#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bwo n SER 21 N 0.00 0.00 -0.48 6.12 3.41 -1.26 -2.74 113.62 118.68 3bwo n SER 21 Ca 0.00 -1.70 0.07 0.00 -0.26 0.00 0.00 58.87 56.99 3bwo n SER 21 Cb 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 3bwo n SER 21 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3bwo n ASP 22 N -0.62 1.91 -4.65 4.04 10.43 -1.26 -4.94 116.55 121.47 3bwo n ASP 22 Ca 0.05 -1.46 -0.43 0.00 2.57 0.00 0.00 54.79 55.53 3bwo n ASP 22 Cb 0.02 0.21 -0.02 0.00 1.84 0.00 0.00 41.12 43.17 3bwo n ASP 22 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 3bwo s PHE 23 N -1.48 3.28 -0.45 1.24 0.40 -1.11 -5.01 117.98 114.86 3bwo s PHE 23 Ca 0.15 1.32 -0.27 0.00 -0.60 0.00 0.00 56.93 57.53 3bwo s PHE 23 Cb 0.12 -3.34 0.03 0.00 0.51 0.00 0.00 43.02 40.34 3bwo s PHE 23 CO 0.27 -0.54 1.00 0.08 0.70 0.00 0.00 175.22 176.73 3bwo s VAL 24 N 3.25 4.40 -0.29 -0.44 1.01 -1.26 -4.90 120.40 122.17 3bwo s VAL 24 Ca 0.42 1.02 -0.29 0.00 0.00 0.00 0.00 61.98 63.13 3bwo s VAL 24 Cb -0.14 -4.48 -0.00 0.00 0.00 0.00 0.00 36.38 31.76 3bwo s VAL 24 CO 0.09 -0.83 1.35 -0.69 0.00 0.00 0.00 175.10 175.02 3bwo s VAL 25 N 3.94 4.07 -0.45 2.92 1.01 0.11 -4.92 120.40 127.08 3bwo s VAL 25 Ca 0.41 1.20 -0.10 0.00 0.00 0.00 0.00 61.98 63.50 3bwo s VAL 25 Cb -0.09 -4.08 0.10 0.00 0.00 0.00 0.00 36.38 32.30 3bwo s VAL 25 CO 0.27 -0.45 0.31 0.21 0.00 0.00 0.00 175.10 175.44 3bwo s ASN 26 N 3.04 5.70 -0.16 3.32 3.84 -1.26 0.74 114.94 130.15 3bwo s ASN 26 Ca 0.59 -1.69 0.14 0.00 0.21 0.00 0.00 52.86 52.10 3bwo s ASN 26 Cb -0.18 -2.01 0.41 0.00 -0.55 0.00 0.00 41.25 38.92 3bwo s ASN 26 CO 0.24 -0.62 1.21 0.18 -2.79 0.00 0.00 177.10 175.32 3bwo n LEU 27 N 4.93 2.32 0.09 3.21 4.77 -0.59 -4.68 117.00 127.05 3bwo n LEU 27 Ca -0.09 -3.46 0.04 0.00 -0.03 0.00 0.00 56.01 52.46 3bwo n LEU 27 Cb 0.42 -0.41 -0.02 0.00 -2.33 0.00 0.00 43.42 41.07 3bwo n LEU 27 CO 0.41 1.19 0.05 -0.78 -1.33 0.00 0.00 177.39 176.93 3bwo h ASP 28 N 0.95 0.00 -2.64 -1.43 3.58 -1.76 -1.85 116.42 113.27 3bwo h ASP 28 Ca -0.05 0.00 -0.57 0.00 0.42 0.00 0.00 57.03 56.84 3bwo h ASP 28 Cb 1.19 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 42.16 3bwo h ASP 28 CO 0.02 0.40 -0.58 -1.38 -2.88 0.00 0.00 179.24 174.82 3bwo s HIS 29 N -3.05 3.07 -0.98 0.28 -3.43 -1.26 -4.36 115.29 105.57 3bwo s HIS 29 Ca 0.00 -0.06 -0.03 0.00 -0.80 0.00 0.00 55.06 54.17 3bwo s HIS 29 Cb 0.08 -1.46 0.22 0.00 -1.43 0.00 0.00 32.58 30.00 3bwo s HIS 29 CO 0.78 0.52 2.20 0.41 -2.00 0.00 0.00 174.74 176.65 3bwo n GLY 30 N -0.46 5.44 3.54 -1.38 0.00 -1.26 -4.65 105.19 106.43 3bwo n GLY 30 Ca -0.08 -2.29 -0.43 0.00 0.00 0.00 0.00 46.02 43.23 3bwo n GLY 30 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3bwo s ASP 31 N -0.49 6.37 -1.08 1.61 2.15 -1.26 -4.94 116.67 119.03 3bwo s ASP 31 Ca 0.49 -0.19 -0.07 0.00 0.43 0.00 0.00 52.55 53.22 3bwo s ASP 31 Cb 0.27 -2.48 -0.07 0.00 -0.30 0.00 0.00 42.92 40.33 3bwo s ASP 31 CO -0.19 -1.34 2.41 -0.81 -0.17 0.00 0.00 175.17 175.07 3bwo n PRO 32 N 7.89 2.55 -0.03 4.34 -0.04 -1.26 -4.38 135.00 144.07 3bwo n PRO 32 Ca 0.04 -1.64 0.07 0.00 -0.04 0.00 0.00 63.50 61.93 3bwo n PRO 32 Cb 0.48 -2.52 0.36 0.00 -0.04 0.00 0.00 33.50 31.77 3bwo n PRO 32 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3bwo n THR 33 N 3.92 0.07 0.22 0.52 -2.24 -0.89 -3.46 114.28 112.42 3bwo n THR 33 Ca 0.54 -0.10 0.11 0.00 -2.27 0.00 0.00 64.05 62.33 3bwo n THR 33 Cb 0.19 -0.07 0.37 0.00 -2.10 0.00 0.00 70.33 68.72 3bwo n THR 33 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3bwo h ALA 34 N 3.52 0.95 0.00 6.98 0.00 -1.41 -3.16 119.26 126.14 3bwo h ALA 34 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3bwo h ALA 34 Cb 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3bwo h ALA 34 CO 0.00 0.22 -0.54 1.88 0.00 0.00 0.00 179.25 180.82 3bwo h TYR 35 N 0.00 0.00 -0.62 0.00 0.05 -1.84 -3.38 116.97 111.18 3bwo h TYR 35 Ca -0.00 0.00 0.12 0.00 0.05 0.00 0.00 58.73 58.90 3bwo h TYR 35 Cb 0.87 0.00 -0.12 0.00 1.01 0.00 0.00 36.73 38.49 3bwo h TYR 35 CO 0.00 0.00 -0.15 1.49 -1.05 0.00 0.00 178.16 178.45 3bwo h GLU 36 N 0.00 0.00 -0.29 4.88 4.81 -1.79 -0.92 114.58 121.28 3bwo h GLU 36 Ca 0.00 -0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.28 3bwo h GLU 36 Cb 0.78 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.12 3bwo h GLU 36 CO 0.00 0.00 0.02 1.49 -0.73 0.00 0.00 179.01 179.79 3bwo h GLU 37 N 0.00 0.11 -0.34 1.92 4.81 -1.81 -1.96 114.58 117.31 3bwo h GLU 37 Ca 0.30 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.59 3bwo h GLU 37 Cb 0.45 -0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.72 3bwo h GLU 37 CO -0.64 0.07 -0.30 -0.92 -0.73 0.00 0.00 179.01 176.49 3bwo h TYR 38 N 0.11 -0.83 0.00 0.92 3.20 -1.43 -2.27 116.97 116.66 3bwo h TYR 38 Ca 0.14 0.05 -0.06 0.00 3.14 0.00 0.00 58.73 61.99 3bwo h TYR 38 Cb 0.17 0.42 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 3bwo h TYR 38 CO -0.20 -0.37 -0.30 -1.49 -1.64 0.00 0.00 178.16 174.16 3bwo h TRP 39 N -0.26 0.00 -0.52 -3.82 4.06 -1.26 -2.28 115.95 111.87 3bwo h TRP 39 Ca 0.16 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 61.06 3bwo h TRP 39 Cb 0.52 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.66 3bwo h TRP 39 CO -0.49 0.30 0.11 -0.09 -3.56 0.00 0.00 178.44 174.71 3bwo h ARG 40 N 0.00 0.80 0.00 0.49 2.43 -0.77 -2.45 114.38 114.88 3bwo h ARG 40 Ca -0.00 -0.16 -0.10 0.00 -0.81 0.00 0.00 59.98 58.90 3bwo h ARG 40 Cb 0.58 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.00 3bwo h ARG 40 CO 0.04 0.73 -0.49 0.87 -1.51 0.00 0.00 179.97 179.61 3bwo h LYS 41 N 0.77 0.00 -0.10 0.20 1.57 -1.17 -3.12 116.57 114.73 3bwo h LYS 41 Ca 0.17 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.98 3bwo h LYS 41 Cb 0.30 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 3bwo h LYS 41 CO 0.00 0.49 0.21 0.52 -0.57 0.00 0.00 179.45 180.10 3bwo h MET 42 N 0.00 0.00 0.00 3.15 2.86 -1.02 -3.47 114.93 116.45 3bwo h MET 42 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3bwo h MET 42 Cb 1.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.79 3bwo h MET 42 CO 0.06 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.44 3bwo n GLY 43 N -1.28 -0.52 0.00 8.32 0.00 -1.18 -3.82 105.19 106.71 3bwo n GLY 43 Ca -0.00 -1.11 0.05 0.00 0.00 0.00 0.00 46.02 44.96 3bwo n GLY 43 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3bwo n ASP 44 N -0.98 0.00 0.26 1.61 9.92 -1.26 -2.53 116.55 123.58 3bwo n ASP 44 Ca 0.00 -0.04 0.13 0.00 -0.53 0.00 0.00 54.79 54.35 3bwo n ASP 44 Cb 0.00 -0.17 0.68 0.00 -0.64 0.00 0.00 41.12 40.99 3bwo n ASP 44 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 3bwo h ARG 45 N 0.00 0.00 -0.01 -1.24 2.43 -1.98 -3.04 114.38 110.54 3bwo h ARG 45 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3bwo h ARG 45 Cb 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 3bwo h ARG 45 CO 0.00 0.12 -0.32 0.00 -1.51 0.00 0.00 179.97 178.27 3bwo n THR 47 N -0.00 0.20 -4.31 0.00 -1.04 -1.15 -4.78 114.28 103.19 3bwo n THR 47 Ca 0.07 -0.05 -0.34 0.00 -2.04 0.00 0.00 64.05 61.70 3bwo n THR 47 Cb 0.36 -1.71 -0.11 0.00 -1.82 0.00 0.00 70.33 67.05 3bwo n THR 47 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 3bwo s VAL 48 N 0.80 4.11 -0.17 12.58 1.01 -1.26 -5.09 120.40 132.39 3bwo s VAL 48 Ca 0.75 -0.28 -0.00 0.00 0.00 0.00 0.00 61.98 62.45 3bwo s VAL 48 Cb -0.61 -2.81 -0.00 0.00 0.00 0.00 0.00 36.38 32.96 3bwo s VAL 48 CO 0.38 0.49 -0.14 -0.89 0.00 0.00 0.00 175.10 174.95 3bwo s THR 49 N 0.30 2.74 -0.14 3.92 2.01 -1.26 -5.11 115.64 118.10 3bwo s THR 49 Ca -0.02 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.25 3bwo s THR 49 Cb -0.14 -2.17 0.02 0.00 0.01 0.00 0.00 72.50 70.22 3bwo s THR 49 CO 0.02 0.50 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.69 3bwo s ILE 50 N 0.95 1.47 0.68 1.82 1.01 -1.26 -5.13 121.20 120.74 3bwo s ILE 50 Ca -0.03 -0.58 -0.11 0.00 0.00 0.00 0.00 60.65 59.94 3bwo s ILE 50 Cb -0.15 -1.39 -0.00 0.00 0.01 0.00 0.00 42.46 40.93 3bwo s ILE 50 CO -0.02 0.44 1.05 -0.13 0.00 0.00 0.00 174.94 176.29 3bwo s ARG 51 N 1.44 3.09 0.57 2.79 0.52 -1.26 -4.95 118.95 121.14 3bwo s ARG 51 Ca 0.03 0.91 0.37 0.00 -0.52 0.00 0.00 55.73 56.52 3bwo s ARG 51 Cb -0.13 -2.01 1.75 0.00 0.52 0.00 0.00 34.95 35.08 3bwo s ARG 51 CO -0.09 -0.98 2.10 0.78 0.02 0.00 0.00 175.30 177.13 3bwo h GLY 52 N -0.62 0.00 -1.62 -3.53 0.00 -2.05 -2.85 103.07 92.40 3bwo h GLY 52 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.89 3bwo h GLY 52 CO 0.58 0.00 0.00 0.00 0.00 0.00 0.00 176.54 177.12 3bwo s ASP 54 N -1.14 6.55 -1.39 0.00 1.01 -1.08 -4.45 116.67 116.17 3bwo s ASP 54 Ca 0.28 0.92 -0.09 0.00 0.71 0.00 0.00 52.55 54.36 3bwo s ASP 54 Cb 0.16 -2.23 0.03 0.00 1.01 0.00 0.00 42.92 41.89 3bwo s ASP 54 CO 0.22 -0.19 1.12 0.18 0.21 0.00 0.00 175.17 176.70 3bwo n LEU 55 N -0.68 -3.23 0.02 1.23 4.77 -1.26 -4.92 117.00 112.94 3bwo n LEU 55 Ca 0.00 -0.61 -0.17 0.00 -0.03 0.00 0.00 56.01 55.20 3bwo n LEU 55 Cb 0.53 -2.92 -0.14 0.00 -2.33 0.00 0.00 43.42 38.56 3bwo n LEU 55 CO 0.46 0.59 -0.58 0.24 -1.33 0.00 0.00 177.39 176.78 3bwo h MET 56 N -2.49 0.22 -7.14 3.23 2.86 -1.95 -3.47 114.93 106.19 3bwo h MET 56 Ca -0.57 -0.38 -0.48 0.00 -2.06 0.00 0.00 59.70 56.21 3bwo h MET 56 Cb 1.37 0.14 0.04 0.00 0.06 0.00 0.00 31.60 33.21 3bwo h MET 56 CO 0.58 1.05 0.38 0.45 1.06 0.00 0.00 176.91 180.43 3bwo s SER 57 N -6.85 6.08 0.50 1.22 0.15 -1.26 -4.93 113.70 108.62 3bwo s SER 57 Ca -0.14 1.86 0.25 0.00 0.70 0.00 0.00 55.95 58.63 3bwo s SER 57 Cb 0.07 -2.55 1.35 0.00 -1.71 0.00 0.00 66.02 63.18 3bwo s SER 57 CO 0.82 -0.96 2.04 1.88 1.20 0.00 0.00 173.24 178.22 3bwo h TYR 58 N 1.00 0.00 -2.90 3.44 -1.99 -1.96 -3.43 116.97 111.13 3bwo h TYR 58 Ca -0.48 0.00 -0.64 0.00 2.00 0.00 0.00 58.73 59.61 3bwo h TYR 58 Cb 1.22 0.00 -0.08 0.00 2.00 0.00 0.00 36.73 39.87 3bwo h TYR 58 CO 0.58 0.14 -0.39 -0.06 -0.00 0.00 0.00 178.16 178.43 3bwo s PHE 59 N -4.21 3.59 -0.27 4.88 0.08 -1.26 -4.74 117.98 116.06 3bwo s PHE 59 Ca -0.03 0.63 -0.06 0.00 0.12 0.00 0.00 56.93 57.59 3bwo s PHE 59 Cb 0.13 -2.11 -0.15 0.00 -0.57 0.00 0.00 43.02 40.33 3bwo s PHE 59 CO 0.60 0.59 -0.28 0.43 -0.10 0.00 0.00 175.22 176.46 3bwo n SER 60 N 2.35 1.97 -3.15 1.36 7.64 0.92 -5.00 113.62 119.71 3bwo n SER 60 Ca -0.17 0.10 0.04 0.00 1.01 0.00 0.00 58.87 59.86 3bwo n SER 60 Cb 0.54 -0.62 -0.01 0.00 -1.01 0.00 0.00 64.21 63.11 3bwo n SER 60 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 3bwo s ASP 61 N -7.01 -1.21 0.59 6.43 2.15 -0.10 -4.90 116.67 112.63 3bwo s ASP 61 Ca -0.37 0.41 0.37 0.00 0.43 0.00 0.00 52.55 53.38 3bwo s ASP 61 Cb 0.12 1.87 1.83 0.00 -0.30 0.00 0.00 42.92 46.44 3bwo s ASP 61 CO 0.55 -0.22 2.17 0.24 -0.17 0.00 0.00 175.17 177.73 3bwo h MET 62 N 7.89 0.00 0.00 4.34 2.86 -1.95 -1.90 114.93 126.17 3bwo h MET 62 Ca -0.11 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 3bwo h MET 62 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 3bwo h MET 62 CO 0.11 0.03 0.00 1.15 1.06 0.00 0.00 176.91 179.26 3bwo h THR 63 N 0.00 0.00 -3.03 2.22 2.02 -1.95 -3.43 112.91 108.74 3bwo h THR 63 Ca -0.00 -0.19 -0.65 0.00 0.77 0.00 0.00 66.41 66.33 3bwo h THR 63 Cb 0.25 0.89 -0.09 0.00 -1.74 0.00 0.00 68.15 67.47 3bwo h THR 63 CO 0.00 0.00 -0.56 0.20 0.37 0.00 0.00 175.52 175.54 3bwo s ASN 64 N -4.31 5.84 0.20 4.18 -0.87 -0.71 -5.00 114.94 114.26 3bwo s ASN 64 Ca 0.02 0.19 -0.11 0.00 -1.57 0.00 0.00 52.86 51.40 3bwo s ASN 64 Cb 0.09 -1.71 0.24 0.00 -0.02 0.00 0.00 41.25 39.84 3bwo s ASN 64 CO 0.36 0.27 1.73 0.25 -2.57 0.00 0.00 177.10 177.14 3bwo h LEU 65 N 4.03 0.12 -7.78 0.60 5.85 -1.86 -2.98 115.31 113.29 3bwo h LEU 65 Ca -0.49 0.08 -0.74 0.00 0.84 0.00 0.00 57.88 57.57 3bwo h LEU 65 Cb 1.18 0.09 -0.20 0.00 0.37 0.00 0.00 40.66 42.10 3bwo h LEU 65 CO 0.64 0.08 0.91 0.00 -0.34 0.00 0.00 178.44 179.72 3bwo n TRP 67 N 5.20 0.00 -0.26 0.00 4.27 -1.13 -1.68 117.44 123.84 3bwo n TRP 67 Ca 0.28 0.00 0.11 0.00 -3.89 0.00 0.00 57.50 54.00 3bwo n TRP 67 Cb 0.44 -0.32 0.29 0.00 -1.36 0.00 0.00 31.31 30.36 3bwo n TRP 67 CO 0.00 0.00 0.00 1.97 -2.29 0.00 0.00 177.69 177.37 3bwo n PHE 68 N -1.32 0.85 -3.09 -2.67 -1.74 -1.26 -0.06 117.46 108.18 3bwo n PHE 68 Ca 0.06 -0.47 -0.41 0.00 -0.56 0.00 0.00 57.45 56.07 3bwo n PHE 68 Cb 0.12 -0.00 -0.06 0.00 1.52 0.00 0.00 39.48 41.05 3bwo n PHE 68 CO 0.00 0.00 0.00 -1.17 -0.56 0.00 0.00 176.76 175.03 3bwo s LEU 69 N -1.06 4.08 -0.05 5.98 2.96 -0.68 -4.71 118.68 125.22 3bwo s LEU 69 Ca 0.44 0.66 -0.30 0.00 -0.22 0.00 0.00 54.13 54.71 3bwo s LEU 69 Cb 0.23 -2.88 -0.04 0.00 0.50 0.00 0.00 46.19 44.00 3bwo s LEU 69 CO 0.31 -0.42 1.39 -0.70 -1.32 0.00 0.00 176.35 175.61 3bwo s GLU 70 N 2.58 4.26 0.18 1.98 2.56 -1.26 -4.48 118.70 124.53 3bwo s GLU 70 Ca 0.27 1.91 -0.21 0.00 0.00 0.00 0.00 54.97 56.94 3bwo s GLU 70 Cb -0.15 -3.67 0.11 0.00 2.00 0.00 0.00 34.13 32.41 3bwo s GLU 70 CO 0.09 -0.63 1.59 -1.35 -0.56 0.00 0.00 175.26 174.41 3bwo h PRO 71 N 8.13 -0.17 -0.93 4.30 0.11 -1.95 -1.41 132.00 140.09 3bwo h PRO 71 Ca -0.35 0.01 0.22 0.00 0.11 0.00 0.00 66.00 65.99 3bwo h PRO 71 Cb 1.16 0.04 -0.07 0.00 0.11 0.00 0.00 31.00 32.24 3bwo h PRO 71 CO 0.92 -0.12 0.62 0.93 -0.21 0.00 0.00 178.00 180.14 3bwo h GLU 72 N -0.18 0.35 -0.16 1.05 3.07 -1.97 0.54 114.58 117.28 3bwo h GLU 72 Ca 0.22 -0.02 -0.22 0.00 -0.50 0.00 0.00 59.36 58.84 3bwo h GLU 72 Cb 0.54 -0.08 0.01 0.00 -0.84 0.00 0.00 28.75 28.38 3bwo h GLU 72 CO -0.62 0.23 -0.76 1.25 -1.40 0.00 0.00 179.01 177.70 3bwo h LEU 73 N 0.36 0.93 -0.42 1.33 5.85 -1.56 -2.44 115.31 119.35 3bwo h LEU 73 Ca 0.49 -0.60 -0.01 0.00 0.84 0.00 0.00 57.88 58.60 3bwo h LEU 73 Cb 1.30 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.03 3bwo h LEU 73 CO -0.18 1.40 0.24 -0.08 -0.34 0.00 0.00 178.44 179.49 3bwo h GLU 74 N 0.54 0.58 -0.31 1.25 4.81 0.91 -0.85 114.58 121.51 3bwo h GLU 74 Ca -0.05 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.12 3bwo h GLU 74 Cb 1.39 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.64 3bwo h GLU 74 CO 0.16 0.45 0.17 -0.44 -0.73 0.00 0.00 179.01 178.62 3bwo h ASP 75 N 0.56 0.38 -0.38 1.04 3.32 -1.21 -2.37 116.42 117.75 3bwo h ASP 75 Ca 0.15 -0.07 0.04 0.00 0.02 0.00 0.00 57.03 57.17 3bwo h ASP 75 Cb 0.03 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 3bwo h ASP 75 CO -0.03 0.34 0.15 0.00 -1.72 0.00 0.00 179.24 177.99 3bwo h ALA 76 N 1.05 0.45 -0.79 3.45 0.00 -1.24 0.92 119.26 123.11 3bwo h ALA 76 Ca 0.11 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.08 3bwo h ALA 76 Cb 0.04 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3bwo h ALA 76 CO -0.02 -0.23 0.52 0.82 0.00 0.00 0.00 179.25 180.34 3bwo h ILE 77 N 0.32 1.14 0.02 0.00 2.04 -0.98 -0.43 117.51 119.62 3bwo h ILE 77 Ca 0.17 -0.34 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 3bwo h ILE 77 Cb 0.12 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.26 3bwo h ILE 77 CO -0.15 0.18 -0.01 0.11 0.00 0.00 0.00 178.15 178.28 3bwo h LYS 78 N 0.99 -0.02 -0.93 2.37 1.57 -0.87 -2.63 116.57 117.04 3bwo h LYS 78 Ca 0.31 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 59.16 3bwo h LYS 78 Cb 0.01 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.26 3bwo h LYS 78 CO -0.09 0.65 0.59 -0.44 -0.57 0.00 0.00 179.45 179.59 3bwo h ASP 79 N -0.74 0.92 0.27 0.86 3.32 -0.76 0.44 116.42 120.73 3bwo h ASP 79 Ca -0.00 0.02 -0.10 0.00 0.02 0.00 0.00 57.03 56.96 3bwo h ASP 79 Cb 0.69 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.05 3bwo h ASP 79 CO 0.00 0.58 -0.41 0.25 -1.72 0.00 0.00 179.24 177.94 3bwo h LEU 80 N 1.05 0.20 0.00 1.55 7.12 -1.13 -1.55 115.31 122.55 3bwo h LEU 80 Ca 0.41 -0.08 -0.10 0.00 0.13 0.00 0.00 57.88 58.24 3bwo h LEU 80 Cb 0.20 -0.05 -0.01 0.00 -0.53 0.00 0.00 40.66 40.26 3bwo h LEU 80 CO -0.18 0.59 -0.55 0.45 -0.13 0.00 0.00 178.44 178.62 3bwo h HIS 81 N 0.16 0.00 -0.03 1.25 3.86 -1.02 -2.93 115.15 116.44 3bwo h HIS 81 Ca 0.01 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.06 3bwo h HIS 81 Cb 0.80 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.26 3bwo h HIS 81 CO 0.01 0.44 -0.71 0.78 0.86 0.00 0.00 177.93 179.31 3bwo h GLY 82 N 3.59 0.17 1.21 2.45 0.00 -0.36 0.93 103.07 111.06 3bwo h GLY 82 Ca -0.02 -0.24 -0.11 0.00 0.00 0.00 0.00 47.33 46.96 3bwo h GLY 82 CO 0.05 0.21 -1.10 -0.24 0.00 0.00 0.00 176.54 175.46 3bwo h VAL 83 N 0.10 0.43 0.00 4.60 3.04 -1.36 -3.35 116.25 119.71 3bwo h VAL 83 Ca -0.02 -1.77 -0.27 0.00 -1.01 0.00 0.00 66.70 63.64 3bwo h VAL 83 Cb 1.26 1.98 -0.05 0.00 -2.01 0.00 0.00 31.29 32.47 3bwo h VAL 83 CO 0.10 0.24 -1.92 0.52 -1.01 0.00 0.00 177.57 175.51 3bwo n VAL 84 N -2.91 1.30 -1.72 1.51 0.31 -1.11 -4.98 118.33 110.74 3bwo n VAL 84 Ca -0.05 -0.77 -0.13 0.00 -0.01 0.00 0.00 64.34 63.38 3bwo n VAL 84 Cb 0.74 -0.67 -0.04 0.00 -0.91 0.00 0.00 33.84 32.97 3bwo n VAL 84 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3bwo n GLY 85 N 1.57 0.78 0.11 2.92 0.00 0.32 -4.62 105.19 106.26 3bwo n GLY 85 Ca -0.20 -0.38 0.12 0.00 0.00 0.00 0.00 46.02 45.56 3bwo n GLY 85 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 3bwo h ASN 86 N 0.00 0.00 -4.68 1.61 -1.07 -1.83 -3.32 115.58 106.29 3bwo h ASN 86 Ca -0.29 -0.07 -0.10 0.00 0.07 0.00 0.00 56.30 55.91 3bwo h ASN 86 Cb 1.01 0.00 -0.21 0.00 -2.07 0.00 0.00 38.32 37.05 3bwo h ASN 86 CO 0.38 0.04 -0.14 0.00 0.07 0.00 0.00 177.43 177.78 3bwo s ALA 87 N -3.27 -1.11 0.17 4.14 0.00 -1.26 -2.00 121.76 118.43 3bwo s ALA 87 Ca 0.03 0.83 -0.18 0.00 0.00 0.00 0.00 51.96 52.64 3bwo s ALA 87 Cb 0.10 -0.18 -0.08 0.00 0.00 0.00 0.00 23.12 22.97 3bwo s ALA 87 CO 0.74 -0.27 0.64 0.00 0.00 0.00 0.00 175.76 176.87 3bwo s ALA 88 N -0.84 3.50 -0.00 0.00 0.00 0.04 -4.74 121.76 119.71 3bwo s ALA 88 Ca -0.09 0.06 0.01 0.00 0.00 0.00 0.00 51.96 51.93 3bwo s ALA 88 Cb -0.03 -2.70 0.01 0.00 0.00 0.00 0.00 23.12 20.40 3bwo s ALA 88 CO 0.04 0.38 0.76 0.25 0.00 0.00 0.00 175.76 177.19 3bwo n THR 89 N 0.98 0.49 -3.13 0.00 -2.24 -1.26 -4.94 114.28 104.18 3bwo n THR 89 Ca -0.05 -0.50 -0.28 0.00 -2.27 0.00 0.00 64.05 60.95 3bwo n THR 89 Cb 0.51 0.72 -0.02 0.00 -2.10 0.00 0.00 70.33 69.44 3bwo n THR 89 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3bwo s GLU 90 N -0.52 3.62 -0.97 -0.78 1.03 -1.26 -4.28 118.70 115.54 3bwo s GLU 90 Ca 0.01 0.08 -0.02 0.00 0.03 0.00 0.00 54.97 55.07 3bwo s GLU 90 Cb 0.01 -2.55 0.01 0.00 -0.80 0.00 0.00 34.13 30.80 3bwo s GLU 90 CO 0.00 0.08 0.10 -0.25 -1.33 0.00 0.00 175.26 173.86 3bwo n ASP 91 N -1.37 -3.51 -4.12 0.83 10.43 -1.26 -4.92 116.55 112.63 3bwo n ASP 91 Ca -0.01 0.12 -0.08 0.00 2.57 0.00 0.00 54.79 57.38 3bwo n ASP 91 Cb 0.54 -2.99 -0.10 0.00 1.84 0.00 0.00 41.12 40.42 3bwo n ASP 91 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3bwo s ARG 92 N -5.22 0.76 -0.12 -1.24 1.70 -1.26 -4.83 118.95 108.74 3bwo s ARG 92 Ca 0.08 -1.32 -0.14 0.00 -0.47 0.00 0.00 55.73 53.88 3bwo s ARG 92 Cb -0.04 0.18 -0.05 0.00 -0.57 0.00 0.00 34.95 34.47 3bwo s ARG 92 CO 0.10 -0.16 0.33 0.71 -1.08 0.00 0.00 175.30 175.19 3bwo s TYR 93 N -3.94 3.54 -0.11 5.89 2.02 0.26 -4.90 117.35 120.12 3bwo s TYR 93 Ca 0.14 0.71 -0.11 0.00 -0.37 0.00 0.00 57.07 57.44 3bwo s TYR 93 Cb 0.08 -2.32 -0.05 0.00 -0.40 0.00 0.00 41.96 39.27 3bwo s TYR 93 CO -0.05 0.36 0.26 0.42 -1.57 0.00 0.00 175.55 174.97 3bwo s ILE 94 N 0.03 5.31 -0.09 2.71 1.01 -1.26 -1.08 121.20 127.82 3bwo s ILE 94 Ca 0.19 0.48 -0.00 0.00 0.00 0.00 0.00 60.65 61.32 3bwo s ILE 94 Cb -0.14 -3.56 0.02 0.00 0.01 0.00 0.00 42.46 38.79 3bwo s ILE 94 CO 0.07 0.52 -0.04 -0.69 0.00 0.00 0.00 174.94 174.80 3bwo s VAL 95 N -0.48 0.72 0.29 2.92 1.01 -0.91 -4.69 120.40 119.26 3bwo s VAL 95 Ca 0.17 -0.12 -0.07 0.00 0.00 0.00 0.00 61.98 61.96 3bwo s VAL 95 Cb -0.13 -0.79 -0.06 0.00 0.00 0.00 0.00 36.38 35.40 3bwo s VAL 95 CO 0.06 0.31 0.58 0.68 0.00 0.00 0.00 175.10 176.73 3bwo s VAL 96 N 1.65 4.96 0.20 2.92 -7.23 -1.26 -0.30 120.40 121.34 3bwo s VAL 96 Ca 0.02 0.26 -0.08 0.00 -1.81 0.00 0.00 61.98 60.36 3bwo s VAL 96 Cb -0.13 -3.70 -0.02 0.00 0.56 0.00 0.00 36.38 33.10 3bwo s VAL 96 CO -0.05 -0.27 0.31 -0.83 -0.31 0.00 0.00 175.10 173.94 3bwo s GLY 97 N -2.92 0.75 -1.19 2.32 0.00 -0.82 -4.89 107.32 100.58 3bwo s GLY 97 Ca 0.46 -1.10 -0.21 0.00 0.00 0.00 0.00 44.72 43.87 3bwo s GLY 97 CO 0.27 -0.91 1.89 2.41 0.00 0.00 0.00 173.10 176.76 3bwo n THR 98 N -0.29 2.59 0.00 0.90 -1.04 -1.26 -2.31 114.28 112.88 3bwo n THR 98 Ca -0.03 -2.63 0.00 0.00 -2.04 0.00 0.00 64.05 59.35 3bwo n THR 98 Cb 0.63 -2.26 0.00 0.00 -1.82 0.00 0.00 70.33 66.88 3bwo n THR 98 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3bwo n GLY 99 N 5.45 -1.79 0.22 3.41 0.00 -0.50 -3.85 105.19 108.13 3bwo n GLY 99 Ca 0.47 -1.53 0.00 0.00 0.00 0.00 0.00 46.02 44.96 3bwo n GLY 99 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3bwo h SER 100 N 0.00 0.23 -0.50 1.61 0.87 -1.80 -2.95 113.55 111.01 3bwo h SER 100 Ca 0.00 -0.07 0.05 0.00 -1.23 0.00 0.00 61.79 60.54 3bwo h SER 100 Cb 0.00 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 3bwo h SER 100 CO 0.00 0.50 0.33 0.71 -0.53 0.00 0.00 176.83 177.85 3bwo h THR 101 N 0.21 1.00 0.00 2.23 1.35 -1.96 0.26 112.91 116.00 3bwo h THR 101 Ca 0.03 -0.17 -0.23 0.00 -0.55 0.00 0.00 66.41 65.49 3bwo h THR 101 Cb 0.59 0.47 0.01 0.00 -1.73 0.00 0.00 68.15 67.49 3bwo h THR 101 CO 0.04 0.09 -0.96 -0.61 -0.25 0.00 0.00 175.52 173.83 3bwo h GLN 102 N 0.49 0.45 -0.63 4.72 4.15 -1.63 -3.05 115.11 119.61 3bwo h GLN 102 Ca 0.21 -0.49 -0.07 0.00 0.77 0.00 0.00 58.65 59.07 3bwo h GLN 102 Cb 0.23 0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.03 3bwo h GLN 102 CO -0.06 1.14 0.10 -0.07 -1.93 0.00 0.00 178.83 178.02 3bwo h LEU 103 N 0.25 0.98 -0.97 -2.39 -0.00 -1.15 -0.84 115.31 111.19 3bwo h LEU 103 Ca -0.09 -0.22 -0.09 0.00 -0.00 0.00 0.00 57.88 57.48 3bwo h LEU 103 Cb 1.60 -0.26 -0.01 0.00 -0.00 0.00 0.00 40.66 41.99 3bwo h LEU 103 CO 0.17 0.98 -0.23 0.00 -0.00 0.00 0.00 178.44 179.35 3bwo h GLN 105 N 0.42 0.16 -0.53 0.00 4.20 -1.38 -2.78 115.11 115.20 3bwo h GLN 105 Ca 0.07 -0.13 -0.12 0.00 0.06 0.00 0.00 58.65 58.53 3bwo h GLN 105 Cb 0.64 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.43 3bwo h GLN 105 CO 0.05 0.79 -0.14 0.00 -0.67 0.00 0.00 178.83 178.85 3bwo h ALA 106 N 1.18 0.73 0.18 3.87 0.00 -0.82 -1.84 119.26 122.56 3bwo h ALA 106 Ca -0.02 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 3bwo h ALA 106 Cb 1.23 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.83 3bwo h ALA 106 CO 0.10 0.67 -0.08 0.00 0.00 0.00 0.00 179.25 179.94 3bwo h ALA 107 N 0.91 -0.24 -0.95 0.00 0.00 -1.23 0.14 119.26 117.90 3bwo h ALA 107 Ca 0.13 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 54.97 3bwo h ALA 107 Cb 0.72 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.52 3bwo h ALA 107 CO 0.05 -0.48 0.59 0.28 0.00 0.00 0.00 179.25 179.69 3bwo h VAL 108 N -0.54 0.98 0.17 0.00 2.07 -1.53 0.33 116.25 117.72 3bwo h VAL 108 Ca -0.02 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 3bwo h VAL 108 Cb 0.41 -0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.08 3bwo h VAL 108 CO 0.04 0.18 -0.08 -0.74 0.02 0.00 0.00 177.57 176.99 3bwo h HIS 109 N 1.00 -0.21 0.01 1.57 6.17 -1.22 -1.90 115.15 120.56 3bwo h HIS 109 Ca 0.44 -0.01 0.02 0.00 0.71 0.00 0.00 60.37 61.54 3bwo h HIS 109 Cb 0.33 0.07 -0.03 0.00 2.52 0.00 0.00 27.41 30.31 3bwo h HIS 109 CO -0.02 0.09 -0.14 0.00 0.71 0.00 0.00 177.93 178.57 3bwo h ALA 110 N 0.24 -0.17 -0.47 5.26 0.00 0.02 0.24 119.26 124.38 3bwo h ALA 110 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3bwo h ALA 110 Cb 0.40 0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 3bwo h ALA 110 CO 0.04 -0.64 0.31 -0.07 0.00 0.00 0.00 179.25 178.89 3bwo h LEU 111 N -0.24 0.55 -1.67 0.00 3.38 -0.45 -2.10 115.31 114.78 3bwo h LEU 111 Ca 0.05 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3bwo h LEU 111 Cb 0.30 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 3bwo h LEU 111 CO -0.13 0.40 -0.06 0.28 0.09 0.00 0.00 178.44 179.02 3bwo h SER 112 N 0.64 0.00 1.89 -0.43 0.02 -1.08 -1.75 113.55 112.84 3bwo h SER 112 Ca 0.17 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 3bwo h SER 112 Cb -0.07 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.47 3bwo h SER 112 CO -0.04 0.06 -0.11 -1.28 -1.14 0.00 0.00 176.83 174.32 3bwo h SER 113 N 0.00 0.00 0.00 3.07 0.87 -0.30 -3.25 113.55 113.95 3bwo h SER 113 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3bwo h SER 113 Cb 0.46 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.42 3bwo h SER 113 CO 0.01 0.00 -1.24 0.18 -0.53 0.00 0.00 176.83 175.25 3bwo n LEU 114 N -3.06 0.52 -4.69 2.23 4.77 -0.90 -5.00 117.00 110.88 3bwo n LEU 114 Ca 0.04 -0.31 -0.32 0.00 -0.03 0.00 0.00 56.01 55.39 3bwo n LEU 114 Cb 0.53 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.77 3bwo n LEU 114 CO 0.35 0.13 0.73 0.00 -1.33 0.00 0.00 177.39 177.27 3bwo s ALA 115 N -2.93 1.69 -1.06 -1.18 0.00 -0.71 -4.91 121.76 112.67 3bwo s ALA 115 Ca 0.02 0.72 0.29 0.00 0.00 0.00 0.00 51.96 52.98 3bwo s ALA 115 Cb 0.13 -3.47 1.19 0.00 0.00 0.00 0.00 23.12 20.97 3bwo s ALA 115 CO 0.75 -2.48 1.89 2.89 0.00 0.00 0.00 175.76 178.81 3bwo n ARG 116 N -3.70 0.06 -3.48 0.00 1.85 -1.26 -4.86 116.66 105.27 3bwo n ARG 116 Ca 0.13 -0.01 -0.15 0.00 -1.00 0.00 0.00 57.85 56.82 3bwo n ARG 116 Cb 0.51 -1.50 -0.04 0.00 -1.05 0.00 0.00 32.46 30.38 3bwo n ARG 116 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 3bwo s SER 117 N -2.94 -0.61 0.08 2.89 1.04 -1.26 -5.15 113.70 107.74 3bwo s SER 117 Ca 0.16 0.42 0.02 0.00 0.48 0.00 0.00 55.95 57.02 3bwo s SER 117 Cb 0.19 0.56 -0.03 0.00 0.10 0.00 0.00 66.02 66.84 3bwo s SER 117 CO 0.54 -0.75 -0.07 -1.10 0.98 0.00 0.00 173.24 172.83 3bwo s GLN 118 N -2.23 0.72 0.25 4.02 -0.21 -1.26 -4.27 119.66 116.67 3bwo s GLN 118 Ca -0.06 -1.11 -0.30 0.00 0.02 0.00 0.00 55.36 53.91 3bwo s GLN 118 Cb -0.00 -0.26 -0.09 0.00 1.00 0.00 0.00 33.01 33.65 3bwo s GLN 118 CO 0.01 0.01 1.07 -1.25 -2.12 0.00 0.00 175.29 173.01 3bwo s PRO 119 N -2.93 4.67 0.15 2.91 0.04 -1.21 -5.03 135.00 133.60 3bwo s PRO 119 Ca 0.03 1.73 -0.30 0.00 0.04 0.00 0.00 61.00 62.51 3bwo s PRO 119 Cb -0.01 -3.23 -0.07 0.00 0.04 0.00 0.00 34.50 31.24 3bwo s PRO 119 CO -0.03 0.23 0.94 0.08 0.04 0.00 0.00 177.00 178.26 3bwo s VAL 120 N -0.94 4.36 0.28 -0.36 1.01 -0.88 -4.76 120.40 119.10 3bwo s VAL 120 Ca 0.45 2.04 -0.29 0.00 0.00 0.00 0.00 61.98 64.18 3bwo s VAL 120 Cb -0.30 -4.31 -0.09 0.00 0.00 0.00 0.00 36.38 31.67 3bwo s VAL 120 CO 0.38 0.39 1.03 -0.44 0.00 0.00 0.00 175.10 176.46 3bwo s SER 121 N -0.45 7.38 -0.13 3.32 0.01 -0.50 -1.05 113.70 122.28 3bwo s SER 121 Ca 0.44 2.11 0.01 0.00 1.31 0.00 0.00 55.95 59.83 3bwo s SER 121 Cb -0.24 -2.62 0.02 0.00 0.21 0.00 0.00 66.02 63.39 3bwo s SER 121 CO 0.30 -0.05 -0.16 -0.69 0.41 0.00 0.00 173.24 173.05 3bwo s VAL 122 N -1.23 1.63 0.22 3.43 1.01 -0.16 0.11 120.40 125.41 3bwo s VAL 122 Ca 0.44 -0.71 0.01 0.00 0.00 0.00 0.00 61.98 61.73 3bwo s VAL 122 Cb -0.28 -1.49 -0.05 0.00 0.00 0.00 0.00 36.38 34.56 3bwo s VAL 122 CO 0.36 0.47 0.05 0.68 0.00 0.00 0.00 175.10 176.66 3bwo s VAL 123 N 1.10 0.61 -0.25 2.92 -7.23 -0.67 -0.31 120.40 116.57 3bwo s VAL 123 Ca -0.03 -1.99 -0.18 0.00 -1.81 0.00 0.00 61.98 57.96 3bwo s VAL 123 Cb -0.14 -2.39 0.07 0.00 0.56 0.00 0.00 36.38 34.48 3bwo s VAL 123 CO -0.04 -0.23 0.64 0.00 -0.31 0.00 0.00 175.10 175.16 3bwo s ALA 124 N -3.71 -1.65 0.10 1.32 0.00 -0.70 -1.56 121.76 115.55 3bwo s ALA 124 Ca 0.31 2.04 -0.31 0.00 0.00 0.00 0.00 51.96 54.00 3bwo s ALA 124 Cb 0.07 -1.20 -0.10 0.00 0.00 0.00 0.00 23.12 21.89 3bwo s ALA 124 CO 0.09 -0.33 1.86 0.00 0.00 0.00 0.00 175.76 177.38 3bwo s ALA 125 N 0.98 3.71 0.35 0.00 0.00 -1.26 -2.01 121.76 123.54 3bwo s ALA 125 Ca -0.05 1.41 -0.26 0.00 0.00 0.00 0.00 51.96 53.06 3bwo s ALA 125 Cb -0.05 -3.79 -0.09 0.00 0.00 0.00 0.00 23.12 19.19 3bwo s ALA 125 CO -0.09 -1.32 1.03 0.00 0.00 0.00 0.00 175.76 175.38 3bwo s ALA 126 N 3.22 3.19 0.32 0.00 0.00 -1.26 -3.53 121.76 123.70 3bwo s ALA 126 Ca 0.83 0.69 -0.28 0.00 0.00 0.00 0.00 51.96 53.20 3bwo s ALA 126 Cb -0.45 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.32 3bwo s ALA 126 CO 0.38 -0.09 1.12 -1.25 0.00 0.00 0.00 175.76 175.92 3bwo s PRO 127 N -2.12 4.46 0.38 0.00 0.04 -1.26 -5.04 135.00 131.46 3bwo s PRO 127 Ca 0.52 1.79 0.08 0.00 0.04 0.00 0.00 61.00 63.44 3bwo s PRO 127 Cb -0.23 -3.00 -0.07 0.00 0.04 0.00 0.00 34.50 31.24 3bwo s PRO 127 CO 0.29 0.05 -0.01 -0.59 0.04 0.00 0.00 177.00 176.78 3bwo s PHE 128 N -1.28 2.49 -0.66 0.56 -0.12 0.72 -4.54 117.98 115.16 3bwo s PHE 128 Ca 0.49 -0.57 -0.26 0.00 -0.05 0.00 0.00 56.93 56.54 3bwo s PHE 128 Cb -0.31 -1.62 -0.05 0.00 -0.63 0.00 0.00 43.02 40.42 3bwo s PHE 128 CO 0.39 0.48 2.08 -0.47 -0.05 0.00 0.00 175.22 177.65 3bwo s TYR 129 N -2.64 1.48 0.28 3.49 5.04 -0.01 -4.41 117.35 120.58 3bwo s TYR 129 Ca 0.35 1.10 0.06 0.00 -2.44 0.00 0.00 57.07 56.13 3bwo s TYR 129 Cb 0.05 -3.88 0.79 0.00 0.35 0.00 0.00 41.96 39.27 3bwo s TYR 129 CO 0.18 -2.18 1.37 -1.13 -1.34 0.00 0.00 175.55 172.45 3bwo n SER 130 N 14.48 -0.01 0.31 4.32 3.41 -1.26 0.31 113.62 135.18 3bwo n SER 130 Ca 0.31 1.48 0.17 0.00 -0.26 0.00 0.00 58.87 60.56 3bwo n SER 130 Cb 0.51 -0.58 0.84 0.00 -0.26 0.00 0.00 64.21 64.72 3bwo n SER 130 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3bwo h THR 131 N 0.00 0.06 -0.18 6.66 2.02 -1.89 0.30 112.91 119.87 3bwo h THR 131 Ca 0.58 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.71 3bwo h THR 131 Cb 1.29 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 3bwo h THR 131 CO -0.79 0.00 -0.12 1.88 0.37 0.00 0.00 175.52 176.86 3bwo h TYR 132 N 0.00 0.30 0.34 3.16 0.05 -0.53 -2.63 116.97 117.66 3bwo h TYR 132 Ca 0.02 -0.04 -0.02 0.00 0.05 0.00 0.00 58.73 58.75 3bwo h TYR 132 Cb 0.65 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.31 3bwo h TYR 132 CO 0.00 0.42 -0.16 0.28 -1.05 0.00 0.00 178.16 177.64 3bwo h VAL 133 N 0.28 0.68 -0.20 -2.88 2.07 -0.58 -2.83 116.25 112.78 3bwo h VAL 133 Ca 0.06 -0.27 -0.07 0.00 0.82 0.00 0.00 66.70 67.24 3bwo h VAL 133 Cb 0.39 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 3bwo h VAL 133 CO 0.02 0.05 -0.18 1.05 0.02 0.00 0.00 177.57 178.53 3bwo h GLU 134 N -0.60 0.34 0.00 1.57 9.09 -1.65 -2.61 114.58 120.71 3bwo h GLU 134 Ca -0.05 -0.10 -0.01 0.00 0.05 0.00 0.00 59.36 59.25 3bwo h GLU 134 Cb 0.44 -0.04 -0.00 0.00 -1.65 0.00 0.00 28.75 27.50 3bwo h GLU 134 CO 0.08 0.52 -0.05 0.93 0.05 0.00 0.00 179.01 180.54 3bwo h GLU 135 N 0.32 0.00 -0.33 1.06 5.08 -1.37 -1.85 114.58 117.48 3bwo h GLU 135 Ca 0.06 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 3bwo h GLU 135 Cb 0.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 3bwo h GLU 135 CO 0.03 0.05 0.01 0.25 -1.00 0.00 0.00 179.01 178.35 3bwo n THR 136 N -4.19 2.41 0.00 1.13 -2.24 -1.00 -4.72 114.28 105.67 3bwo n THR 136 Ca -0.03 -1.81 0.00 0.00 -2.27 0.00 0.00 64.05 59.94 3bwo n THR 136 Cb 0.14 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 3bwo n THR 136 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3bwo n THR 137 N -0.31 0.00 -0.32 4.28 -1.04 -0.92 -4.25 114.28 111.72 3bwo n THR 137 Ca 0.23 0.00 0.33 0.00 -2.04 0.00 0.00 64.05 62.58 3bwo n THR 137 Cb 0.97 -0.57 0.71 0.00 -1.82 0.00 0.00 70.33 69.62 3bwo n THR 137 CO 0.00 0.00 0.00 0.10 -0.64 0.00 0.00 175.07 174.53 3bwo h TYR 138 N 0.00 0.11 -0.01 -1.42 -0.00 -1.63 0.34 116.97 114.37 3bwo h TYR 138 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3bwo h TYR 138 Cb 0.31 -0.03 0.00 0.00 -0.00 0.00 0.00 36.73 37.01 3bwo h TYR 138 CO 0.00 0.00 -0.37 1.33 -0.00 0.00 0.00 178.16 179.13 3bwo n VAL 139 N -4.26 0.00 -3.84 -0.90 0.24 -1.26 -4.97 118.33 103.33 3bwo n VAL 139 Ca 0.26 -0.19 -0.26 0.00 -2.04 0.00 0.00 64.34 62.10 3bwo n VAL 139 Cb 1.19 0.82 0.02 0.00 -1.47 0.00 0.00 33.84 34.40 3bwo n VAL 139 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3bwo n ARG 140 N -0.33 -5.00 -2.42 7.34 1.74 0.11 -4.92 116.66 113.18 3bwo n ARG 140 Ca 0.11 0.58 -0.39 0.00 -0.77 0.00 0.00 57.85 57.38 3bwo n ARG 140 Cb 0.41 -5.26 -0.03 0.00 -1.02 0.00 0.00 32.46 26.55 3bwo n ARG 140 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3bwo s SER 141 N -3.83 6.85 0.00 0.55 0.15 -1.26 -4.95 113.70 111.21 3bwo s SER 141 Ca 0.34 2.25 0.26 0.00 0.70 0.00 0.00 55.95 59.50 3bwo s SER 141 Cb -0.17 -2.61 0.71 0.00 -1.71 0.00 0.00 66.02 62.24 3bwo s SER 141 CO 0.83 -0.44 1.55 0.61 1.20 0.00 0.00 173.24 176.99 3bwo n GLY 142 N 0.75 -1.08 0.25 9.45 0.00 -1.26 -4.01 105.19 109.28 3bwo n GLY 142 Ca 0.02 -0.33 0.16 0.00 0.00 0.00 0.00 46.02 45.87 3bwo n GLY 142 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3bwo h MET 143 N 0.36 0.00 -3.22 1.61 2.86 -1.94 -3.19 114.93 111.41 3bwo h MET 143 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 3bwo h MET 143 Cb 0.49 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.10 3bwo h MET 143 CO 0.00 0.00 0.14 1.52 1.06 0.00 0.00 176.91 179.63 3bwo s TYR 144 N -3.52 0.11 -0.26 -0.22 -0.85 -1.26 -2.07 117.35 109.28 3bwo s TYR 144 Ca 0.03 -0.60 -0.13 0.00 -0.52 0.00 0.00 57.07 55.85 3bwo s TYR 144 Cb 0.08 0.58 0.09 0.00 0.38 0.00 0.00 41.96 43.09 3bwo s TYR 144 CO 0.56 -1.28 0.62 0.21 -1.52 0.00 0.00 175.55 174.14 3bwo s LYS 145 N -3.39 0.61 0.06 -3.49 2.20 -0.21 -4.74 119.74 110.77 3bwo s LYS 145 Ca 0.16 1.20 -0.31 0.00 -0.36 0.00 0.00 55.97 56.67 3bwo s LYS 145 Cb -0.04 0.29 -0.08 0.00 -1.51 0.00 0.00 37.83 36.49 3bwo s LYS 145 CO 0.10 -0.17 1.59 -0.46 -0.36 0.00 0.00 175.35 176.05 3bwo s TRP 146 N 1.95 2.54 -0.51 4.03 -0.11 -1.26 -0.98 118.94 124.60 3bwo s TRP 146 Ca -0.09 0.45 0.11 0.00 1.22 0.00 0.00 56.10 57.80 3bwo s TRP 146 Cb -0.08 -3.89 -0.13 0.00 -1.50 0.00 0.00 33.47 27.87 3bwo s TRP 146 CO -0.18 -3.52 0.48 0.39 -4.62 0.00 0.00 176.95 169.49 3bwo n GLU 147 N 5.48 2.99 0.00 5.86 -0.58 0.58 -4.87 120.64 130.10 3bwo n GLU 147 Ca 0.15 -0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 3bwo n GLU 147 Cb 0.41 -1.06 0.00 0.00 -0.57 0.00 0.00 31.44 30.22 3bwo n GLU 147 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3bwo n GLY 148 N 1.31 0.33 3.59 0.62 0.00 -1.24 -4.96 105.19 104.84 3bwo n GLY 148 Ca 0.02 -1.38 -0.51 0.00 0.00 0.00 0.00 46.02 44.14 3bwo n GLY 148 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3bwo n ASP 149 N 1.29 1.58 0.09 1.61 -0.08 -1.25 -1.73 116.55 118.06 3bwo n ASP 149 Ca 0.00 1.12 -0.05 0.00 -1.51 0.00 0.00 54.79 54.35 3bwo n ASP 149 Cb 0.00 -1.19 0.01 0.00 2.34 0.00 0.00 41.12 42.28 3bwo n ASP 149 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3bwo h ALA 150 N 4.34 0.62 -0.12 -1.67 0.00 -1.74 -3.34 119.26 117.35 3bwo h ALA 150 Ca -0.47 -0.75 0.05 0.00 0.00 0.00 0.00 54.91 53.74 3bwo h ALA 150 Cb 1.34 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.94 3bwo h ALA 150 CO 0.76 1.02 -0.29 -1.49 0.00 0.00 0.00 179.25 179.25 3bwo h TRP 151 N 0.01 -0.79 -1.29 0.00 4.06 -1.85 -2.02 115.95 114.06 3bwo h TRP 151 Ca -0.01 0.03 -0.58 0.00 2.06 0.00 0.00 58.89 60.39 3bwo h TRP 151 Cb 1.47 0.37 -0.21 0.00 -1.00 0.00 0.00 29.16 29.78 3bwo h TRP 151 CO 0.00 -0.37 0.66 0.41 -3.56 0.00 0.00 178.44 175.58 3bwo n GLY 152 N -1.40 4.85 3.22 1.49 0.00 -1.25 -4.87 105.19 107.24 3bwo n GLY 152 Ca -0.03 -2.03 -0.38 0.00 0.00 0.00 0.00 46.02 43.58 3bwo n GLY 152 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3bwo s PHE 153 N -2.70 3.37 0.00 1.61 2.19 -0.76 -4.87 117.98 116.82 3bwo s PHE 153 Ca 0.54 -1.77 0.00 0.00 0.33 0.00 0.00 56.93 56.03 3bwo s PHE 153 Cb 0.40 -2.80 0.00 0.00 -1.31 0.00 0.00 43.02 39.31 3bwo s PHE 153 CO -0.24 -0.85 0.80 -0.40 1.83 0.00 0.00 175.22 176.36 3bwo n ASP 154 N 4.78 1.42 -4.54 6.13 3.85 -1.26 -5.04 116.55 121.89 3bwo n ASP 154 Ca -0.09 -1.64 -0.29 0.00 -0.71 0.00 0.00 54.79 52.06 3bwo n ASP 154 Cb 0.43 0.00 0.23 0.00 -1.35 0.00 0.00 41.12 40.43 3bwo n ASP 154 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 3bwo s LYS 155 N -0.64 -0.38 0.42 0.11 1.02 -1.26 -5.02 119.74 113.99 3bwo s LYS 155 Ca 0.00 1.12 0.07 0.00 0.02 0.00 0.00 55.97 57.18 3bwo s LYS 155 Cb 0.00 -1.60 0.01 0.00 -0.52 0.00 0.00 37.83 35.72 3bwo s LYS 155 CO 0.00 -3.44 0.58 0.21 -0.92 0.00 0.00 175.35 171.77 3bwo s LYS 156 N -4.49 2.83 0.47 1.68 2.47 -1.26 -5.04 119.74 116.41 3bwo s LYS 156 Ca 0.68 -1.19 0.00 0.00 -1.56 0.00 0.00 55.97 53.90 3bwo s LYS 156 Cb -0.25 -2.75 0.00 0.00 -1.46 0.00 0.00 37.83 33.38 3bwo s LYS 156 CO 0.63 -0.27 0.00 0.41 0.16 0.00 0.00 175.35 176.27 3bwo n GLY 157 N -1.87 -2.24 3.74 5.54 0.00 -1.26 -4.92 105.19 104.18 3bwo n GLY 157 Ca 0.07 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 3bwo n GLY 157 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3bwo s PRO 158 N -0.27 4.22 0.08 1.61 0.02 -1.26 -4.82 135.00 134.59 3bwo s PRO 158 Ca 0.00 2.38 -0.06 0.00 0.02 0.00 0.00 61.00 63.34 3bwo s PRO 158 Cb 0.00 -3.11 -0.01 0.00 0.02 0.00 0.00 34.50 31.40 3bwo s PRO 158 CO 0.00 -0.53 0.13 1.52 -0.33 0.00 0.00 177.00 177.79 3bwo s TYR 159 N 0.39 0.29 -0.06 6.54 1.13 -1.26 -1.41 117.35 122.97 3bwo s TYR 159 Ca 0.64 -0.75 0.03 0.00 -1.41 0.00 0.00 57.07 55.58 3bwo s TYR 159 Cb -0.44 -0.16 0.01 0.00 -1.10 0.00 0.00 41.96 40.27 3bwo s TYR 159 CO 0.40 -0.51 -0.14 0.42 -2.51 0.00 0.00 175.55 173.21 3bwo s ILE 160 N -3.89 1.26 -0.10 -3.49 1.01 0.31 -1.02 121.20 115.28 3bwo s ILE 160 Ca 0.07 -0.56 -0.00 0.00 0.00 0.00 0.00 60.65 60.16 3bwo s ILE 160 Cb 0.06 -1.13 -0.03 0.00 0.01 0.00 0.00 42.46 41.37 3bwo s ILE 160 CO -0.10 0.38 -0.08 -0.70 0.00 0.00 0.00 174.94 174.45 3bwo s GLU 161 N 0.54 3.10 -0.24 2.79 2.12 0.27 -1.67 118.70 125.60 3bwo s GLU 161 Ca -0.13 -0.58 -0.09 0.00 0.36 0.00 0.00 54.97 54.53 3bwo s GLU 161 Cb -0.15 -2.67 -0.04 0.00 0.26 0.00 0.00 34.13 31.52 3bwo s GLU 161 CO 0.04 0.47 0.13 -0.51 -0.54 0.00 0.00 175.26 174.84 3bwo s LEU 162 N -0.28 3.89 -0.31 2.70 1.43 -0.60 -0.41 118.68 125.10 3bwo s LEU 162 Ca 0.04 0.02 0.03 0.00 -1.03 0.00 0.00 54.13 53.18 3bwo s LEU 162 Cb -0.13 -2.04 0.08 0.00 0.03 0.00 0.00 46.19 44.13 3bwo s LEU 162 CO 0.03 0.05 -0.01 -0.69 0.23 0.00 0.00 176.35 175.96 3bwo s VAL 163 N 1.15 2.37 -0.20 -1.59 1.01 -0.02 -4.40 120.40 118.73 3bwo s VAL 163 Ca 0.06 -1.97 -0.17 0.00 0.00 0.00 0.00 61.98 59.90 3bwo s VAL 163 Cb -0.14 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 3bwo s VAL 163 CO 0.05 -0.34 0.46 -0.89 0.00 0.00 0.00 175.10 174.38 3bwo s THR 164 N 1.02 5.15 -0.26 3.92 2.01 -1.26 -0.26 115.64 125.97 3bwo s THR 164 Ca 0.02 0.84 -0.04 0.00 0.31 0.00 0.00 61.69 62.81 3bwo s THR 164 Cb -0.20 -3.79 0.14 0.00 0.01 0.00 0.00 72.50 68.66 3bwo s THR 164 CO -0.06 0.21 0.49 -0.55 -0.69 0.00 0.00 174.62 174.02 3bwo s SER 165 N 1.10 -0.53 0.23 3.53 0.15 -0.76 -2.63 113.70 114.79 3bwo s SER 165 Ca 0.22 0.77 -0.31 0.00 0.70 0.00 0.00 55.95 57.33 3bwo s SER 165 Cb -0.15 1.64 -0.14 0.00 -1.71 0.00 0.00 66.02 65.66 3bwo s SER 165 CO 0.09 -0.26 1.30 -2.65 1.20 0.00 0.00 173.24 172.92 3bwo n PRO 166 N 5.40 1.72 -1.23 5.44 -0.02 -1.26 -4.01 135.00 141.04 3bwo n PRO 166 Ca -0.05 0.61 -0.30 0.00 -2.02 0.00 0.00 63.50 61.74 3bwo n PRO 166 Cb 0.50 -2.20 0.12 0.00 -0.02 0.00 0.00 33.50 31.90 3bwo n PRO 166 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3bwo s ASN 167 N 0.11 3.91 -0.14 2.55 2.47 0.02 -4.59 114.94 119.27 3bwo s ASN 167 Ca 0.68 1.62 0.01 0.00 0.42 0.00 0.00 52.86 55.60 3bwo s ASN 167 Cb -0.71 -2.31 0.02 0.00 -1.45 0.00 0.00 41.25 36.79 3bwo s ASN 167 CO 0.52 -2.38 -0.17 0.21 -3.72 0.00 0.00 177.10 171.55 3bwo s ASN 168 N -3.42 2.81 -0.04 -4.21 3.84 -1.26 -1.74 114.94 110.92 3bwo s ASN 168 Ca 0.62 -0.53 0.10 0.00 0.21 0.00 0.00 52.86 53.26 3bwo s ASN 168 Cb -0.18 -1.28 -0.23 0.00 -0.55 0.00 0.00 41.25 39.01 3bwo s ASN 168 CO 0.57 0.01 0.67 1.55 -2.79 0.00 0.00 177.10 177.10 3bwo h PRO 169 N 7.70 0.03 0.00 0.43 0.13 -1.80 0.01 132.00 138.50 3bwo h PRO 169 Ca -0.37 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 3bwo h PRO 169 Cb 1.16 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3bwo h PRO 169 CO 0.55 0.60 0.00 -0.40 -0.23 0.00 0.00 178.00 178.52 3bwo n ASP 170 N -3.11 0.00 -1.24 1.44 5.68 -1.26 -4.36 116.55 113.70 3bwo n ASP 170 Ca -0.17 -0.23 -0.16 0.00 -0.50 0.00 0.00 54.79 53.73 3bwo n ASP 170 Cb 1.05 -0.10 -0.07 0.00 -1.14 0.00 0.00 41.12 40.86 3bwo n ASP 170 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3bwo n GLY 171 N -0.19 1.52 3.77 6.12 0.00 -0.71 -4.85 105.19 110.85 3bwo n GLY 171 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 3bwo n GLY 171 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3bwo s THR 172 N -2.35 3.48 0.06 2.61 2.01 -1.26 -4.18 115.64 116.00 3bwo s THR 172 Ca 0.00 1.34 -0.31 0.00 0.31 0.00 0.00 61.69 63.03 3bwo s THR 172 Cb 0.00 -3.79 -0.05 0.00 0.01 0.00 0.00 72.50 68.66 3bwo s THR 172 CO 0.00 0.21 1.20 -0.63 -0.69 0.00 0.00 174.62 174.70 3bwo s ILE 173 N -1.35 4.06 0.29 1.82 -1.09 -1.26 -0.80 121.20 122.86 3bwo s ILE 173 Ca 0.51 1.47 0.05 0.00 -2.23 0.00 0.00 60.65 60.44 3bwo s ILE 173 Cb -0.29 -3.94 -0.06 0.00 -1.58 0.00 0.00 42.46 36.59 3bwo s ILE 173 CO 0.37 0.11 0.01 -0.13 -1.23 0.00 0.00 174.94 174.07 3bwo s ARG 174 N 1.11 1.55 0.28 2.79 0.52 -1.26 -4.98 118.95 118.96 3bwo s ARG 174 Ca 0.59 -1.82 -0.02 0.00 -0.52 0.00 0.00 55.73 53.95 3bwo s ARG 174 Cb -0.29 -0.91 -0.02 0.00 0.52 0.00 0.00 34.95 34.25 3bwo s ARG 174 CO 0.29 -0.10 0.33 -2.00 0.02 0.00 0.00 175.30 173.85 3bwo s GLU 175 N -3.83 1.59 0.23 3.54 2.56 -1.26 -4.86 118.70 116.67 3bwo s GLU 175 Ca 0.32 -1.66 -0.30 0.00 0.00 0.00 0.00 54.97 53.33 3bwo s GLU 175 Cb 0.07 0.37 -0.10 0.00 2.00 0.00 0.00 34.13 36.47 3bwo s GLU 175 CO 0.13 -0.61 1.49 0.95 -0.56 0.00 0.00 175.26 176.66 3bwo s THR 176 N -3.67 2.60 -0.19 -1.70 -4.23 -1.26 -4.93 115.64 102.26 3bwo s THR 176 Ca 0.33 0.48 0.16 0.00 -1.18 0.00 0.00 61.69 61.48 3bwo s THR 176 Cb 0.02 -3.31 0.48 0.00 1.34 0.00 0.00 72.50 71.03 3bwo s THR 176 CO 0.17 0.07 1.37 1.33 -0.54 0.00 0.00 174.62 177.01 3bwo n VAL 177 N 2.77 2.26 0.00 2.29 0.24 -1.26 -5.21 118.33 119.42 3bwo n VAL 177 Ca 0.09 -2.15 0.00 0.00 -2.04 0.00 0.00 64.34 60.24 3bwo n VAL 177 Cb 0.40 -0.27 0.00 0.00 -1.47 0.00 0.00 33.84 32.50 3bwo n VAL 177 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 3bwo n VAL 178 N -0.83 0.00 0.00 3.34 3.14 -1.26 -4.71 118.33 118.01 3bwo n VAL 178 Ca 0.22 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.60 3bwo n VAL 178 Cb 0.87 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.65 3bwo n VAL 178 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3bwo n ALA 186 N -3.00 0.00 -2.46 1.55 0.00 -1.26 -5.21 120.51 110.13 3bwo n ALA 186 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 3bwo n ALA 186 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 3bwo n ALA 186 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3bwo s LYS 187 N -0.20 1.24 0.02 0.00 -0.14 -0.19 -4.99 119.74 115.49 3bwo s LYS 187 Ca 0.00 -1.38 0.01 0.00 -1.36 0.00 0.00 55.97 53.24 3bwo s LYS 187 Cb 0.00 -1.30 -0.02 0.00 -1.68 0.00 0.00 37.83 34.84 3bwo s LYS 187 CO 0.00 0.26 -0.05 0.54 -0.76 0.00 0.00 175.35 175.35 3bwo s VAL 188 N -2.01 0.32 -0.14 3.17 0.11 -1.26 -0.57 120.40 120.03 3bwo s VAL 188 Ca 0.15 -0.71 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 3bwo s VAL 188 Cb -0.06 -0.38 0.02 0.00 -1.53 0.00 0.00 36.38 34.43 3bwo s VAL 188 CO 0.06 -0.26 -0.13 -0.63 -3.33 0.00 0.00 175.10 170.81 3bwo s ILE 189 N -0.96 1.48 -0.31 7.04 1.01 0.46 -4.50 121.20 125.41 3bwo s ILE 189 Ca -0.08 -0.58 -0.15 0.00 0.00 0.00 0.00 60.65 59.84 3bwo s ILE 189 Cb -0.07 -1.39 -0.02 0.00 0.01 0.00 0.00 42.46 40.99 3bwo s ILE 189 CO -0.00 0.44 0.38 -1.00 0.00 0.00 0.00 174.94 174.76 3bwo s HIS 190 N 1.45 3.22 -0.55 3.97 3.76 -0.58 -0.84 115.29 125.71 3bwo s HIS 190 Ca 0.03 0.18 -0.15 0.00 -0.15 0.00 0.00 55.06 54.97 3bwo s HIS 190 Cb -0.13 -2.65 0.14 0.00 1.11 0.00 0.00 32.58 31.04 3bwo s HIS 190 CO -0.09 -0.36 0.50 0.34 -0.85 0.00 0.00 174.74 174.28 3bwo s ASP 191 N 1.70 6.16 -0.77 1.40 -1.08 0.64 -0.48 116.67 124.25 3bwo s ASP 191 Ca 0.14 -1.88 -0.01 0.00 -0.52 0.00 0.00 52.55 50.28 3bwo s ASP 191 Cb -0.16 -2.18 0.37 0.00 -1.46 0.00 0.00 42.92 39.49 3bwo s ASP 191 CO 0.11 -0.82 1.91 0.49 0.52 0.00 0.00 175.17 177.38 3bwo n PHE 192 N 5.11 3.06 -0.26 -5.34 3.72 -0.39 -1.82 117.46 121.53 3bwo n PHE 192 Ca -0.11 -2.51 0.05 0.00 -0.05 0.00 0.00 57.45 54.83 3bwo n PHE 192 Cb 0.41 -1.08 0.28 0.00 -0.94 0.00 0.00 39.48 38.15 3bwo n PHE 192 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3bwo h ALA 193 N 2.80 1.58 -0.26 4.37 0.00 -1.82 -2.75 119.26 123.19 3bwo h ALA 193 Ca 0.54 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.43 3bwo h ALA 193 Cb 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.81 3bwo h ALA 193 CO 1.38 0.28 0.00 0.66 0.00 0.00 0.00 179.25 181.57 3bwo n TYR 194 N -4.49 0.37 -1.03 0.00 4.01 -1.26 -4.59 117.16 110.17 3bwo n TYR 194 Ca 0.13 -0.52 -0.32 0.00 -0.16 0.00 0.00 57.90 57.03 3bwo n TYR 194 Cb 0.22 -0.05 -0.03 0.00 -0.31 0.00 0.00 39.34 39.17 3bwo n TYR 194 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 3bwo n TYR 195 N 0.20 1.89 -4.24 -0.72 9.36 -1.04 -4.50 117.16 118.12 3bwo n TYR 195 Ca 0.09 -2.26 -0.15 0.00 3.32 0.00 0.00 57.90 58.90 3bwo n TYR 195 Cb 0.41 -1.93 -0.10 0.00 -0.63 0.00 0.00 39.34 37.08 3bwo n TYR 195 CO 0.00 0.00 0.00 -1.58 0.22 0.00 0.00 176.86 175.50 3bwo s TRP 196 N 3.45 1.25 0.47 2.98 0.52 -1.26 -4.97 118.94 121.38 3bwo s TRP 196 Ca 0.50 -0.70 0.29 0.00 0.02 0.00 0.00 56.10 56.21 3bwo s TRP 196 Cb 0.13 -0.65 1.36 0.00 -1.15 0.00 0.00 33.47 33.17 3bwo s TRP 196 CO -0.01 0.08 1.74 -1.35 0.02 0.00 0.00 176.95 177.43 3bwo h PRO 197 N 3.05 0.17 -0.00 4.98 0.11 -1.88 -0.24 132.00 138.18 3bwo h PRO 197 Ca -0.37 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3bwo h PRO 197 Cb 1.19 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3bwo h PRO 197 CO 0.59 0.11 -0.29 -2.39 -0.21 0.00 0.00 178.00 175.82 3bwo n HIS 198 N -4.44 0.00 -0.06 0.65 1.44 -1.26 -3.94 115.22 107.61 3bwo n HIS 198 Ca 0.29 0.00 -0.05 0.00 -2.01 0.00 0.00 57.72 55.95 3bwo n HIS 198 Cb 1.18 -0.28 -0.11 0.00 0.12 0.00 0.00 29.99 30.90 3bwo n HIS 198 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 3bwo n TYR 199 N -1.31 0.00 -3.54 -1.40 4.01 -0.18 -4.34 117.16 110.40 3bwo n TYR 199 Ca 0.08 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.71 3bwo n TYR 199 Cb 0.33 -0.63 -0.04 0.00 -0.31 0.00 0.00 39.34 38.68 3bwo n TYR 199 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 3bwo s THR 200 N -2.42 0.00 0.33 -0.72 -1.32 -0.70 -1.71 115.64 109.10 3bwo s THR 200 Ca -0.07 0.00 -0.28 0.00 -1.21 0.00 0.00 61.69 60.13 3bwo s THR 200 Cb 0.05 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.94 3bwo s THR 200 CO 0.57 0.00 1.28 -2.16 -2.21 0.00 0.00 174.62 172.10 3bwo s PRO 201 N -1.86 4.35 -0.99 7.08 0.04 -1.26 -3.78 135.00 138.57 3bwo s PRO 201 Ca -0.01 2.16 -0.22 0.00 0.04 0.00 0.00 61.00 62.97 3bwo s PRO 201 Cb -0.01 -3.05 0.07 0.00 0.04 0.00 0.00 34.50 31.55 3bwo s PRO 201 CO -0.01 -0.17 1.36 0.42 0.04 0.00 0.00 177.00 178.64 3bwo s ILE 202 N -1.16 4.13 0.22 0.56 -1.09 -1.26 -4.81 121.20 117.79 3bwo s ILE 202 Ca 0.49 -0.96 0.11 0.00 -2.23 0.00 0.00 60.65 58.06 3bwo s ILE 202 Cb -0.39 -4.98 -0.05 0.00 -1.58 0.00 0.00 42.46 35.46 3bwo s ILE 202 CO 0.51 -1.82 1.55 0.71 -1.23 0.00 0.00 174.94 174.66 3bwo h THR 203 N 6.54 1.43 -3.38 2.92 1.35 -1.93 -0.67 112.91 119.17 3bwo h THR 203 Ca 0.18 -2.33 -0.05 0.00 -0.55 0.00 0.00 66.41 63.66 3bwo h THR 203 Cb 1.01 2.28 -0.13 0.00 -1.73 0.00 0.00 68.15 69.58 3bwo h THR 203 CO 1.34 0.66 -0.06 0.00 -0.25 0.00 0.00 175.52 177.21 3bwo s ARG 204 N -3.40 1.08 -0.92 4.72 1.70 -1.26 -4.86 118.95 116.00 3bwo s ARG 204 Ca -0.01 -0.70 -0.16 0.00 -0.47 0.00 0.00 55.73 54.39 3bwo s ARG 204 Cb 0.12 0.47 0.18 0.00 -0.57 0.00 0.00 34.95 35.15 3bwo s ARG 204 CO 0.77 -0.42 1.01 0.50 -1.08 0.00 0.00 175.30 176.07 3bwo s ARG 205 N -3.80 3.67 0.31 3.89 3.52 -1.25 -4.65 118.95 120.63 3bwo s ARG 205 Ca 0.03 -2.17 -0.26 0.00 -0.13 0.00 0.00 55.73 53.20 3bwo s ARG 205 Cb 0.02 -4.72 -0.15 0.00 -1.56 0.00 0.00 34.95 28.54 3bwo s ARG 205 CO -0.12 -1.56 0.67 1.04 -0.81 0.00 0.00 175.30 174.52 3bwo n GLN 206 N 5.30 0.62 -2.86 5.12 1.13 -0.85 -4.50 117.38 121.35 3bwo n GLN 206 Ca 0.21 0.22 -0.11 0.00 -1.94 0.00 0.00 57.00 55.38 3bwo n GLN 206 Cb 0.47 -1.43 0.05 0.00 0.11 0.00 0.00 30.24 29.44 3bwo n GLN 206 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3bwo n ASP 207 N 1.54 -0.92 -2.27 1.08 -0.08 -1.26 -0.78 116.55 113.86 3bwo n ASP 207 Ca 0.13 -3.19 -0.02 0.00 -1.51 0.00 0.00 54.79 50.19 3bwo n ASP 207 Cb 0.32 0.76 0.01 0.00 2.34 0.00 0.00 41.12 44.55 3bwo n ASP 207 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 3bwo n HIS 208 N 0.14 -3.15 0.00 -0.67 8.25 -1.26 -5.05 115.22 113.49 3bwo n HIS 208 Ca 0.11 -0.19 -0.17 0.00 -0.26 0.00 0.00 57.72 57.20 3bwo n HIS 208 Cb 0.72 -0.06 -0.11 0.00 1.12 0.00 0.00 29.99 31.66 3bwo n HIS 208 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 3bwo h ASP 209 N -0.03 0.49 -3.44 0.41 3.32 -1.89 -3.44 116.42 111.84 3bwo h ASP 209 Ca -0.03 -0.78 -0.56 0.00 0.02 0.00 0.00 57.03 55.68 3bwo h ASP 209 Cb 0.12 -0.15 -0.39 0.00 0.22 0.00 0.00 39.33 39.13 3bwo h ASP 209 CO 0.04 1.21 -0.77 -0.63 -1.72 0.00 0.00 179.24 177.36 3bwo s ILE 210 N -3.13 1.01 -0.14 0.35 1.01 -1.25 -1.83 121.20 117.22 3bwo s ILE 210 Ca -0.14 -0.90 -0.00 0.00 0.00 0.00 0.00 60.65 59.62 3bwo s ILE 210 Cb 0.03 -1.41 -0.01 0.00 0.01 0.00 0.00 42.46 41.08 3bwo s ILE 210 CO 0.81 -0.17 -0.14 -0.04 0.00 0.00 0.00 174.94 175.40 3bwo s MET 211 N 1.63 3.32 -0.09 2.79 -1.94 0.28 -1.53 119.30 123.76 3bwo s MET 211 Ca -0.03 -0.71 -0.02 0.00 -1.71 0.00 0.00 55.69 53.22 3bwo s MET 211 Cb -0.18 -2.64 -0.03 0.00 2.01 0.00 0.00 34.83 33.99 3bwo s MET 211 CO -0.08 0.13 0.02 -0.51 -0.01 0.00 0.00 175.02 174.58 3bwo s LEU 212 N 0.55 3.71 -0.03 -0.03 1.02 0.37 -0.23 118.68 124.05 3bwo s LEU 212 Ca -0.09 0.19 -0.03 0.00 0.02 0.00 0.00 54.13 54.22 3bwo s LEU 212 Cb -0.16 -1.88 0.01 0.00 0.02 0.00 0.00 46.19 44.18 3bwo s LEU 212 CO 0.04 0.38 0.08 -0.36 0.02 0.00 0.00 176.35 176.51 3bwo s PHE 213 N -0.92 -0.05 -0.07 0.29 0.08 -0.39 -1.26 117.98 115.65 3bwo s PHE 213 Ca 0.14 0.14 0.05 0.00 0.12 0.00 0.00 56.93 57.38 3bwo s PHE 213 Cb -0.11 0.01 -0.01 0.00 -0.57 0.00 0.00 43.02 42.33 3bwo s PHE 213 CO 0.03 -0.08 -0.23 -0.08 -0.10 0.00 0.00 175.22 174.76 3bwo s THR 214 N -0.20 2.19 0.35 0.64 -1.32 -1.26 -1.03 115.64 115.00 3bwo s THR 214 Ca -0.03 -1.01 0.33 0.00 -1.21 0.00 0.00 61.69 59.78 3bwo s THR 214 Cb -0.02 -1.81 0.36 0.00 -1.51 0.00 0.00 72.50 69.52 3bwo s THR 214 CO 0.00 0.57 2.09 0.15 -2.21 0.00 0.00 174.62 175.22 3bwo h PHE 215 N 6.18 0.00 0.00 9.09 -0.00 -1.51 -3.30 116.94 127.40 3bwo h PHE 215 Ca -0.30 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.67 3bwo h PHE 215 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.14 3bwo h PHE 215 CO 0.44 0.06 0.00 0.43 -0.00 0.00 0.00 178.31 179.25 3bwo n SER 216 N -3.31 0.00 0.00 0.41 7.64 -1.26 -3.27 113.62 113.83 3bwo n SER 216 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.87 3bwo n SER 216 Cb 0.24 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.44 3bwo n SER 216 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 3bwo n ILE 218 N -0.54 0.00 0.63 0.44 5.41 -1.24 -1.53 119.36 122.52 3bwo n ILE 218 Ca 0.00 0.00 0.08 0.00 1.00 0.00 0.00 62.75 63.83 3bwo n ILE 218 Cb 0.00 0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 38.83 3bwo n ILE 218 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3bwo n THR 219 N 0.00 0.00 -0.45 1.39 -2.24 -1.20 -5.00 114.28 106.77 3bwo n THR 219 Ca 0.00 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 3bwo n THR 219 Cb 0.00 0.84 0.00 0.00 -2.10 0.00 0.00 70.33 69.07 3bwo n THR 219 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3bwo n GLY 220 N 1.42 0.75 2.44 3.38 0.00 -0.58 -4.72 105.19 107.86 3bwo n GLY 220 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 3bwo n GLY 220 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3bwo n HIS 221 N -2.20 2.68 0.01 1.61 8.25 -1.23 -4.66 115.22 119.68 3bwo n HIS 221 Ca 0.00 -3.03 0.02 0.00 -0.26 0.00 0.00 57.72 54.45 3bwo n HIS 221 Cb 0.00 -2.40 0.36 0.00 1.12 0.00 0.00 29.99 29.08 3bwo n HIS 221 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3bwo h ALA 222 N 5.17 1.54 0.00 -1.41 0.00 -1.84 -2.75 119.26 119.97 3bwo h ALA 222 Ca 0.78 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.57 3bwo h ALA 222 Cb 0.37 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3bwo h ALA 222 CO 1.76 0.35 0.00 0.78 0.00 0.00 0.00 179.25 182.14 3bwo h GLY 223 N 0.69 0.00 2.00 0.00 0.00 -1.96 -2.21 103.07 101.60 3bwo h GLY 223 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 3bwo h GLY 223 CO -0.01 0.00 0.00 1.76 0.00 0.00 0.00 176.54 178.29 3bwo h SER 224 N 0.00 0.00 -6.23 0.19 0.02 -1.88 -3.47 113.55 102.18 3bwo h SER 224 Ca 0.00 0.00 -0.44 0.00 -0.84 0.00 0.00 61.79 60.51 3bwo h SER 224 Cb 0.20 0.00 0.06 0.00 0.14 0.00 0.00 62.40 62.80 3bwo h SER 224 CO 0.00 0.00 -0.92 0.54 -1.14 0.00 0.00 176.83 175.31 3bwo n ARG 225 N -3.03 -2.01 -4.66 3.45 5.12 -0.83 -4.79 116.66 109.91 3bwo n ARG 225 Ca 0.02 0.48 -0.26 0.00 -1.93 0.00 0.00 57.85 56.16 3bwo n ARG 225 Cb 0.38 -4.37 -0.17 0.00 -1.16 0.00 0.00 32.46 27.15 3bwo n ARG 225 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3bwo s ILE 226 N -3.57 1.29 0.12 0.55 -1.09 -1.26 -1.41 121.20 115.83 3bwo s ILE 226 Ca 0.34 -0.56 -0.06 0.00 -2.23 0.00 0.00 60.65 58.13 3bwo s ILE 226 Cb -0.12 -1.17 -0.02 0.00 -1.58 0.00 0.00 42.46 39.58 3bwo s ILE 226 CO 0.86 0.39 0.17 -0.83 -1.23 0.00 0.00 174.94 174.30 3bwo s GLY 227 N 0.66 0.43 0.03 6.18 0.00 -0.98 -1.18 107.32 112.46 3bwo s GLY 227 Ca -0.14 -0.93 -0.12 0.00 0.00 0.00 0.00 44.72 43.53 3bwo s GLY 227 CO 0.04 -0.98 0.25 0.66 0.00 0.00 0.00 173.10 173.07 3bwo s TRP 228 N -3.94 -0.04 0.17 1.90 -2.14 -0.20 -1.94 118.94 112.76 3bwo s TRP 228 Ca 0.13 -0.10 0.10 0.00 2.66 0.00 0.00 56.10 58.89 3bwo s TRP 228 Cb 0.05 0.04 -0.04 0.00 -3.10 0.00 0.00 33.47 30.42 3bwo s TRP 228 CO -0.05 -0.45 -0.23 0.00 -2.66 0.00 0.00 176.95 173.56 3bwo s ALA 229 N -2.35 2.33 -0.27 2.67 0.00 0.58 -1.26 121.76 123.46 3bwo s ALA 229 Ca -0.07 -1.54 -0.01 0.00 0.00 0.00 0.00 51.96 50.34 3bwo s ALA 229 Cb -0.02 -0.30 0.04 0.00 0.00 0.00 0.00 23.12 22.84 3bwo s ALA 229 CO -0.02 0.40 -0.05 -0.51 0.00 0.00 0.00 175.76 175.58 3bwo s LEU 230 N -2.49 3.48 -0.09 0.00 1.43 0.68 -2.13 118.68 119.56 3bwo s LEU 230 Ca 0.17 -1.13 0.03 0.00 -1.03 0.00 0.00 54.13 52.17 3bwo s LEU 230 Cb -0.08 -1.65 0.01 0.00 0.03 0.00 0.00 46.19 44.50 3bwo s LEU 230 CO 0.08 -0.19 -0.18 -0.69 0.23 0.00 0.00 176.35 175.60 3bwo s VAL 231 N 1.25 1.62 -0.15 -1.59 1.01 -0.25 -0.56 120.40 121.73 3bwo s VAL 231 Ca -0.04 -0.75 -0.15 0.00 0.00 0.00 0.00 61.98 61.03 3bwo s VAL 231 Cb -0.18 -1.44 -0.12 0.00 0.00 0.00 0.00 36.38 34.63 3bwo s VAL 231 CO -0.04 0.46 0.19 0.11 0.00 0.00 0.00 175.10 175.83 3bwo h LYS 232 N 6.95 0.00 -6.21 2.72 1.57 -1.65 0.76 116.57 120.71 3bwo h LYS 232 Ca -0.26 0.00 -0.57 0.00 -1.87 0.00 0.00 60.65 57.95 3bwo h LYS 232 Cb 1.21 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.51 3bwo h LYS 232 CO 0.48 0.53 1.28 0.34 -0.57 0.00 0.00 179.45 181.50 3bwo s ASP 233 N -6.15 6.03 0.17 0.86 2.15 -1.26 -4.66 116.67 113.82 3bwo s ASP 233 Ca -0.17 1.81 -0.14 0.00 0.43 0.00 0.00 52.55 54.49 3bwo s ASP 233 Cb 0.02 -2.52 0.09 0.00 -0.30 0.00 0.00 42.92 40.21 3bwo s ASP 233 CO 0.39 -1.51 1.81 0.50 -0.17 0.00 0.00 175.17 176.19 3bwo h LYS 234 N 12.35 0.58 -0.94 4.34 3.64 -1.99 -2.00 116.57 132.56 3bwo h LYS 234 Ca -0.38 -0.04 0.11 0.00 -1.27 0.00 0.00 60.65 59.07 3bwo h LYS 234 Cb 1.19 -0.13 -0.07 0.00 -0.41 0.00 0.00 32.23 32.81 3bwo h LYS 234 CO 0.98 0.39 0.60 1.49 -2.27 0.00 0.00 179.45 180.64 3bwo h GLU 235 N 0.60 0.90 0.01 1.90 4.57 -1.99 0.73 114.58 121.31 3bwo h GLU 235 Ca 0.20 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.33 3bwo h GLU 235 Cb 0.02 -0.20 0.00 0.00 -0.16 0.00 0.00 28.75 28.41 3bwo h GLU 235 CO -0.09 0.59 -0.01 0.28 -1.18 0.00 0.00 179.01 178.61 3bwo h VAL 236 N 0.93 1.28 -0.93 0.32 2.07 -1.81 -2.49 116.25 115.62 3bwo h VAL 236 Ca 0.45 -0.89 0.08 0.00 0.82 0.00 0.00 66.70 67.16 3bwo h VAL 236 Cb 0.45 1.88 -0.06 0.00 -1.52 0.00 0.00 31.29 32.04 3bwo h VAL 236 CO -0.21 0.23 0.60 0.00 0.02 0.00 0.00 177.57 178.21 3bwo h ALA 237 N 0.59 1.53 -0.52 1.67 0.00 -0.66 -0.18 119.26 121.69 3bwo h ALA 237 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3bwo h ALA 237 Cb 0.39 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3bwo h ALA 237 CO 0.00 0.31 0.24 -0.22 0.00 0.00 0.00 179.25 179.58 3bwo h LYS 238 N 1.01 0.76 -0.02 0.00 3.64 -0.81 -0.49 116.57 120.65 3bwo h LYS 238 Ca 0.41 -0.12 -0.14 0.00 -1.27 0.00 0.00 60.65 59.54 3bwo h LYS 238 Cb 0.28 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 3bwo h LYS 238 CO -0.17 0.64 -0.63 0.87 -2.27 0.00 0.00 179.45 177.89 3bwo h LYS 239 N 0.70 0.06 -0.33 1.90 1.79 -0.90 -1.55 116.57 118.24 3bwo h LYS 239 Ca 0.18 -0.05 -0.06 0.00 -2.18 0.00 0.00 60.65 58.54 3bwo h LYS 239 Cb 0.14 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 3bwo h LYS 239 CO -0.02 0.67 -0.04 0.52 -1.08 0.00 0.00 179.45 179.49 3bwo h MET 240 N 0.05 0.61 0.41 3.15 2.86 -0.62 -1.84 114.93 119.55 3bwo h MET 240 Ca -0.01 -0.22 -0.02 0.00 -2.06 0.00 0.00 59.70 57.39 3bwo h MET 240 Cb 1.12 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.74 3bwo h MET 240 CO 0.09 0.77 -0.20 0.28 1.06 0.00 0.00 176.91 178.91 3bwo h VAL 241 N 0.40 0.60 -1.03 -2.22 2.07 -0.98 -2.44 116.25 112.65 3bwo h VAL 241 Ca 0.09 -0.09 0.27 0.00 0.82 0.00 0.00 66.70 67.78 3bwo h VAL 241 Cb 0.52 0.65 -0.08 0.00 -1.52 0.00 0.00 31.29 30.86 3bwo h VAL 241 CO 0.03 0.02 0.69 -0.33 0.02 0.00 0.00 177.57 177.99 3bwo h GLU 242 N -0.60 0.29 -0.22 1.57 5.08 -1.26 -0.20 114.58 119.24 3bwo h GLU 242 Ca -0.06 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 3bwo h GLU 242 Cb 0.45 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.63 3bwo h GLU 242 CO 0.09 0.19 -0.12 -0.92 -1.00 0.00 0.00 179.01 177.25 3bwo h TYR 243 N 0.30 0.55 -0.21 4.33 3.20 -0.99 -2.88 116.97 121.27 3bwo h TYR 243 Ca 0.56 -0.14 -0.12 0.00 3.14 0.00 0.00 58.73 62.17 3bwo h TYR 243 Cb 1.60 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 39.73 3bwo h TYR 243 CO -0.00 0.76 -0.37 0.82 -1.64 0.00 0.00 178.16 177.73 3bwo h ILE 244 N 0.18 1.30 -0.01 1.81 2.04 -0.63 0.01 117.51 122.21 3bwo h ILE 244 Ca 0.05 -1.49 0.01 0.00 1.00 0.00 0.00 64.86 64.42 3bwo h ILE 244 Cb 0.63 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 38.24 3bwo h ILE 244 CO 0.04 0.47 -0.04 0.40 0.00 0.00 0.00 178.15 179.01 3bwo h ILE 245 N 0.39 0.89 -0.09 -0.67 2.04 -1.16 0.15 117.51 119.07 3bwo h ILE 245 Ca 0.04 0.00 -0.14 0.00 1.00 0.00 0.00 64.86 65.76 3bwo h ILE 245 Cb 0.83 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 3bwo h ILE 245 CO 0.07 0.00 -0.55 0.58 0.00 0.00 0.00 178.15 178.25 3bwo h VAL 246 N -0.07 1.36 -0.06 1.67 2.07 -1.43 0.57 116.25 120.37 3bwo h VAL 246 Ca 0.02 -1.85 -0.14 0.00 0.82 0.00 0.00 66.70 65.55 3bwo h VAL 246 Cb 0.10 1.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 3bwo h VAL 246 CO -0.05 0.55 -0.60 -1.13 0.02 0.00 0.00 177.57 176.36 3bwo h ASN 247 N 0.20 0.23 0.00 0.57 -0.00 -0.64 -3.42 115.58 112.52 3bwo h ASN 247 Ca 0.00 -0.13 0.00 0.00 -0.00 0.00 0.00 56.30 56.17 3bwo h ASN 247 Cb 1.03 -0.07 0.00 0.00 -0.00 0.00 0.00 38.32 39.28 3bwo h ASN 247 CO 0.09 0.78 0.00 -1.54 -0.00 0.00 0.00 177.43 176.75 3bwo n SER 248 N -3.87 0.00 -4.19 1.15 3.41 0.49 -5.02 113.62 105.59 3bwo n SER 248 Ca -0.02 -0.53 -0.30 0.00 -0.26 0.00 0.00 58.87 57.77 3bwo n SER 248 Cb 0.61 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.49 3bwo n SER 248 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3bwo n ILE 249 N 0.00 -1.74 0.00 -1.33 5.41 0.20 -4.65 119.36 117.26 3bwo n ILE 249 Ca 0.00 -0.51 0.00 0.00 1.00 0.00 0.00 62.75 63.24 3bwo n ILE 249 Cb 0.26 -1.58 0.00 0.00 -0.71 0.00 0.00 39.64 37.61 3bwo n ILE 249 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3bwo n GLY 250 N -2.38 -1.69 3.18 7.39 0.00 -1.22 -4.93 105.19 105.54 3bwo n GLY 250 Ca -0.32 -2.05 -0.21 0.00 0.00 0.00 0.00 46.02 43.44 3bwo n GLY 250 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3bwo s VAL 251 N 0.00 1.27 -0.37 1.61 1.01 -1.26 -4.85 120.40 117.81 3bwo s VAL 251 Ca 0.00 -1.08 -0.43 0.00 0.00 0.00 0.00 61.98 60.47 3bwo s VAL 251 Cb 0.00 -1.14 -0.17 0.00 0.00 0.00 0.00 36.38 35.07 3bwo s VAL 251 CO 0.00 0.04 1.73 -0.24 0.00 0.00 0.00 175.10 176.63 3bwo n SER 252 N 1.82 1.91 -0.19 3.32 2.88 -1.26 -4.84 113.62 117.26 3bwo n SER 252 Ca -0.18 1.08 -0.07 0.00 -1.33 0.00 0.00 58.87 58.37 3bwo n SER 252 Cb 0.54 -1.04 0.02 0.00 -0.75 0.00 0.00 64.21 62.98 3bwo n SER 252 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3bwo h LYS 253 N 6.68 0.79 -0.80 -1.46 6.56 -1.94 -2.37 116.57 124.03 3bwo h LYS 253 Ca -0.44 -0.10 -0.04 0.00 -1.06 0.00 0.00 60.65 59.01 3bwo h LYS 253 Cb 1.34 -0.15 -0.04 0.00 -0.57 0.00 0.00 32.23 32.82 3bwo h LYS 253 CO 0.98 0.62 0.33 1.05 -2.06 0.00 0.00 179.45 180.37 3bwo h GLU 254 N 0.75 1.20 -0.59 3.15 9.09 -1.93 0.03 114.58 126.27 3bwo h GLU 254 Ca 0.19 -0.21 0.03 0.00 0.05 0.00 0.00 59.36 59.42 3bwo h GLU 254 Cb 0.08 -0.20 -0.04 0.00 -1.65 0.00 0.00 28.75 26.94 3bwo h GLU 254 CO -0.03 0.96 0.35 0.77 0.05 0.00 0.00 179.01 181.11 3bwo h SER 255 N 1.17 0.55 0.07 3.06 0.02 -1.83 0.10 113.55 116.69 3bwo h SER 255 Ca 0.27 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.23 3bwo h SER 255 Cb 0.21 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 62.64 3bwo h SER 255 CO -0.02 0.38 -0.05 1.56 -1.14 0.00 0.00 176.83 177.56 3bwo h GLN 256 N 0.68 -0.11 -0.25 3.45 4.20 -0.75 0.31 115.11 122.64 3bwo h GLN 256 Ca 0.24 0.01 0.05 0.00 0.06 0.00 0.00 58.65 59.01 3bwo h GLN 256 Cb 0.06 0.03 -0.05 0.00 0.30 0.00 0.00 27.48 27.81 3bwo h GLN 256 CO -0.12 -0.08 -0.08 0.28 -0.67 0.00 0.00 178.83 178.17 3bwo h VAL 257 N -0.12 0.71 -0.36 -0.54 2.07 -0.60 -1.78 116.25 115.64 3bwo h VAL 257 Ca -0.00 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 3bwo h VAL 257 Cb 0.10 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 3bwo h VAL 257 CO 0.00 0.00 0.03 -0.09 0.02 0.00 0.00 177.57 177.53 3bwo h ARG 258 N -0.03 0.61 -0.89 1.57 2.43 -0.63 -2.43 114.38 115.00 3bwo h ARG 258 Ca 0.12 -0.18 0.17 0.00 -0.81 0.00 0.00 59.98 59.29 3bwo h ARG 258 Cb 0.21 -0.06 -0.10 0.00 -0.42 0.00 0.00 29.97 29.60 3bwo h ARG 258 CO -0.27 0.70 0.46 1.15 -1.51 0.00 0.00 179.97 180.49 3bwo h THR 259 N 0.43 0.66 -0.62 0.20 2.02 -0.73 0.58 112.91 115.46 3bwo h THR 259 Ca 0.11 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 67.04 3bwo h THR 259 Cb 0.40 0.02 -0.03 0.00 -1.74 0.00 0.00 68.15 66.80 3bwo h THR 259 CO 0.01 0.11 0.24 0.00 0.37 0.00 0.00 175.52 176.25 3bwo h ALA 260 N 1.61 0.81 0.10 6.16 0.00 -0.99 0.41 119.26 127.36 3bwo h ALA 260 Ca 0.51 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 55.24 3bwo h ALA 260 Cb 0.80 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3bwo h ALA 260 CO -0.41 0.43 -0.05 -0.22 0.00 0.00 0.00 179.25 179.01 3bwo h LYS 261 N 0.87 -0.13 0.20 0.00 1.63 -0.58 -0.88 116.57 117.68 3bwo h LYS 261 Ca 0.21 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 60.02 3bwo h LYS 261 Cb 0.22 0.03 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 3bwo h LYS 261 CO -0.02 -0.00 -0.20 0.82 -3.45 0.00 0.00 179.45 176.60 3bwo h ILE 262 N -0.23 0.56 -0.98 2.00 1.08 -0.85 -0.76 117.51 118.33 3bwo h ILE 262 Ca -0.01 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.50 3bwo h ILE 262 Cb 0.18 0.56 -0.06 0.00 -3.07 0.00 0.00 36.82 34.44 3bwo h ILE 262 CO 0.02 0.00 0.64 -0.07 -0.69 0.00 0.00 178.15 178.05 3bwo h LEU 263 N -0.43 1.06 -0.93 1.44 3.38 -0.92 0.14 115.31 119.05 3bwo h LEU 263 Ca 0.00 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 3bwo h LEU 263 Cb 0.41 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 3bwo h LEU 263 CO -0.05 0.72 0.07 0.78 0.09 0.00 0.00 178.44 180.05 3bwo h ASN 264 N 1.23 0.81 -0.08 -0.43 2.35 -0.76 0.56 115.58 119.25 3bwo h ASN 264 Ca 0.39 -0.17 -0.12 0.00 -0.55 0.00 0.00 56.30 55.85 3bwo h ASN 264 Cb 0.02 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 3bwo h ASN 264 CO -0.12 0.83 -0.35 0.58 -1.65 0.00 0.00 177.43 176.72 3bwo h VAL 265 N 0.80 1.29 -0.52 2.81 2.07 -0.39 -2.25 116.25 120.06 3bwo h VAL 265 Ca 0.17 -1.48 0.00 0.00 0.82 0.00 0.00 66.70 66.21 3bwo h VAL 265 Cb 0.39 1.47 -0.03 0.00 -1.52 0.00 0.00 31.29 31.60 3bwo h VAL 265 CO 0.01 0.47 0.33 0.25 0.02 0.00 0.00 177.57 178.65 3bwo h LEU 266 N 0.49 0.62 0.23 2.57 5.85 0.07 -1.72 115.31 123.41 3bwo h LEU 266 Ca 0.05 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 3bwo h LEU 266 Cb 0.84 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.71 3bwo h LEU 266 CO 0.07 0.48 -0.11 0.50 -0.34 0.00 0.00 178.44 179.04 3bwo h LYS 267 N 0.70 -0.30 -0.07 1.25 3.64 -0.73 -1.90 116.57 119.17 3bwo h LYS 267 Ca 0.19 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.61 3bwo h LYS 267 Cb -0.04 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 31.85 3bwo h LYS 267 CO -0.04 -0.13 0.20 0.93 -2.27 0.00 0.00 179.45 178.14 3bwo h GLU 268 N -0.39 0.00 0.00 1.90 5.08 -1.26 0.12 114.58 120.03 3bwo h GLU 268 Ca -0.03 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.18 3bwo h GLU 268 Cb 0.30 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 3bwo h GLU 268 CO 0.05 0.00 -0.71 1.15 -1.00 0.00 0.00 179.01 178.51 3bwo h THR 269 N 0.00 1.32 -0.48 1.13 2.02 -0.51 -3.32 112.91 113.06 3bwo h THR 269 Ca 0.03 -2.59 -0.04 0.00 0.77 0.00 0.00 66.41 64.59 3bwo h THR 269 Cb 0.43 2.47 -0.02 0.00 -1.74 0.00 0.00 68.15 69.28 3bwo h THR 269 CO -0.00 0.69 0.14 0.00 0.37 0.00 0.00 175.52 176.72 3bwo n LYS 271 N -4.31 2.21 -4.45 0.00 2.85 -1.25 -4.88 118.16 108.33 3bwo n LYS 271 Ca 0.03 -2.23 -0.25 0.00 -1.05 0.00 0.00 58.31 54.81 3bwo n LYS 271 Cb 0.19 -1.94 -0.10 0.00 -0.65 0.00 0.00 35.03 32.54 3bwo n LYS 271 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 3bwo s SER 272 N -0.17 3.91 -0.50 -5.58 0.15 -1.00 -5.08 113.70 105.43 3bwo s SER 272 Ca 0.47 -1.07 0.07 0.00 0.70 0.00 0.00 55.95 56.13 3bwo s SER 272 Cb 0.35 -0.43 0.36 0.00 -1.71 0.00 0.00 66.02 64.58 3bwo s SER 272 CO -0.11 -0.16 0.92 -1.84 1.20 0.00 0.00 173.24 173.25 3bwo n GLU 273 N -0.83 2.61 -3.83 5.44 0.28 -1.26 -4.72 120.64 118.33 3bwo n GLU 273 Ca -0.05 -4.37 -0.12 0.00 -0.16 0.00 0.00 57.16 52.46 3bwo n GLU 273 Cb 0.62 -2.06 -0.13 0.00 1.43 0.00 0.00 31.44 31.31 3bwo n GLU 273 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 3bwo s SER 274 N -3.22 -0.11 0.17 -1.84 0.15 -1.26 -5.01 113.70 102.58 3bwo s SER 274 Ca 0.45 0.21 0.23 0.00 0.70 0.00 0.00 55.95 57.54 3bwo s SER 274 Cb 0.32 0.24 0.90 0.00 -1.71 0.00 0.00 66.02 65.77 3bwo s SER 274 CO -0.12 -0.06 1.70 -0.62 1.20 0.00 0.00 173.24 175.33 3bwo n GLU 275 N 2.92 0.15 0.00 5.44 4.71 -1.26 -1.29 120.64 131.31 3bwo n GLU 275 Ca -0.13 0.30 0.10 0.00 -0.01 0.00 0.00 57.16 57.43 3bwo n GLU 275 Cb 0.59 -1.75 0.07 0.00 -1.01 0.00 0.00 31.44 29.34 3bwo n GLU 275 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 3bwo n SER 276 N -2.03 2.54 -0.01 1.62 3.41 -1.26 -3.64 113.62 114.25 3bwo n SER 276 Ca 0.04 -1.77 -0.02 0.00 -0.26 0.00 0.00 58.87 56.85 3bwo n SER 276 Cb 0.27 0.09 -0.01 0.00 -0.26 0.00 0.00 64.21 64.30 3bwo n SER 276 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3bwo n GLU 277 N 0.92 0.13 -1.59 4.33 -0.58 -1.01 -4.93 120.64 117.92 3bwo n GLU 277 Ca 0.11 0.05 -0.43 0.00 -0.42 0.00 0.00 57.16 56.47 3bwo n GLU 277 Cb 0.49 -0.61 -0.03 0.00 -0.57 0.00 0.00 31.44 30.72 3bwo n GLU 277 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 3bwo n ASN 278 N -3.17 3.12 -0.03 1.62 2.85 -0.41 -4.86 115.26 114.37 3bwo n ASN 278 Ca -0.03 0.17 -0.09 0.00 -0.11 0.00 0.00 54.58 54.51 3bwo n ASN 278 Cb 0.13 -1.54 -0.03 0.00 1.24 0.00 0.00 39.78 39.58 3bwo n ASN 278 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 3bwo h PHE 279 N 15.20 0.07 -0.25 1.20 3.04 -1.88 -0.39 116.94 133.93 3bwo h PHE 279 Ca -0.39 0.01 -0.02 0.00 3.98 0.00 0.00 57.97 61.55 3bwo h PHE 279 Cb 1.25 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.74 3bwo h PHE 279 CO 0.94 0.03 0.06 0.74 -2.02 0.00 0.00 178.31 178.06 3bwo h PHE 280 N 0.12 0.35 -0.16 0.41 0.05 -1.93 0.41 116.94 116.19 3bwo h PHE 280 Ca 0.08 -0.01 -0.18 0.00 3.82 0.00 0.00 57.97 61.68 3bwo h PHE 280 Cb 0.07 -0.11 0.01 0.00 2.00 0.00 0.00 35.95 37.91 3bwo h PHE 280 CO -0.13 0.32 -0.60 -0.22 -0.18 0.00 0.00 178.31 177.49 3bwo h LYS 281 N 0.36 0.68 0.23 1.51 1.63 -1.81 -2.21 116.57 116.97 3bwo h LYS 281 Ca 0.09 -0.53 -0.01 0.00 -0.85 0.00 0.00 60.65 59.35 3bwo h LYS 281 Cb 0.14 0.10 0.00 0.00 -0.60 0.00 0.00 32.23 31.87 3bwo h LYS 281 CO -0.00 1.15 -0.11 -0.92 -3.45 0.00 0.00 179.45 176.11 3bwo h TYR 282 N 0.37 -0.29 -0.96 1.91 5.03 -0.17 -2.08 116.97 120.78 3bwo h TYR 282 Ca -0.03 -0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.29 3bwo h TYR 282 Cb 1.23 0.10 -0.05 0.00 1.55 0.00 0.00 36.73 39.56 3bwo h TYR 282 CO 0.10 -0.09 0.64 0.78 -1.32 0.00 0.00 178.16 178.26 3bwo h GLY 283 N -0.44 1.36 0.80 1.82 0.00 -0.27 -1.12 103.07 105.23 3bwo h GLY 283 Ca -0.03 -0.50 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 3bwo h GLY 283 CO 0.05 0.47 0.01 -0.09 0.00 0.00 0.00 176.54 176.99 3bwo h ARG 284 N 1.28 0.26 -0.70 4.80 2.43 -1.31 0.32 114.38 121.46 3bwo h ARG 284 Ca 0.36 -0.08 -0.02 0.00 -0.81 0.00 0.00 59.98 59.43 3bwo h ARG 284 Cb -0.11 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.38 3bwo h ARG 284 CO -0.09 0.47 0.36 1.49 -1.51 0.00 0.00 179.97 180.69 3bwo h GLU 285 N 0.02 0.97 0.12 0.20 4.57 -1.20 0.18 114.58 119.44 3bwo h GLU 285 Ca 0.04 -0.11 -0.01 0.00 -1.18 0.00 0.00 59.36 58.11 3bwo h GLU 285 Cb 0.34 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 3bwo h GLU 285 CO 0.01 0.73 -0.06 1.98 -1.18 0.00 0.00 179.01 180.48 3bwo h MET 286 N 0.97 -0.15 -0.80 1.92 4.05 -0.99 -0.72 114.93 119.22 3bwo h MET 286 Ca 0.24 0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.64 3bwo h MET 286 Cb 0.05 0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 30.85 3bwo h MET 286 CO -0.04 0.06 0.37 0.52 0.23 0.00 0.00 176.91 178.05 3bwo h MET 287 N -0.35 1.15 0.08 0.39 2.86 -0.57 -2.11 114.93 116.38 3bwo h MET 287 Ca -0.02 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.45 3bwo h MET 287 Cb 0.29 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 3bwo h MET 287 CO 0.03 0.90 -0.10 -0.22 1.06 0.00 0.00 176.91 178.58 3bwo h LYS 288 N 1.13 -0.21 -0.11 1.72 3.64 -0.56 -0.90 116.57 121.28 3bwo h LYS 288 Ca 0.27 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.71 3bwo h LYS 288 Cb 0.14 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.96 3bwo h LYS 288 CO -0.03 -0.14 -0.18 -0.97 -2.27 0.00 0.00 179.45 175.86 3bwo h ASN 289 N -0.22 -0.56 -0.70 4.20 -0.00 -0.95 -1.59 115.58 115.76 3bwo h ASN 289 Ca 0.01 0.10 0.04 0.00 -0.00 0.00 0.00 56.30 56.45 3bwo h ASN 289 Cb 0.22 0.26 -0.05 0.00 -0.00 0.00 0.00 38.32 38.75 3bwo h ASN 289 CO -0.04 -0.23 0.42 0.03 -0.00 0.00 0.00 177.43 177.61 3bwo h ARG 290 N -0.24 0.78 -0.10 6.67 3.08 -1.25 -1.66 114.38 121.65 3bwo h ARG 290 Ca 0.09 -0.05 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 3bwo h ARG 290 Cb 0.37 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 3bwo h ARG 290 CO -0.25 0.52 -0.31 -1.49 -1.07 0.00 0.00 179.97 177.37 3bwo h TRP 291 N 0.81 0.21 -0.07 3.04 4.06 -0.97 -1.76 115.95 121.27 3bwo h TRP 291 Ca 0.29 -0.04 -0.02 0.00 2.06 0.00 0.00 58.89 61.18 3bwo h TRP 291 Cb 0.08 -0.05 -0.00 0.00 -1.00 0.00 0.00 29.16 28.19 3bwo h TRP 291 CO -0.05 0.48 -0.03 0.93 -3.56 0.00 0.00 178.44 176.21 3bwo h GLU 292 N 0.17 0.15 -0.25 0.49 5.08 -0.48 0.22 114.58 119.96 3bwo h GLU 292 Ca 0.02 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 3bwo h GLU 292 Cb 0.63 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 3bwo h GLU 292 CO 0.05 0.52 0.11 0.87 -1.00 0.00 0.00 179.01 179.56 3bwo h LYS 293 N -0.22 0.23 -0.74 2.33 1.57 -1.25 0.18 116.57 118.67 3bwo h LYS 293 Ca 0.02 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3bwo h LYS 293 Cb 0.48 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.70 3bwo h LYS 293 CO 0.01 0.16 0.45 1.25 -0.57 0.00 0.00 179.45 180.74 3bwo h LEU 294 N 0.24 0.89 -0.45 2.94 5.85 -1.30 -1.89 115.31 121.59 3bwo h LEU 294 Ca 0.10 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 3bwo h LEU 294 Cb 0.04 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.83 3bwo h LEU 294 CO -0.08 0.68 0.23 -0.09 -0.34 0.00 0.00 178.44 178.83 3bwo h ARG 295 N 1.02 0.63 -0.45 1.25 9.65 0.74 -1.55 114.38 125.68 3bwo h ARG 295 Ca 0.27 -0.09 0.05 0.00 -1.10 0.00 0.00 59.98 59.11 3bwo h ARG 295 Cb -0.04 -0.12 -0.05 0.00 -1.39 0.00 0.00 29.97 28.37 3bwo h ARG 295 CO -0.05 0.53 0.18 0.93 2.80 0.00 0.00 179.97 184.36 3bwo h GLU 296 N 0.58 0.35 0.80 0.20 4.39 -0.23 -0.87 114.58 119.81 3bwo h GLU 296 Ca 0.15 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.79 3bwo h GLU 296 Cb 0.09 -0.08 0.01 0.00 -0.10 0.00 0.00 28.75 28.67 3bwo h GLU 296 CO -0.02 0.23 -0.39 0.28 -1.16 0.00 0.00 179.01 177.95 3bwo h VAL 297 N 0.36 0.19 -0.46 3.13 2.07 -1.09 -2.89 116.25 117.55 3bwo h VAL 297 Ca 0.21 -0.03 0.11 0.00 0.82 0.00 0.00 66.70 67.81 3bwo h VAL 297 Cb 0.18 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.13 3bwo h VAL 297 CO -0.20 0.00 0.32 0.58 0.02 0.00 0.00 177.57 178.30 3bwo h VAL 298 N -1.11 0.83 0.27 2.57 2.07 -1.18 -2.84 116.25 116.86 3bwo h VAL 298 Ca -0.11 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.36 3bwo h VAL 298 Cb 0.83 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 3bwo h VAL 298 CO 0.18 0.02 -0.25 0.50 0.02 0.00 0.00 177.57 178.05 3bwo h LYS 299 N 0.12 -0.49 -0.73 1.57 1.63 -0.94 -2.72 116.57 115.00 3bwo h LYS 299 Ca 0.22 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.05 3bwo h LYS 299 Cb 0.71 0.11 0.00 0.00 -0.60 0.00 0.00 32.23 32.45 3bwo h LYS 299 CO -0.03 -0.33 0.00 -0.85 -3.45 0.00 0.00 179.45 174.80 3bwo n GLU 300 N -3.84 1.35 -2.18 1.90 0.00 -1.11 -4.79 120.64 111.96 3bwo n GLU 300 Ca -0.06 -0.32 -0.28 0.00 0.00 0.00 0.00 57.16 56.50 3bwo n GLU 300 Cb 0.23 -1.45 0.04 0.00 0.00 0.00 0.00 31.44 30.26 3bwo n GLU 300 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 3bwo s SER 301 N -0.32 5.45 -0.20 -1.84 0.01 -1.03 -5.04 113.70 110.73 3bwo s SER 301 Ca 0.06 0.85 -0.17 0.00 1.31 0.00 0.00 55.95 57.99 3bwo s SER 301 Cb 0.04 -1.73 -0.13 0.00 0.21 0.00 0.00 66.02 64.42 3bwo s SER 301 CO 0.02 -1.23 -0.04 0.47 0.41 0.00 0.00 173.24 172.87 3bwo n ASP 302 N -2.78 1.87 -0.63 2.44 8.00 -1.26 -4.68 116.55 119.51 3bwo n ASP 302 Ca 0.06 0.45 0.06 0.00 0.71 0.00 0.00 54.79 56.07 3bwo n ASP 302 Cb 0.58 -0.90 0.16 0.00 -0.02 0.00 0.00 41.12 40.94 3bwo n ASP 302 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3bwo n ALA 303 N -3.72 2.23 -2.72 2.24 0.00 -1.26 -4.94 120.51 112.35 3bwo n ALA 303 Ca -0.29 -1.23 -0.36 0.00 0.00 0.00 0.00 53.44 51.56 3bwo n ALA 303 Cb 0.60 -0.44 -0.07 0.00 0.00 0.00 0.00 19.45 19.54 3bwo n ALA 303 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3bwo s PHE 304 N -1.14 3.43 0.26 0.00 0.08 -1.26 -0.69 117.98 118.66 3bwo s PHE 304 Ca 0.24 0.50 0.09 0.00 0.12 0.00 0.00 56.93 57.88 3bwo s PHE 304 Cb 0.13 -2.30 -0.04 0.00 -0.57 0.00 0.00 43.02 40.24 3bwo s PHE 304 CO 0.15 0.23 -0.01 0.95 -0.10 0.00 0.00 175.22 176.44 3bwo s THR 305 N 0.51 3.45 -0.14 0.64 -4.23 -0.40 -4.86 115.64 110.62 3bwo s THR 305 Ca 0.14 -1.89 -0.12 0.00 -1.18 0.00 0.00 61.69 58.63 3bwo s THR 305 Cb -0.12 -2.84 0.04 0.00 1.34 0.00 0.00 72.50 70.91 3bwo s THR 305 CO 0.02 -0.36 0.36 -0.22 -0.54 0.00 0.00 174.62 173.89 3bwo s LEU 306 N -3.63 0.56 0.77 4.79 2.96 -1.26 -1.94 118.68 120.93 3bwo s LEU 306 Ca 0.31 0.74 -0.15 0.00 -0.22 0.00 0.00 54.13 54.81 3bwo s LEU 306 Cb -0.07 1.24 0.05 0.00 0.50 0.00 0.00 46.19 47.92 3bwo s LEU 306 CO 0.20 -0.13 1.19 -2.65 -1.32 0.00 0.00 176.35 173.63 3bwo n PRO 307 N 3.00 0.41 -4.83 0.98 -0.02 -1.26 -5.03 135.00 128.24 3bwo n PRO 307 Ca -0.14 0.21 -0.32 0.00 -2.02 0.00 0.00 63.50 61.22 3bwo n PRO 307 Cb 0.57 -2.43 -0.13 0.00 -0.02 0.00 0.00 33.50 31.50 3bwo n PRO 307 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3bwo s LYS 308 N -3.86 2.45 -0.09 -0.52 1.02 -1.26 -5.08 119.74 112.40 3bwo s LYS 308 Ca 0.75 -0.73 0.03 0.00 0.02 0.00 0.00 55.97 56.05 3bwo s LYS 308 Cb -0.32 -2.36 0.00 0.00 -0.52 0.00 0.00 37.83 34.63 3bwo s LYS 308 CO 0.49 0.61 -0.20 0.71 -0.92 0.00 0.00 175.35 176.03 3bwo s TYR 309 N -0.77 2.24 0.35 3.18 2.02 -1.26 -5.08 117.35 118.02 3bwo s TYR 309 Ca 0.12 -0.90 -0.27 0.00 -0.37 0.00 0.00 57.07 55.65 3bwo s TYR 309 Cb -0.11 -1.52 -0.09 0.00 -0.40 0.00 0.00 41.96 39.84 3bwo s TYR 309 CO 0.02 -0.38 1.18 -1.25 -1.57 0.00 0.00 175.55 173.54 3bwo s PRO 310 N 0.45 4.29 0.38 -1.71 0.04 -1.26 -4.79 135.00 132.39 3bwo s PRO 310 Ca -0.17 1.91 -0.26 0.00 0.04 0.00 0.00 61.00 62.52 3bwo s PRO 310 Cb -0.17 -2.91 -0.09 0.00 0.04 0.00 0.00 34.50 31.37 3bwo s PRO 310 CO 0.07 -0.14 1.13 -2.00 0.04 0.00 0.00 177.00 176.11 3bwo s GLU 311 N -1.95 4.20 0.08 4.56 2.12 -1.26 -4.64 118.70 121.80 3bwo s GLU 311 Ca 0.52 1.77 -0.07 0.00 0.36 0.00 0.00 54.97 57.55 3bwo s GLU 311 Cb -0.33 -2.75 -0.01 0.00 0.26 0.00 0.00 34.13 31.30 3bwo s GLU 311 CO 0.42 -0.17 0.13 0.00 -0.54 0.00 0.00 175.26 175.10 3bwo s ALA 312 N -1.41 -0.02 -0.14 6.30 0.00 -0.76 -4.91 121.76 120.81 3bwo s ALA 312 Ca 0.55 -0.78 -0.27 0.00 0.00 0.00 0.00 51.96 51.45 3bwo s ALA 312 Cb -0.29 0.44 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 3bwo s ALA 312 CO 0.37 -0.47 0.91 0.12 0.00 0.00 0.00 175.76 176.68 3bwo s PHE 313 N -3.88 3.46 -0.26 0.00 2.19 -1.26 0.03 117.98 118.25 3bwo s PHE 313 Ca 0.06 1.40 -0.15 0.00 0.33 0.00 0.00 56.93 58.57 3bwo s PHE 313 Cb 0.06 -3.09 -0.04 0.00 -1.31 0.00 0.00 43.02 38.64 3bwo s PHE 313 CO -0.11 -0.24 0.37 0.00 1.83 0.00 0.00 175.22 177.08 3bwo n ASN 315 N 5.15 0.16 -0.10 0.00 3.02 -0.26 0.71 115.26 123.94 3bwo n ASN 315 Ca -0.09 0.54 -0.22 0.00 -0.03 0.00 0.00 54.58 54.78 3bwo n ASN 315 Cb 0.51 -0.58 -0.12 0.00 -0.61 0.00 0.00 39.78 38.99 3bwo n ASN 315 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3bwo n TYR 316 N -1.68 0.98 0.14 3.10 9.36 -1.26 -4.33 117.16 123.47 3bwo n TYR 316 Ca 0.03 0.40 0.07 0.00 3.32 0.00 0.00 57.90 61.72 3bwo n TYR 316 Cb 0.18 -1.10 0.05 0.00 -0.63 0.00 0.00 39.34 37.84 3bwo n TYR 316 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 3bwo h PHE 317 N -0.92 0.00 -0.07 2.98 0.04 -1.95 -3.48 116.94 113.54 3bwo h PHE 317 Ca -0.37 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.36 3bwo h PHE 317 Cb 1.38 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.51 3bwo h PHE 317 CO 0.09 0.27 -0.03 0.41 -0.60 0.00 0.00 178.31 178.45 3bwo n GLY 318 N 1.21 0.50 3.66 -1.45 0.00 0.22 -5.01 105.19 104.31 3bwo n GLY 318 Ca 0.00 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 3bwo n GLY 318 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bwo s LYS 319 N -1.07 2.03 -0.20 1.61 1.02 -1.20 -4.90 119.74 117.03 3bwo s LYS 319 Ca 0.00 -2.22 -0.08 0.00 0.02 0.00 0.00 55.97 53.69 3bwo s LYS 319 Cb 0.00 -1.46 -0.04 0.00 -0.52 0.00 0.00 37.83 35.81 3bwo s LYS 319 CO 0.00 -0.22 0.08 0.45 -0.92 0.00 0.00 175.35 174.75 3bwo s SER 320 N -3.75 5.66 0.24 2.83 0.15 -1.26 0.43 113.70 118.00 3bwo s SER 320 Ca 0.22 0.05 -0.18 0.00 0.70 0.00 0.00 55.95 56.74 3bwo s SER 320 Cb 0.06 -1.99 0.02 0.00 -1.71 0.00 0.00 66.02 62.40 3bwo s SER 320 CO 0.11 0.12 0.61 -1.48 1.20 0.00 0.00 173.24 173.80 3bwo s LEU 321 N 0.69 -0.06 0.66 3.45 2.34 0.10 -4.90 118.68 120.96 3bwo s LEU 321 Ca 0.04 -0.62 -0.11 0.00 0.06 0.00 0.00 54.13 53.51 3bwo s LEU 321 Cb -0.13 2.36 -0.02 0.00 -0.56 0.00 0.00 46.19 47.84 3bwo s LEU 321 CO 0.02 -1.21 1.05 -1.61 -1.06 0.00 0.00 176.35 173.54 3bwo s GLU 322 N -3.92 3.29 -0.10 1.48 0.41 -1.26 -1.83 118.70 116.77 3bwo s GLU 322 Ca 0.13 0.70 -0.04 0.00 -0.41 0.00 0.00 54.97 55.35 3bwo s GLU 322 Cb -0.03 -2.05 -0.04 0.00 -1.78 0.00 0.00 34.13 30.23 3bwo s GLU 322 CO 0.04 -0.78 0.04 -1.54 -0.49 0.00 0.00 175.26 172.53 3bwo s SER 323 N -4.17 5.57 -0.63 -0.19 1.04 -1.26 -4.60 113.70 109.46 3bwo s SER 323 Ca 0.56 0.23 0.05 0.00 0.48 0.00 0.00 55.95 57.27 3bwo s SER 323 Cb -0.11 -1.67 0.17 0.00 0.10 0.00 0.00 66.02 64.51 3bwo s SER 323 CO 0.54 0.37 0.45 -0.31 0.98 0.00 0.00 173.24 175.27 3bwo s TYR 324 N -0.84 2.98 0.77 5.02 4.12 -0.69 -4.90 117.35 123.80 3bwo s TYR 324 Ca 0.13 -3.09 -0.16 0.00 0.02 0.00 0.00 57.07 53.97 3bwo s TYR 324 Cb -0.12 -2.29 -0.03 0.00 -1.52 0.00 0.00 41.96 38.00 3bwo s TYR 324 CO 0.03 -0.62 0.45 -2.30 0.02 0.00 0.00 175.55 173.13 3bwo n PRO 325 N 2.21 0.18 0.00 -1.71 -0.02 -1.25 -4.66 135.00 129.75 3bwo n PRO 325 Ca 0.22 0.10 0.13 0.00 -2.02 0.00 0.00 63.50 61.92 3bwo n PRO 325 Cb 0.38 -1.79 0.59 0.00 -0.02 0.00 0.00 33.50 32.66 3bwo n PRO 325 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3bwo n ALA 326 N -2.59 2.25 -2.65 3.55 0.00 -1.26 -4.74 120.51 115.06 3bwo n ALA 326 Ca 0.09 -0.10 -0.20 0.00 0.00 0.00 0.00 53.44 53.23 3bwo n ALA 326 Cb 0.51 -1.43 -0.13 0.00 0.00 0.00 0.00 19.45 18.40 3bwo n ALA 326 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3bwo s PHE 327 N -2.91 1.31 -0.30 0.00 0.08 -1.26 -0.22 117.98 114.68 3bwo s PHE 327 Ca 0.15 -0.40 -0.05 0.00 0.12 0.00 0.00 56.93 56.75 3bwo s PHE 327 Cb 0.18 -0.75 0.03 0.00 -0.57 0.00 0.00 43.02 41.90 3bwo s PHE 327 CO 0.47 0.06 0.05 0.00 -0.10 0.00 0.00 175.22 175.71 3bwo s ALA 328 N -1.05 2.96 -1.33 5.36 0.00 -0.23 -4.73 121.76 122.73 3bwo s ALA 328 Ca 0.01 -1.57 -0.16 0.00 0.00 0.00 0.00 51.96 50.24 3bwo s ALA 328 Cb -0.09 -2.07 0.08 0.00 0.00 0.00 0.00 23.12 21.04 3bwo s ALA 328 CO 0.02 -1.06 1.83 1.87 0.00 0.00 0.00 175.76 178.42 3bwo n TRP 329 N 4.78 4.38 -2.11 0.00 -0.00 -1.26 -2.19 117.44 121.04 3bwo n TRP 329 Ca -0.14 -2.92 -0.42 0.00 -0.00 0.00 0.00 57.50 54.01 3bwo n TRP 329 Cb 0.46 -2.55 -0.03 0.00 -0.00 0.00 0.00 31.31 29.20 3bwo n TRP 329 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 177.69 176.52 3bwo s LEU 330 N 3.33 4.34 0.42 5.87 2.96 -0.61 -4.39 118.68 130.59 3bwo s LEU 330 Ca 0.51 2.27 0.06 0.00 -0.22 0.00 0.00 54.13 56.75 3bwo s LEU 330 Cb 0.06 -3.57 -0.07 0.00 0.50 0.00 0.00 46.19 43.12 3bwo s LEU 330 CO 0.03 -0.77 0.02 -0.83 -1.32 0.00 0.00 176.35 173.48 3bwo s GLY 331 N 1.93 2.55 -0.03 7.98 0.00 -0.82 -1.29 107.32 117.65 3bwo s GLY 331 Ca 0.67 -1.94 -0.01 0.00 0.00 0.00 0.00 44.72 43.45 3bwo s GLY 331 CO 0.29 -2.08 0.05 -1.08 0.00 0.00 0.00 173.10 170.28 3bwo s THR 332 N -2.81 -0.04 0.17 0.90 -1.32 -0.74 -1.28 115.64 110.52 3bwo s THR 332 Ca 0.30 0.14 -0.08 0.00 -1.21 0.00 0.00 61.69 60.84 3bwo s THR 332 Cb 0.08 -0.10 -0.02 0.00 -1.51 0.00 0.00 72.50 70.96 3bwo s THR 332 CO 0.15 0.06 1.53 0.11 -2.21 0.00 0.00 174.62 174.26 3bwo h LYS 333 N 6.87 0.85 -7.29 7.08 1.57 -1.25 -3.45 116.57 120.95 3bwo h LYS 333 Ca -0.38 -0.42 -0.41 0.00 -1.87 0.00 0.00 60.65 57.58 3bwo h LYS 333 Cb 1.15 -0.00 0.20 0.00 0.08 0.00 0.00 32.23 33.66 3bwo h LYS 333 CO 0.47 1.06 0.06 -1.21 -0.57 0.00 0.00 179.45 179.26 3bwo s GLU 334 N -4.44 -1.68 -0.72 3.15 2.02 -1.26 -4.97 118.70 110.81 3bwo s GLU 334 Ca -0.10 0.01 -0.12 0.00 0.02 0.00 0.00 54.97 54.78 3bwo s GLU 334 Cb 0.12 -1.54 0.19 0.00 0.10 0.00 0.00 34.13 33.00 3bwo s GLU 334 CO 0.86 -4.03 0.64 -1.21 0.02 0.00 0.00 175.26 171.55 3bwo s GLU 335 N -5.29 3.27 0.01 1.61 0.41 -1.26 -4.93 118.70 112.51 3bwo s GLU 335 Ca 0.70 -2.29 0.00 0.00 -0.41 0.00 0.00 54.97 52.98 3bwo s GLU 335 Cb -0.11 -4.27 -0.01 0.00 -1.78 0.00 0.00 34.13 27.96 3bwo s GLU 335 CO 0.57 -1.27 -0.02 0.95 -0.49 0.00 0.00 175.26 175.00 3bwo s THR 336 N 0.48 0.09 -1.02 3.63 -4.23 -1.26 -3.95 115.64 109.38 3bwo s THR 336 Ca 0.14 -0.30 -0.23 0.00 -1.18 0.00 0.00 61.69 60.12 3bwo s THR 336 Cb -0.16 -0.13 0.00 0.00 1.34 0.00 0.00 72.50 73.55 3bwo s THR 336 CO -0.05 -0.13 1.71 -0.62 -0.54 0.00 0.00 174.62 174.98 3bwo s ASP 337 N -0.45 5.89 0.22 3.99 3.68 -1.26 -3.94 116.67 124.80 3bwo s ASP 337 Ca -0.04 -1.28 -0.07 0.00 2.13 0.00 0.00 52.55 53.28 3bwo s ASP 337 Cb -0.03 -2.57 0.30 0.00 -1.45 0.00 0.00 42.92 39.17 3bwo s ASP 337 CO -0.00 -2.08 1.82 0.25 0.13 0.00 0.00 175.17 175.28 3bwo h LEU 338 N 15.13 0.63 -1.09 -1.34 5.85 -1.27 0.08 115.31 133.30 3bwo h LEU 338 Ca 0.19 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.98 3bwo h LEU 338 Cb 0.99 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.87 3bwo h LEU 338 CO 1.33 0.39 0.62 1.62 -0.34 0.00 0.00 178.44 182.06 3bwo h VAL 339 N 0.76 1.15 -0.05 1.05 3.04 -1.84 0.22 116.25 120.58 3bwo h VAL 339 Ca 0.34 -0.40 -0.04 0.00 -1.01 0.00 0.00 66.70 65.59 3bwo h VAL 339 Cb 0.23 -0.12 0.00 0.00 -2.01 0.00 0.00 31.29 29.39 3bwo h VAL 339 CO -0.20 0.21 -0.12 0.28 -1.01 0.00 0.00 177.57 176.73 3bwo h SER 340 N 1.17 0.19 -0.04 3.17 0.02 -1.77 -2.11 113.55 114.18 3bwo h SER 340 Ca 0.38 -0.59 -0.01 0.00 -0.84 0.00 0.00 61.79 60.74 3bwo h SER 340 Cb 0.04 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.52 3bwo h SER 340 CO -0.12 0.74 0.01 -0.33 -1.14 0.00 0.00 176.83 176.00 3bwo h GLU 341 N -0.35 0.08 -0.03 3.45 4.39 -0.67 0.28 114.58 121.73 3bwo h GLU 341 Ca -0.00 -0.01 -0.26 0.00 0.34 0.00 0.00 59.36 59.44 3bwo h GLU 341 Cb 0.72 -0.02 0.02 0.00 -0.10 0.00 0.00 28.75 29.37 3bwo h GLU 341 CO 0.03 0.08 -0.98 -0.07 -1.16 0.00 0.00 179.01 176.90 3bwo h LEU 342 N 0.08 0.91 -1.38 1.33 -0.00 -0.96 -3.21 115.31 112.09 3bwo h LEU 342 Ca 0.02 -0.72 -0.00 0.00 -0.00 0.00 0.00 57.88 57.18 3bwo h LEU 342 Cb 0.04 -0.28 -0.03 0.00 -0.00 0.00 0.00 40.66 40.39 3bwo h LEU 342 CO -0.00 1.51 0.33 0.03 -0.00 0.00 0.00 178.44 180.31 3bwo h ARG 343 N 0.41 0.75 0.00 1.13 3.08 -0.51 -0.40 114.38 118.84 3bwo h ARG 343 Ca -0.12 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 59.87 3bwo h ARG 343 Cb 1.63 -0.16 -0.00 0.00 0.08 0.00 0.00 29.97 31.52 3bwo h ARG 343 CO 0.20 0.53 -0.00 0.00 -1.07 0.00 0.00 179.97 179.62 3bwo h ARG 344 N 0.76 0.00 -0.49 0.04 3.08 -1.00 0.18 114.38 116.96 3bwo h ARG 344 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.25 3bwo h ARG 344 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.03 3bwo h ARG 344 CO -0.04 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.58 3bwo n HIS 345 N -3.09 1.17 -3.30 3.04 8.25 -0.43 -4.94 115.22 115.91 3bwo n HIS 345 Ca -0.02 -0.66 -0.18 0.00 -0.26 0.00 0.00 57.72 56.61 3bwo n HIS 345 Cb 0.13 -0.23 0.06 0.00 1.12 0.00 0.00 29.99 31.07 3bwo n HIS 345 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3bwo n LYS 346 N 0.58 -5.87 -4.04 -0.41 5.02 0.64 -4.90 118.16 109.19 3bwo n LYS 346 Ca 0.22 0.61 -0.32 0.00 -2.02 0.00 0.00 58.31 56.81 3bwo n LYS 346 Cb 0.81 -5.00 -0.15 0.00 -0.02 0.00 0.00 35.03 30.67 3bwo n LYS 346 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3bwo s VAL 347 N -3.24 1.93 0.08 -0.18 1.01 -0.29 0.06 120.40 119.77 3bwo s VAL 347 Ca 0.42 -1.31 -0.25 0.00 0.00 0.00 0.00 61.98 60.84 3bwo s VAL 347 Cb -0.18 -2.00 -0.06 0.00 0.00 0.00 0.00 36.38 34.13 3bwo s VAL 347 CO 0.54 0.10 0.76 -0.04 0.00 0.00 0.00 175.10 176.45 3bwo s MET 348 N 1.25 4.50 0.17 2.72 -1.94 0.23 -2.41 119.30 123.81 3bwo s MET 348 Ca -0.04 1.07 -0.15 0.00 -1.71 0.00 0.00 55.69 54.85 3bwo s MET 348 Cb -0.18 -3.33 0.02 0.00 2.01 0.00 0.00 34.83 33.36 3bwo s MET 348 CO -0.07 0.38 0.44 -1.54 -0.01 0.00 0.00 175.02 174.22 3bwo s SER 349 N -0.41 -0.19 -0.42 3.03 1.04 -1.26 -1.54 113.70 113.95 3bwo s SER 349 Ca 0.37 -0.51 -0.23 0.00 0.48 0.00 0.00 55.95 56.06 3bwo s SER 349 Cb -0.21 0.52 0.02 0.00 0.10 0.00 0.00 66.02 66.45 3bwo s SER 349 CO 0.24 -0.96 0.78 -0.60 0.98 0.00 0.00 173.24 173.67 3bwo s ARG 350 N -3.87 3.53 -0.09 4.02 6.06 -0.57 -4.78 118.95 123.24 3bwo s ARG 350 Ca 0.09 0.04 -0.35 0.00 -2.50 0.00 0.00 55.73 53.01 3bwo s ARG 350 Cb 0.01 -3.89 -0.13 0.00 0.06 0.00 0.00 34.95 31.00 3bwo s ARG 350 CO -0.05 -1.02 1.81 0.00 -2.50 0.00 0.00 175.30 173.54 3bwo n ALA 351 N 6.61 0.69 0.08 6.12 0.00 -1.26 0.05 120.51 132.80 3bwo n ALA 351 Ca 0.02 0.33 0.20 0.00 0.00 0.00 0.00 53.44 53.99 3bwo n ALA 351 Cb 0.48 -2.42 0.75 0.00 0.00 0.00 0.00 19.45 18.26 3bwo n ALA 351 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3bwo h GLY 352 N 8.37 0.00 1.74 0.00 0.00 -1.09 0.16 103.07 112.25 3bwo h GLY 352 Ca -0.48 0.00 0.04 0.00 0.00 0.00 0.00 47.33 46.89 3bwo h GLY 352 CO 0.94 0.00 0.09 -2.09 0.00 0.00 0.00 176.54 175.48 3bwo h GLU 353 N 0.00 0.00 0.00 4.80 4.81 -1.74 0.10 114.58 122.55 3bwo h GLU 353 Ca 0.20 0.00 -0.09 0.00 -0.13 0.00 0.00 59.36 59.34 3bwo h GLU 353 Cb 1.01 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 3bwo h GLU 353 CO -0.00 0.00 -0.43 0.00 -0.73 0.00 0.00 179.01 177.85 3bwo h ARG 354 N 0.00 0.00 -0.41 1.92 3.08 -0.99 -3.01 114.38 114.96 3bwo h ARG 354 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3bwo h ARG 354 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 3bwo h ARG 354 CO -0.00 0.43 0.00 0.00 -1.07 0.00 0.00 179.97 179.33 3bwo n GLY 356 N 1.11 0.83 0.00 0.00 0.00 -1.00 -0.20 105.19 105.93 3bwo n GLY 356 Ca 0.13 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.43 3bwo n GLY 356 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3bwo n SER 357 N 1.60 0.00 -4.63 1.61 7.64 0.14 -4.58 113.62 115.40 3bwo n SER 357 Ca 0.00 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.59 3bwo n SER 357 Cb 0.50 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.60 3bwo n SER 357 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 3bwo s ASP 358 N 1.00 3.77 0.00 6.43 3.84 -1.26 -4.27 116.67 126.18 3bwo s ASP 358 Ca 0.00 -1.49 0.07 0.00 -0.00 0.00 0.00 52.55 51.13 3bwo s ASP 358 Cb 0.00 0.00 0.36 0.00 -1.38 0.00 0.00 42.92 41.90 3bwo s ASP 358 CO 0.00 -0.63 1.11 0.29 -0.00 0.00 0.00 175.17 175.94 3bwo n LYS 359 N -1.04 0.09 0.00 2.11 5.02 -1.26 -2.08 118.16 121.00 3bwo n LYS 359 Ca -0.10 0.24 0.13 0.00 -2.02 0.00 0.00 58.31 56.56 3bwo n LYS 359 Cb 0.67 -1.50 0.40 0.00 -0.02 0.00 0.00 35.03 34.58 3bwo n LYS 359 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3bwo n LYS 360 N -1.32 0.10 -4.39 1.97 5.02 -1.25 -0.77 118.16 117.51 3bwo n LYS 360 Ca 0.03 -0.04 -0.27 0.00 -2.02 0.00 0.00 58.31 56.00 3bwo n LYS 360 Cb 0.06 -1.50 -0.12 0.00 -0.02 0.00 0.00 35.03 33.46 3bwo n LYS 360 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3bwo s HIS 361 N -2.93 2.36 0.09 2.13 3.76 -0.88 -1.80 115.29 118.02 3bwo s HIS 361 Ca 0.14 -0.34 -0.12 0.00 -0.15 0.00 0.00 55.06 54.59 3bwo s HIS 361 Cb 0.18 -1.19 0.02 0.00 1.11 0.00 0.00 32.58 32.69 3bwo s HIS 361 CO 0.62 0.46 0.28 0.14 -0.85 0.00 0.00 174.74 175.39 3bwo s VAL 362 N -1.51 0.11 -0.14 -0.90 -7.23 -0.41 -0.66 120.40 109.66 3bwo s VAL 362 Ca 0.20 -0.87 -0.03 0.00 -1.81 0.00 0.00 61.98 59.47 3bwo s VAL 362 Cb -0.09 -1.20 -0.03 0.00 0.56 0.00 0.00 36.38 35.63 3bwo s VAL 362 CO 0.10 -0.48 -0.05 -0.60 -0.31 0.00 0.00 175.10 173.76 3bwo s ARG 363 N -3.57 3.48 -0.11 4.82 3.52 0.11 -1.58 118.95 125.62 3bwo s ARG 363 Ca 0.02 -0.53 -0.00 0.00 -0.13 0.00 0.00 55.73 55.09 3bwo s ARG 363 Cb 0.03 -2.84 0.02 0.00 -1.56 0.00 0.00 34.95 30.60 3bwo s ARG 363 CO -0.10 0.33 -0.07 0.54 -0.81 0.00 0.00 175.30 175.19 3bwo s VAL 364 N 0.12 0.98 0.35 7.11 0.11 -0.93 -1.52 120.40 126.62 3bwo s VAL 364 Ca -0.01 -0.26 -0.28 0.00 -2.93 0.00 0.00 61.98 58.49 3bwo s VAL 364 Cb -0.14 -1.01 -0.12 0.00 -1.53 0.00 0.00 36.38 33.59 3bwo s VAL 364 CO 0.03 0.36 1.42 -0.24 -3.33 0.00 0.00 175.10 173.34 3bwo n SER 365 N 4.94 3.36 -0.55 3.54 2.88 -0.70 -1.07 113.62 126.04 3bwo n SER 365 Ca -0.12 1.21 0.07 0.00 -1.33 0.00 0.00 58.87 58.69 3bwo n SER 365 Cb 0.50 -1.56 0.07 0.00 -0.75 0.00 0.00 64.21 62.47 3bwo n SER 365 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 3bwo n MET 366 N 0.72 1.00 -0.79 -1.46 2.81 0.69 -4.53 117.12 115.57 3bwo n MET 366 Ca 0.04 -1.36 0.08 0.00 -1.81 0.00 0.00 57.70 54.64 3bwo n MET 366 Cb 0.37 -1.26 0.37 0.00 -0.71 0.00 0.00 33.22 32.00 3bwo n MET 366 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 3bwo n LEU 367 N 0.74 5.31 -4.77 4.03 4.77 -1.25 -4.98 117.00 120.84 3bwo n LEU 367 Ca 0.08 -2.90 -0.30 0.00 -0.03 0.00 0.00 56.01 52.86 3bwo n LEU 367 Cb 0.34 -0.65 0.20 0.00 -2.33 0.00 0.00 43.42 40.98 3bwo n LEU 367 CO 0.08 0.66 0.75 -0.55 -1.33 0.00 0.00 177.39 177.00 3bwo s SER 368 N -1.02 2.32 0.61 -1.43 0.15 -1.26 -1.60 113.70 111.47 3bwo s SER 368 Ca 0.52 0.52 -0.17 0.00 0.70 0.00 0.00 55.95 57.52 3bwo s SER 368 Cb 0.39 -0.73 -0.02 0.00 -1.71 0.00 0.00 66.02 63.95 3bwo s SER 368 CO 0.15 -3.25 1.12 -0.60 1.20 0.00 0.00 173.24 171.86 3bwo s ARG 369 N -5.60 3.04 0.16 5.44 6.06 -1.26 -3.90 118.95 122.88 3bwo s ARG 369 Ca 0.71 1.47 -0.20 0.00 -2.50 0.00 0.00 55.73 55.21 3bwo s ARG 369 Cb -0.08 -1.97 0.07 0.00 0.06 0.00 0.00 34.95 33.03 3bwo s ARG 369 CO 0.54 -1.08 1.64 0.93 -2.50 0.00 0.00 175.30 174.83 3bwo h GLU 370 N 0.51 -0.14 -0.49 5.12 4.39 -1.93 -1.02 114.58 121.02 3bwo h GLU 370 Ca -0.48 0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.26 3bwo h GLU 370 Cb 1.25 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.90 3bwo h GLU 370 CO 0.55 -0.10 0.27 -0.44 -1.16 0.00 0.00 179.01 178.14 3bwo h ASP 371 N -0.15 0.43 -0.77 1.42 3.32 -1.99 0.07 116.42 118.75 3bwo h ASP 371 Ca 0.17 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 3bwo h ASP 371 Cb 0.42 -0.08 -0.04 0.00 0.22 0.00 0.00 39.33 39.86 3bwo h ASP 371 CO -0.44 0.30 0.40 0.58 -1.72 0.00 0.00 179.24 178.36 3bwo h VAL 372 N 0.54 1.24 0.79 -1.35 2.07 -1.86 -0.93 116.25 116.75 3bwo h VAL 372 Ca 0.20 -0.64 -0.04 0.00 0.82 0.00 0.00 66.70 67.05 3bwo h VAL 372 Cb 0.05 0.24 0.01 0.00 -1.52 0.00 0.00 31.29 30.07 3bwo h VAL 372 CO -0.11 0.28 -0.38 0.15 0.02 0.00 0.00 177.57 177.53 3bwo h PHE 373 N 1.08 -0.98 -0.87 1.57 3.57 -0.45 -1.33 116.94 119.53 3bwo h PHE 373 Ca 0.27 -0.02 0.18 0.00 3.53 0.00 0.00 57.97 61.93 3bwo h PHE 373 Cb 0.08 0.33 -0.06 0.00 2.79 0.00 0.00 35.95 39.08 3bwo h PHE 373 CO 0.01 -0.60 0.57 -0.91 -2.23 0.00 0.00 178.31 175.15 3bwo h ASN 374 N -1.14 0.44 -0.01 0.41 2.35 -0.90 0.23 115.58 116.95 3bwo h ASN 374 Ca -0.11 0.04 -0.16 0.00 -0.55 0.00 0.00 56.30 55.52 3bwo h ASN 374 Cb 0.83 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 39.14 3bwo h ASN 374 CO 0.18 0.20 -0.52 0.58 -1.65 0.00 0.00 177.43 176.21 3bwo h VAL 375 N 0.45 1.31 -0.45 2.81 2.07 -1.03 -2.75 116.25 118.66 3bwo h VAL 375 Ca 0.44 -1.75 -0.05 0.00 0.82 0.00 0.00 66.70 66.17 3bwo h VAL 375 Cb 1.03 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 32.49 3bwo h VAL 375 CO -0.17 0.55 0.08 0.15 0.02 0.00 0.00 177.57 178.20 3bwo h PHE 376 N 0.46 0.72 -0.35 1.57 3.04 0.61 -2.09 116.94 120.89 3bwo h PHE 376 Ca 0.02 -0.07 -0.07 0.00 3.98 0.00 0.00 57.97 61.83 3bwo h PHE 376 Cb 1.06 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 39.35 3bwo h PHE 376 CO 0.05 0.63 -0.06 -0.07 -2.02 0.00 0.00 178.31 176.84 3bwo h LEU 377 N 0.67 0.65 0.26 0.59 3.38 -1.22 -1.13 115.31 118.51 3bwo h LEU 377 Ca 0.15 -0.35 -0.00 0.00 0.09 0.00 0.00 57.88 57.77 3bwo h LEU 377 Cb 0.30 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3bwo h LEU 377 CO 0.00 0.85 -0.20 -0.33 0.09 0.00 0.00 178.44 178.85 3bwo h GLU 378 N 0.45 -0.45 0.00 1.13 5.08 -1.17 -0.98 114.58 118.64 3bwo h GLU 378 Ca 0.09 0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.42 3bwo h GLU 378 Cb 0.55 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 3bwo h GLU 378 CO 0.03 -0.30 -0.29 0.00 -1.00 0.00 0.00 179.01 177.45 3bwo h ARG 379 N -0.47 0.00 -0.26 2.33 3.08 -1.41 -2.76 114.38 114.90 3bwo h ARG 379 Ca -0.02 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.85 3bwo h ARG 379 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.46 3bwo h ARG 379 CO -0.01 0.29 -0.58 1.25 -1.07 0.00 0.00 179.97 179.85 3bwo h LEU 380 N 0.00 0.91 0.00 3.04 7.12 -0.72 -3.07 115.31 122.59 3bwo h LEU 380 Ca -0.00 -0.50 0.00 0.00 0.13 0.00 0.00 57.88 57.50 3bwo h LEU 380 Cb 0.53 -0.26 0.00 0.00 -0.53 0.00 0.00 40.66 40.40 3bwo h LEU 380 CO 0.04 1.29 -0.12 0.00 -0.13 0.00 0.00 178.44 179.51 3bwo n ALA 381 N -2.57 2.61 0.50 1.25 0.00 -0.42 -3.52 120.51 118.37 3bwo n ALA 381 Ca -0.04 -0.16 0.07 0.00 0.00 0.00 0.00 53.44 53.31 3bwo n ALA 381 Cb 0.64 -1.39 0.08 0.00 0.00 0.00 0.00 19.45 18.79 3bwo n ALA 381 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3bwo n ASN 382 N -1.54 2.38 -4.95 0.00 2.85 -1.06 -5.01 115.26 107.93 3bwo n ASN 382 Ca 0.07 -1.67 -0.23 0.00 -0.11 0.00 0.00 54.58 52.63 3bwo n ASN 382 Cb 0.34 -0.04 0.02 0.00 1.24 0.00 0.00 39.78 41.34 3bwo n ASN 382 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3bwo s MET 383 N -1.20 2.93 0.06 1.20 0.23 -1.17 -5.08 119.30 116.27 3bwo s MET 383 Ca 0.19 -0.49 0.04 0.00 -1.03 0.00 0.00 55.69 54.41 3bwo s MET 383 Cb 0.13 -2.50 -0.03 0.00 -1.53 0.00 0.00 34.83 30.90 3bwo s MET 383 CO 0.19 -0.42 -0.12 0.21 -2.03 0.00 0.00 175.02 172.85 3bwo s LYS 384 N -4.66 0.72 0.00 3.16 2.20 -1.26 -5.02 119.74 114.89 3bwo s LYS 384 Ca 0.51 -0.85 0.00 0.00 -0.36 0.00 0.00 55.97 55.27 3bwo s LYS 384 Cb -0.10 -0.65 0.00 0.00 -1.51 0.00 0.00 37.83 35.57 3bwo s LYS 384 CO 0.39 0.14 0.00 1.28 -0.36 0.00 0.00 175.35 176.80 3bwo n LEU 385 N 1.45 0.00 0.00 5.43 7.99 -1.26 -5.11 117.00 125.49 3bwo n LEU 385 Ca -0.21 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 55.79 3bwo n LEU 385 Cb 0.54 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.85 3bwo n LEU 385 CO 0.21 0.00 0.00 0.00 -1.51 0.00 0.00 177.39 176.09 3bwo n ILE 386 N 0.00 0.00 -0.45 -0.08 0.13 -1.26 -5.17 119.36 112.53 3bwo n ILE 386 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 3bwo n ILE 386 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 38.80 3bwo n ILE 386 CO 0.00 0.00 0.00 0.29 2.80 0.00 0.00 176.55 179.64