 N -2.85 2.18 -0.19 0.56 0.40 0.15 -4.98 117.98 113.25 3duy s PHE 374 Ca 0.55 -0.45 -0.09 0.00 -0.60 0.00 0.00 56.93 56.34 3duy s PHE 374 Cb -0.10 -1.05 -0.05 0.00 0.51 0.00 0.00 43.02 42.33 3duy s PHE 374 CO 0.43 0.58 0.11 0.08 0.70 0.00 0.00 175.22 177.12 3duy s VAL 375 N -2.66 5.20 -0.04 -0.44 1.01 -1.26 -0.65 120.40 121.56 3duy s VAL 375 Ca 0.29 0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.37 3duy s VAL 375 Cb -0.02 -3.36 0.03 0.00 0.00 0.00 0.00 36.38 33.03 3duy s VAL 375 CO 0.14 0.45 0.09 -0.89 0.00 0.00 0.00 175.10 174.89 3duy s THR 376 N 0.32 -0.05 0.33 3.92 2.01 -0.27 -4.88 115.64 117.01 3duy s THR 376 Ca 0.07 0.19 -0.04 0.00 0.31 0.00 0.00 61.69 62.21 3duy s THR 376 Cb -0.11 -0.16 -0.05 0.00 0.01 0.00 0.00 72.50 72.19 3duy s THR 376 CO -0.01 0.08 0.59 -0.76 -0.69 0.00 0.00 174.62 173.82 3duy s LEU 377 N 1.07 3.99 -1.46 4.42 1.43 -1.26 -4.30 118.68 122.57 3duy s LEU 377 Ca -0.09 0.71 -0.09 0.00 -1.03 0.00 0.00 54.13 53.63 3duy s LEU 377 Cb -0.12 -3.55 0.04 0.00 0.03 0.00 0.00 46.19 42.59 3duy s LEU 377 CO -0.04 -0.27 0.90 0.47 0.23 0.00 0.00 176.35 177.64 3duy n ASP 378 N -1.27 -5.60 -0.17 2.29 10.43 -1.26 -4.87 116.55 116.10 3duy n ASP 378 Ca -0.02 -0.52 -0.02 0.00 2.57 0.00 0.00 54.79 56.79 3duy n ASP 378 Cb 0.54 -4.47 0.19 0.00 1.84 0.00 0.00 41.12 39.23 3duy n ASP 378 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 3duy h MET 379 N -2.00 0.92 0.00 -1.24 2.86 -2.00 -1.19 114.93 112.29 3duy h MET 379 Ca -0.55 -0.15 -0.01 0.00 -2.06 0.00 0.00 59.70 56.94 3duy h MET 379 Cb 1.36 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 32.86 3duy h MET 379 CO 0.59 0.75 -0.04 1.49 1.06 0.00 0.00 176.91 180.77 3duy h GLU 380 N 0.90 0.00 0.00 1.72 4.57 -1.97 -1.47 114.58 118.33 3duy h GLU 380 Ca 0.21 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.39 3duy h GLU 380 Cb 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 3duy h GLU 380 CO -0.02 0.04 0.00 -0.44 -1.18 0.00 0.00 179.01 177.41 3duy h ASP 381 N 0.00 0.00 1.14 1.04 3.32 -1.59 -2.32 116.42 118.02 3duy h ASP 381 Ca -0.00 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 3duy h ASP 381 Cb 0.36 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.90 3duy h ASP 381 CO 0.00 0.00 -0.17 0.00 -1.72 0.00 0.00 179.24 177.35 3duy s GLY 383 N -4.27 2.95 -0.04 0.00 0.00 -0.87 -3.83 107.32 101.25 3duy s GLY 383 Ca 0.02 1.20 -0.08 0.00 0.00 0.00 0.00 44.72 45.86 3duy s GLY 383 CO 0.63 1.80 0.25 -0.47 0.00 0.00 0.00 173.10 175.31 3duy s TYR 384 N -1.24 3.61 0.00 1.90 5.04 -1.26 -4.96 117.35 120.44 3duy s TYR 384 Ca 0.54 0.64 0.00 0.00 -2.44 0.00 0.00 57.07 55.81 3duy s TYR 384 Cb -0.37 -2.03 0.00 0.00 0.35 0.00 0.00 41.96 39.91 3duy s TYR 384 CO 0.49 0.66 0.28 0.09 -1.34 0.00 0.00 175.55 175.73