#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mbh s VAL 6 N 0.00 2.27 0.55 3.15 1.01 -1.26 -5.10 120.40 121.02 3mbh s VAL 6 Ca 0.00 -0.95 -0.20 0.00 0.00 0.00 0.00 61.98 60.83 3mbh s VAL 6 Cb 0.00 -1.88 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 3mbh s VAL 6 CO 0.00 0.56 1.21 -0.54 0.00 0.00 0.00 175.10 176.32 3mbh s LYS 7 N 0.25 3.23 -0.07 2.72 1.02 -1.26 -4.74 119.74 120.88 3mbh s LYS 7 Ca -0.15 1.84 0.02 0.00 0.02 0.00 0.00 55.97 57.70 3mbh s LYS 7 Cb -0.17 -2.09 -0.03 0.00 -0.52 0.00 0.00 37.83 35.02 3mbh s LYS 7 CO 0.07 -1.00 -0.11 0.15 -0.92 0.00 0.00 175.35 173.54 3mbh s LYS 8 N -3.12 2.79 -0.17 1.68 1.02 -1.26 -1.10 119.74 119.57 3mbh s LYS 8 Ca 0.73 -0.64 0.01 0.00 0.02 0.00 0.00 55.97 56.09 3mbh s LYS 8 Cb -0.30 -2.52 0.02 0.00 -0.52 0.00 0.00 37.83 34.51 3mbh s LYS 8 CO 0.34 0.55 -0.18 0.42 -0.92 0.00 0.00 175.35 175.56 3mbh s ILE 9 N -0.52 1.92 -0.29 2.17 1.01 -0.01 -1.13 121.20 124.34 3mbh s ILE 9 Ca 0.07 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 59.58 3mbh s ILE 9 Cb -0.12 -1.75 0.00 0.00 0.01 0.00 0.00 42.46 40.60 3mbh s ILE 9 CO 0.02 0.52 1.30 0.00 0.00 0.00 0.00 174.94 176.77 3mbh s ALA 10 N 1.35 3.38 -0.34 9.38 0.00 0.08 -0.35 121.76 135.26 3mbh s ALA 10 Ca 0.05 0.12 -0.09 0.00 0.00 0.00 0.00 51.96 52.05 3mbh s ALA 10 Cb -0.13 -3.77 0.02 0.00 0.00 0.00 0.00 23.12 19.25 3mbh s ALA 10 CO -0.12 -1.74 0.15 0.00 0.00 0.00 0.00 175.76 174.05 3mbh s ALA 11 N 4.33 3.17 -0.87 0.00 0.00 -0.65 -0.57 121.76 127.18 3mbh s ALA 11 Ca 0.56 -1.65 -0.11 0.00 0.00 0.00 0.00 51.96 50.76 3mbh s ALA 11 Cb -0.17 -2.40 0.23 0.00 0.00 0.00 0.00 23.12 20.77 3mbh s ALA 11 CO 0.23 -1.25 0.80 0.08 0.00 0.00 0.00 175.76 175.62 3mbh s VAL 12 N 1.50 5.43 0.11 0.00 1.01 0.27 -0.23 120.40 128.50 3mbh s VAL 12 Ca 0.01 -2.78 -0.10 0.00 0.00 0.00 0.00 61.98 59.11 3mbh s VAL 12 Cb -0.19 -4.35 0.00 0.00 0.00 0.00 0.00 36.38 31.85 3mbh s VAL 12 CO 0.05 -1.05 0.24 -1.00 0.00 0.00 0.00 175.10 173.34 3mbh s HIS 13 N -0.22 0.17 0.73 5.22 3.76 -1.19 -1.08 115.29 122.68 3mbh s HIS 13 Ca 0.21 -0.57 -0.12 0.00 -0.15 0.00 0.00 55.06 54.43 3mbh s HIS 13 Cb -0.11 -0.02 0.03 0.00 1.11 0.00 0.00 32.58 33.59 3mbh s HIS 13 CO -0.08 -0.60 1.10 0.16 -0.85 0.00 0.00 174.74 174.47 3mbh s ASP 14 N -2.88 5.19 -0.28 1.40 -4.77 -1.22 -1.66 116.67 112.45 3mbh s ASP 14 Ca 0.07 1.13 -0.05 0.00 -3.30 0.00 0.00 52.55 50.41 3mbh s ASP 14 Cb 0.04 -1.89 0.02 0.00 -1.09 0.00 0.00 42.92 39.99 3mbh s ASP 14 CO -0.09 -1.51 0.03 -0.22 0.70 0.00 0.00 175.17 174.09 3mbh s LEU 15 N -5.46 3.61 -0.11 2.11 2.96 -0.39 -1.48 118.68 119.93 3mbh s LEU 15 Ca 0.59 -0.77 0.01 0.00 -0.22 0.00 0.00 54.13 53.74 3mbh s LEU 15 Cb -0.12 -1.80 -0.02 0.00 0.50 0.00 0.00 46.19 44.76 3mbh s LEU 15 CO 0.52 -0.17 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.80 3mbh s SER 16 N 1.43 3.92 0.00 3.68 0.01 -1.26 -0.60 113.70 120.88 3mbh s SER 16 Ca 0.02 -0.32 0.10 0.00 1.31 0.00 0.00 55.95 57.05 3mbh s SER 16 Cb -0.17 -1.39 0.42 0.00 0.21 0.00 0.00 66.02 65.09 3mbh s SER 16 CO -0.00 0.21 1.31 0.61 0.41 0.00 0.00 173.24 175.78 3mbh n GLY 17 N 3.22 -0.84 1.09 3.44 0.00 -0.57 -4.76 105.19 106.78 3mbh n GLY 17 Ca -0.18 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 45.92 3mbh n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mbh n GLY 19 N -0.49 -2.00 2.94 -0.02 0.00 -1.26 -4.95 105.19 99.40 3mbh n GLY 19 Ca 0.02 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 45.12 3mbh n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3mbh s ARG 20 N -4.44 2.38 0.35 1.61 0.52 -1.21 -4.93 118.95 113.24 3mbh s ARG 20 Ca 0.00 -3.09 0.05 0.00 -0.52 0.00 0.00 55.73 52.17 3mbh s ARG 20 Cb 0.00 -3.45 -0.07 0.00 0.52 0.00 0.00 34.95 31.95 3mbh s ARG 20 CO 0.00 -1.22 0.04 0.14 0.02 0.00 0.00 175.30 174.28 3mbh s VAL 21 N -1.03 1.45 0.00 3.52 -7.23 -1.26 -4.27 120.40 111.58 3mbh s VAL 21 Ca 0.22 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.39 3mbh s VAL 21 Cb -0.12 -2.86 0.00 0.00 0.56 0.00 0.00 36.38 33.96 3mbh s VAL 21 CO -0.11 -0.00 0.00 -1.54 -0.31 0.00 0.00 175.10 173.14 3mbh n SER 22 N -0.78 0.00 0.06 4.85 3.41 -1.26 -2.61 113.62 117.29 3mbh n SER 22 Ca -0.03 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.65 3mbh n SER 22 Cb 0.67 0.00 0.51 0.00 -0.26 0.00 0.00 64.21 65.13 3mbh n SER 22 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3mbh h LEU 23 N 0.00 0.30 0.00 1.04 3.38 -1.57 -0.45 115.31 118.01 3mbh h LEU 23 Ca 0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3mbh h LEU 23 Cb 0.00 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.68 3mbh h LEU 23 CO 0.00 0.21 0.00 0.35 0.09 0.00 0.00 178.44 179.09 3mbh n THR 24 N -4.49 0.05 -0.08 0.22 -2.24 -1.07 -1.09 114.28 105.58 3mbh n THR 24 Ca 0.03 0.01 -0.16 0.00 -2.27 0.00 0.00 64.05 61.66 3mbh n THR 24 Cb 0.14 -0.62 -0.05 0.00 -2.10 0.00 0.00 70.33 67.70 3mbh n THR 24 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3mbh n VAL 25 N -1.06 0.82 -0.10 2.28 0.31 -0.46 -4.56 118.33 115.55 3mbh n VAL 25 Ca 0.17 -0.22 -0.06 0.00 -0.01 0.00 0.00 64.34 64.23 3mbh n VAL 25 Cb 0.11 -1.65 0.01 0.00 -0.91 0.00 0.00 33.84 31.40 3mbh n VAL 25 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 3mbh h VAL 26 N -0.50 0.74 0.26 2.52 2.07 -1.06 -2.08 116.25 118.20 3mbh h VAL 26 Ca -0.38 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 3mbh h VAL 26 Cb 1.35 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 3mbh h VAL 26 CO -0.22 0.02 -0.12 0.40 0.02 0.00 0.00 177.57 177.67 3mbh h ILE 27 N 0.10 0.76 -0.45 4.57 2.04 -1.36 -1.29 117.51 121.89 3mbh h ILE 27 Ca 0.17 -0.08 -0.09 0.00 1.00 0.00 0.00 64.86 65.85 3mbh h ILE 27 Cb 0.23 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 3mbh h ILE 27 CO -0.28 0.02 -0.10 1.55 0.00 0.00 0.00 178.15 179.34 3mbh h PRO 28 N -0.39 0.80 0.07 2.37 0.13 -1.74 -0.99 132.00 132.26 3mbh h PRO 28 Ca -0.04 -0.27 -0.00 0.00 -0.87 0.00 0.00 66.00 64.82 3mbh h PRO 28 Cb 0.30 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.36 3mbh h PRO 28 CO 0.06 0.88 -0.04 0.82 -0.23 0.00 0.00 178.00 179.49 3mbh h ILE 29 N 0.73 1.14 -0.01 -3.56 2.04 -1.34 -1.19 117.51 115.33 3mbh h ILE 29 Ca 0.12 -0.78 -0.17 0.00 1.00 0.00 0.00 64.86 65.03 3mbh h ILE 29 Cb 0.59 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 3mbh h ILE 29 CO 0.04 0.19 -0.79 -0.07 0.00 0.00 0.00 178.15 177.52 3mbh h LEU 30 N -0.46 0.13 -0.63 1.44 3.38 -1.17 -2.60 115.31 115.39 3mbh h LEU 30 Ca -0.01 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 3mbh h LEU 30 Cb 0.39 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 3mbh h LEU 30 CO 0.02 0.86 0.31 0.28 0.09 0.00 0.00 178.44 180.00 3mbh h SER 31 N 0.06 0.82 0.00 -0.43 0.02 -1.09 -0.87 113.55 112.06 3mbh h SER 31 Ca -0.02 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 3mbh h SER 31 Cb 1.38 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 63.71 3mbh h SER 31 CO 0.11 0.72 0.00 -1.20 -1.14 0.00 0.00 176.83 175.32 3mbh n SER 32 N -4.50 0.95 -0.35 3.07 7.64 -0.45 -3.96 113.62 116.03 3mbh n SER 32 Ca 0.04 -0.93 0.02 0.00 1.01 0.00 0.00 58.87 59.01 3mbh n SER 32 Cb 0.12 -0.19 0.03 0.00 -1.01 0.00 0.00 64.21 63.16 3mbh n SER 32 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3mbh n GLY 34 N 1.46 1.17 3.25 0.23 0.00 -0.97 -4.99 105.19 105.34 3mbh n GLY 34 Ca 0.00 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 3mbh n GLY 34 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3mbh s PHE 35 N -0.64 2.25 -0.08 1.61 0.08 -0.37 -4.49 117.98 116.35 3mbh s PHE 35 Ca 0.07 -0.60 -0.30 0.00 0.12 0.00 0.00 56.93 56.22 3mbh s PHE 35 Cb 0.06 -1.47 -0.02 0.00 -0.57 0.00 0.00 43.02 41.02 3mbh s PHE 35 CO 0.01 -0.16 1.07 -1.14 -0.10 0.00 0.00 175.22 174.90 3mbh s GLN 36 N -0.24 4.41 -0.26 0.44 0.74 -0.26 -3.04 119.66 121.45 3mbh s GLN 36 Ca -0.00 1.49 -0.11 0.00 0.05 0.00 0.00 55.36 56.79 3mbh s GLN 36 Cb -0.12 -3.54 -0.05 0.00 1.10 0.00 0.00 33.01 30.40 3mbh s GLN 36 CO 0.02 -0.34 0.17 0.08 -0.55 0.00 0.00 175.29 174.67 3mbh s VAL 37 N 1.99 5.29 -0.44 1.34 1.01 -1.26 -0.83 120.40 127.50 3mbh s VAL 37 Ca 0.51 0.16 -0.09 0.00 0.00 0.00 0.00 61.98 62.56 3mbh s VAL 37 Cb -0.21 -3.50 0.09 0.00 0.00 0.00 0.00 36.38 32.77 3mbh s VAL 37 CO 0.20 0.29 0.29 0.00 0.00 0.00 0.00 175.10 175.88 3mbh s PRO 39 N 1.41 4.52 -0.64 0.00 0.04 -1.26 -1.63 135.00 137.43 3mbh s PRO 39 Ca 0.04 1.88 -0.00 0.00 0.04 0.00 0.00 61.00 62.95 3mbh s PRO 39 Cb -0.24 -3.22 0.16 0.00 0.04 0.00 0.00 34.50 31.24 3mbh s PRO 39 CO 0.01 -0.02 0.45 -1.17 0.04 0.00 0.00 177.00 176.31 3mbh s LEU 40 N -0.62 5.01 0.18 -3.56 2.96 0.68 -4.87 118.68 118.46 3mbh s LEU 40 Ca 0.51 -3.11 -0.30 0.00 -0.22 0.00 0.00 54.13 51.01 3mbh s LEU 40 Cb -0.33 -1.79 -0.08 0.00 0.50 0.00 0.00 46.19 44.49 3mbh s LEU 40 CO 0.39 -0.28 1.28 -2.16 -1.32 0.00 0.00 176.35 174.25 3mbh s PRO 41 N -0.43 4.41 0.08 0.98 0.04 -1.26 -3.17 135.00 135.65 3mbh s PRO 41 Ca 0.19 1.99 0.18 0.00 0.04 0.00 0.00 61.00 63.40 3mbh s PRO 41 Cb -0.19 -3.22 -0.12 0.00 0.04 0.00 0.00 34.50 31.01 3mbh s PRO 41 CO -0.05 -0.23 0.82 0.25 0.04 0.00 0.00 177.00 177.84 3mbh n THR 42 N 2.83 1.03 -3.52 1.26 -2.24 -0.67 -4.79 114.28 108.19 3mbh n THR 42 Ca 0.06 -0.66 -0.08 0.00 -2.27 0.00 0.00 64.05 61.11 3mbh n THR 42 Cb 0.43 -0.62 -0.02 0.00 -2.10 0.00 0.00 70.33 68.02 3mbh n THR 42 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3mbh s ALA 43 N -3.02 -1.88 -0.10 6.98 0.00 -1.26 -1.98 121.76 120.51 3mbh s ALA 43 Ca -0.03 1.16 0.04 0.00 0.00 0.00 0.00 51.96 53.13 3mbh s ALA 43 Cb 0.09 0.26 -0.00 0.00 0.00 0.00 0.00 23.12 23.47 3mbh s ALA 43 CO 0.81 -0.65 -0.23 0.08 0.00 0.00 0.00 175.76 175.77 3mbh s VAL 44 N -2.89 2.13 0.09 0.00 1.01 -0.56 -1.26 120.40 118.92 3mbh s VAL 44 Ca 0.06 -1.00 0.04 0.00 0.00 0.00 0.00 61.98 61.08 3mbh s VAL 44 Cb -0.01 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 3mbh s VAL 44 CO -0.08 0.56 -0.12 -0.76 0.00 0.00 0.00 175.10 174.71 3mbh s LEU 45 N 0.31 2.37 0.43 3.92 1.02 0.23 -0.40 118.68 126.56 3mbh s LEU 45 Ca -0.17 -0.75 0.13 0.00 0.02 0.00 0.00 54.13 53.35 3mbh s LEU 45 Cb -0.18 -0.39 0.94 0.00 0.02 0.00 0.00 46.19 46.59 3mbh s LEU 45 CO 0.08 -0.19 1.98 0.77 0.02 0.00 0.00 176.35 179.01 3mbh h SER 46 N 3.77 0.08 -5.63 2.29 4.64 -1.85 -1.51 113.55 115.33 3mbh h SER 46 Ca -0.38 -0.01 0.27 0.00 -0.47 0.00 0.00 61.79 61.19 3mbh h SER 46 Cb 1.19 -0.02 -0.09 0.00 -0.31 0.00 0.00 62.40 63.17 3mbh h SER 46 CO 0.49 0.24 0.73 0.54 -0.87 0.00 0.00 176.83 177.95 3mbh s ASN 47 N -6.96 -0.06 0.92 4.97 4.22 -1.26 -2.74 114.94 114.03 3mbh s ASN 47 Ca -0.05 -0.29 -0.12 0.00 -2.14 0.00 0.00 52.86 50.27 3mbh s ASN 47 Cb 0.16 0.28 0.14 0.00 1.28 0.00 0.00 41.25 43.11 3mbh s ASN 47 CO 0.71 -0.54 1.10 -1.38 -2.04 0.00 0.00 177.10 174.95 3mbh s HIS 48 N -2.52 2.33 -2.09 1.54 -3.43 -1.26 -4.83 115.29 105.03 3mbh s HIS 48 Ca 0.17 1.12 0.15 0.00 -0.80 0.00 0.00 55.06 55.70 3mbh s HIS 48 Cb 0.02 -3.21 0.46 0.00 -1.43 0.00 0.00 32.58 28.41 3mbh s HIS 48 CO -0.01 -2.48 1.36 0.25 -2.00 0.00 0.00 174.74 171.86 3mbh n THR 49 N -3.91 0.42 1.25 -5.38 -2.24 -1.26 -2.93 114.28 100.23 3mbh n THR 49 Ca 0.06 -0.46 0.13 0.00 -2.27 0.00 0.00 64.05 61.51 3mbh n THR 49 Cb 0.56 0.30 0.41 0.00 -2.10 0.00 0.00 70.33 69.50 3mbh n THR 49 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3mbh n GLN 50 N 0.53 0.78 -1.63 -0.78 6.02 -1.26 -4.58 117.38 116.45 3mbh n GLN 50 Ca 0.14 -0.44 -0.30 0.00 -0.01 0.00 0.00 57.00 56.39 3mbh n GLN 50 Cb 0.33 -1.49 0.08 0.00 1.02 0.00 0.00 30.24 30.17 3mbh n GLN 50 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 3mbh s TYR 51 N -2.52 2.97 0.40 1.08 2.02 -1.15 -4.97 117.35 115.18 3mbh s TYR 51 Ca 0.24 1.14 0.08 0.00 -0.37 0.00 0.00 57.07 58.16 3mbh s TYR 51 Cb 0.19 -3.09 0.82 0.00 -0.40 0.00 0.00 41.96 39.48 3mbh s TYR 51 CO 0.52 -1.60 2.00 -1.35 -1.57 0.00 0.00 175.55 173.56 3mbh h PRO 52 N -0.96 0.44 -4.70 -1.71 0.11 -1.90 -3.45 132.00 119.84 3mbh h PRO 52 Ca -0.46 -0.05 -0.27 0.00 0.11 0.00 0.00 66.00 65.33 3mbh h PRO 52 Cb 1.26 -0.09 -0.15 0.00 0.11 0.00 0.00 31.00 32.14 3mbh h PRO 52 CO 0.60 0.37 -0.64 0.20 -0.21 0.00 0.00 178.00 178.32 3mbh s GLY 53 N -3.81 1.29 -0.19 -0.55 0.00 -1.26 -5.17 107.32 97.64 3mbh s GLY 53 Ca -0.07 -1.63 -0.30 0.00 0.00 0.00 0.00 44.72 42.72 3mbh s GLY 53 CO 0.73 -1.49 1.09 -0.11 0.00 0.00 0.00 173.10 173.33 3mbh s PHE 54 N -3.84 -0.28 0.40 1.90 -0.71 -1.26 -4.90 117.98 109.29 3mbh s PHE 54 Ca 0.29 0.47 -0.15 0.00 -1.04 0.00 0.00 56.93 56.50 3mbh s PHE 54 Cb 0.07 0.46 -0.08 0.00 -1.21 0.00 0.00 43.02 42.26 3mbh s PHE 54 CO 0.06 -0.27 0.83 -1.54 -1.34 0.00 0.00 175.22 172.96 3mbh s SER 55 N -1.14 6.68 -0.20 1.98 1.04 -1.26 -4.95 113.70 115.85 3mbh s SER 55 Ca 0.01 1.34 -0.07 0.00 0.48 0.00 0.00 55.95 57.71 3mbh s SER 55 Cb -0.01 -2.41 0.09 0.00 0.10 0.00 0.00 66.02 63.80 3mbh s SER 55 CO -0.01 -0.37 0.44 0.12 0.98 0.00 0.00 173.24 174.39 3mbh s PHE 56 N -2.28 -0.81 -0.16 5.02 5.36 -1.26 -3.14 117.98 120.72 3mbh s PHE 56 Ca 0.55 1.55 0.01 0.00 -0.96 0.00 0.00 56.93 58.08 3mbh s PHE 56 Cb -0.10 0.33 0.02 0.00 -0.34 0.00 0.00 43.02 42.93 3mbh s PHE 56 CO 0.24 -0.48 -0.17 -1.17 -1.46 0.00 0.00 175.22 172.19 3mbh s LEU 57 N 2.48 1.88 -0.12 6.12 2.96 0.47 -4.98 118.68 127.48 3mbh s LEU 57 Ca -0.03 -0.55 -0.29 0.00 -0.22 0.00 0.00 54.13 53.03 3mbh s LEU 57 Cb -0.11 -1.31 -0.01 0.00 0.50 0.00 0.00 46.19 45.26 3mbh s LEU 57 CO -0.13 -0.02 1.02 -0.62 -1.32 0.00 0.00 176.35 175.28 3mbh s ASP 58 N 1.36 7.22 -0.21 3.68 -1.08 -1.26 -1.50 116.67 124.88 3mbh s ASP 58 Ca 0.04 1.53 0.15 0.00 -0.52 0.00 0.00 52.55 53.75 3mbh s ASP 58 Cb -0.13 -2.55 0.77 0.00 -1.46 0.00 0.00 42.92 39.54 3mbh s ASP 58 CO -0.11 -0.48 1.69 0.18 0.52 0.00 0.00 175.17 176.97 3mbh n LEU 59 N 5.19 5.35 -0.30 -1.34 4.77 -0.83 -4.62 117.00 125.21 3mbh n LEU 59 Ca 0.09 -2.87 0.14 0.00 -0.03 0.00 0.00 56.01 53.34 3mbh n LEU 59 Cb 0.48 -0.65 0.31 0.00 -2.33 0.00 0.00 43.42 41.24 3mbh n LEU 59 CO 0.52 0.66 1.03 0.74 -1.33 0.00 0.00 177.39 179.02 3mbh h THR 60 N 3.71 0.43 0.00 -5.08 2.02 -1.91 -1.69 112.91 110.40 3mbh h THR 60 Ca 0.00 -0.12 -0.05 0.00 0.77 0.00 0.00 66.41 67.01 3mbh h THR 60 Cb 1.83 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 68.28 3mbh h THR 60 CO 0.42 0.07 -0.39 0.44 0.37 0.00 0.00 175.52 176.42 3mbh h ASP 61 N 0.36 0.00 -0.09 4.18 3.32 -1.97 -3.38 116.42 118.84 3mbh h ASP 61 Ca 0.57 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.48 3mbh h ASP 61 Cb 1.11 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.60 3mbh h ASP 61 CO -0.56 0.23 -0.16 1.21 -1.72 0.00 0.00 179.24 178.25 3mbh n GLU 62 N -3.09 1.63 0.00 3.56 4.07 -0.64 -4.39 120.64 121.78 3mbh n GLU 62 Ca 0.02 -0.72 0.00 0.00 -0.06 0.00 0.00 57.16 56.40 3mbh n GLU 62 Cb 0.63 -1.61 0.00 0.00 -0.06 0.00 0.00 31.44 30.41 3mbh n GLU 62 CO 0.00 0.00 0.00 -2.30 -0.06 0.00 0.00 177.13 174.77 3mbh n PRO 64 N 1.92 0.00 -0.10 5.31 -0.02 -1.26 -1.61 135.00 139.24 3mbh n PRO 64 Ca 0.26 0.00 -0.10 0.00 -2.02 0.00 0.00 63.50 61.64 3mbh n PRO 64 Cb 0.72 0.00 0.04 0.00 -0.02 0.00 0.00 33.50 34.24 3mbh n PRO 64 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 3mbh h LYS 65 N 0.00 0.84 -0.02 -0.52 1.57 -1.94 -0.13 116.57 116.38 3mbh h LYS 65 Ca 0.00 -0.40 -0.00 0.00 -1.87 0.00 0.00 60.65 58.38 3mbh h LYS 65 Cb 0.00 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.30 3mbh h LYS 65 CO 0.00 1.03 0.00 0.82 -0.57 0.00 0.00 179.45 180.74 3mbh h ILE 66 N 0.71 1.22 -0.60 1.86 2.04 -1.67 -3.05 117.51 118.02 3mbh h ILE 66 Ca 0.08 -0.66 0.07 0.00 1.00 0.00 0.00 64.86 65.35 3mbh h ILE 66 Cb 0.86 1.64 -0.06 0.00 -0.74 0.00 0.00 36.82 38.52 3mbh h ILE 66 CO 0.08 0.18 0.27 0.40 0.00 0.00 0.00 178.15 179.07 3mbh h ILE 67 N -0.24 0.86 -0.67 -0.67 2.04 -1.83 -1.66 117.51 115.35 3mbh h ILE 67 Ca 0.01 -0.17 0.12 0.00 1.00 0.00 0.00 64.86 65.81 3mbh h ILE 67 Cb 0.28 0.32 -0.09 0.00 -0.74 0.00 0.00 36.82 36.60 3mbh h ILE 67 CO 0.00 0.09 0.22 0.00 0.00 0.00 0.00 178.15 178.47 3mbh h ALA 68 N 1.36 0.87 -0.37 1.87 0.00 -0.97 -0.54 119.26 121.49 3mbh h ALA 68 Ca 0.28 0.11 -0.11 0.00 0.00 0.00 0.00 54.91 55.20 3mbh h ALA 68 Cb 0.27 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3mbh h ALA 68 CO -0.24 -0.23 -0.22 0.93 0.00 0.00 0.00 179.25 179.49 3mbh h GLU 69 N 0.38 0.72 -0.74 0.00 4.39 -1.35 -2.08 114.58 115.90 3mbh h GLU 69 Ca 0.35 -0.28 -0.03 0.00 0.34 0.00 0.00 59.36 59.74 3mbh h GLU 69 Cb 0.51 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.08 3mbh h GLU 69 CO -0.38 0.88 0.35 -1.49 -1.16 0.00 0.00 179.01 177.21 3mbh h TRP 70 N 0.63 1.05 -0.07 4.33 6.55 -0.22 0.31 115.95 128.54 3mbh h TRP 70 Ca 0.09 -0.04 -0.00 0.00 0.95 0.00 0.00 58.89 59.88 3mbh h TRP 70 Cb 0.71 -0.33 -0.00 0.00 -0.86 0.00 0.00 29.16 28.68 3mbh h TRP 70 CO 0.03 0.76 0.03 0.87 -1.05 0.00 0.00 178.44 179.09 3mbh h LYS 71 N 1.05 0.09 -0.49 0.49 1.57 -1.09 -1.77 116.57 116.41 3mbh h LYS 71 Ca 0.26 -0.01 0.09 0.00 -1.87 0.00 0.00 60.65 59.11 3mbh h LYS 71 Cb 0.11 -0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.33 3mbh h LYS 71 CO -0.03 0.17 0.06 0.87 -0.57 0.00 0.00 179.45 179.95 3mbh h LYS 72 N -0.01 0.18 0.00 3.15 1.57 -0.62 0.17 116.57 121.01 3mbh h LYS 72 Ca 0.02 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3mbh h LYS 72 Cb 0.11 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.38 3mbh h LYS 72 CO -0.00 0.12 0.00 1.28 -0.57 0.00 0.00 179.45 180.28 3mbh n LEU 73 N -5.16 0.00 -3.31 2.94 4.77 0.10 -4.87 117.00 111.47 3mbh n LEU 73 Ca 0.05 0.38 -0.23 0.00 -0.03 0.00 0.00 56.01 56.19 3mbh n LEU 73 Cb 0.25 -0.38 -0.00 0.00 -2.33 0.00 0.00 43.42 40.96 3mbh n LEU 73 CO 0.18 -0.23 -0.04 -0.62 -1.33 0.00 0.00 177.39 175.36 3mbh n GLU 74 N -1.38 -3.35 -1.86 3.23 1.02 0.61 -4.93 120.64 113.98 3mbh n GLU 74 Ca 0.05 0.48 -0.42 0.00 -0.02 0.00 0.00 57.16 57.25 3mbh n GLU 74 Cb 0.12 -5.18 -0.02 0.00 -0.02 0.00 0.00 31.44 26.33 3mbh n GLU 74 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 3mbh s VAL 75 N -2.91 2.32 -0.08 2.62 -7.23 -1.02 -5.01 120.40 109.07 3mbh s VAL 75 Ca 0.38 0.25 -0.02 0.00 -1.81 0.00 0.00 61.98 60.78 3mbh s VAL 75 Cb -0.20 -3.16 -0.03 0.00 0.56 0.00 0.00 36.38 33.55 3mbh s VAL 75 CO 0.46 0.03 0.01 -1.10 -0.31 0.00 0.00 175.10 174.20 3mbh s GLN 76 N 0.00 3.01 -0.10 4.82 -0.21 -1.26 -4.92 119.66 121.00 3mbh s GLN 76 Ca 0.65 -0.40 0.02 0.00 0.02 0.00 0.00 55.36 55.65 3mbh s GLN 76 Cb -0.46 -2.82 -0.01 0.00 1.00 0.00 0.00 33.01 30.72 3mbh s GLN 76 CO 0.42 0.70 -0.17 -0.06 -2.12 0.00 0.00 175.29 174.07 3mbh s PHE 77 N -0.91 2.70 0.11 0.91 0.08 -1.26 -4.78 117.98 114.82 3mbh s PHE 77 Ca 0.14 -0.61 0.10 0.00 0.12 0.00 0.00 56.93 56.68 3mbh s PHE 77 Cb -0.11 -1.74 0.01 0.00 -0.57 0.00 0.00 43.02 40.61 3mbh s PHE 77 CO 0.03 -0.16 1.41 -0.44 -0.10 0.00 0.00 175.22 175.96 3mbh h ASP 78 N 6.32 0.00 -5.06 1.36 3.32 -1.51 -3.45 116.42 117.39 3mbh h ASP 78 Ca -0.30 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.63 3mbh h ASP 78 Cb 1.20 0.00 -0.18 0.00 0.22 0.00 0.00 39.33 40.57 3mbh h ASP 78 CO 0.52 0.80 -0.43 0.00 -1.72 0.00 0.00 179.24 178.40 3mbh s ALA 79 N -2.99 -0.29 -0.12 3.45 0.00 -1.07 -1.70 121.76 119.03 3mbh s ALA 79 Ca 0.01 -0.32 0.01 0.00 0.00 0.00 0.00 51.96 51.65 3mbh s ALA 79 Cb 0.10 0.25 0.02 0.00 0.00 0.00 0.00 23.12 23.49 3mbh s ALA 79 CO 0.79 -0.34 -0.14 0.42 0.00 0.00 0.00 175.76 176.49 3mbh s ILE 80 N -2.45 1.45 -0.19 0.00 1.01 -0.79 -0.74 121.20 119.50 3mbh s ILE 80 Ca -0.06 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 60.01 3mbh s ILE 80 Cb -0.02 -1.35 0.04 0.00 0.01 0.00 0.00 42.46 41.14 3mbh s ILE 80 CO -0.03 0.44 -0.11 -0.47 0.00 0.00 0.00 174.94 174.76 3mbh s TYR 81 N 1.25 2.41 0.14 3.97 5.04 0.26 -0.67 117.35 129.76 3mbh s TYR 81 Ca -0.01 -1.56 0.04 0.00 -2.44 0.00 0.00 57.07 53.10 3mbh s TYR 81 Cb -0.14 -1.65 -0.04 0.00 0.35 0.00 0.00 41.96 40.49 3mbh s TYR 81 CO -0.06 -0.74 0.13 0.95 -1.34 0.00 0.00 175.55 174.50 3mbh s THR 82 N 1.40 4.54 0.00 4.34 -4.23 0.00 -0.57 115.64 121.13 3mbh s THR 82 Ca -0.00 -0.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.52 3mbh s THR 82 Cb -0.16 -3.29 0.00 0.00 1.34 0.00 0.00 72.50 70.39 3mbh s THR 82 CO -0.09 -0.05 0.00 0.61 -0.54 0.00 0.00 174.62 174.55 3mbh n GLY 83 N -0.16 4.21 3.68 3.99 0.00 -0.24 -0.80 105.19 115.86 3mbh n GLY 83 Ca -0.08 -0.43 -0.42 0.00 0.00 0.00 0.00 46.02 45.08 3mbh n GLY 83 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3mbh s TYR 84 N 2.96 2.13 0.04 1.61 6.14 -1.26 -4.51 117.35 124.46 3mbh s TYR 84 Ca 0.00 0.13 0.02 0.00 0.64 0.00 0.00 57.07 57.86 3mbh s TYR 84 Cb 0.00 -4.03 -0.04 0.00 0.42 0.00 0.00 41.96 38.32 3mbh s TYR 84 CO 0.00 -4.26 0.04 -0.51 0.64 0.00 0.00 175.55 171.47 3mbh s LEU 85 N 3.19 3.69 0.33 6.97 1.43 -1.26 -3.40 118.68 129.62 3mbh s LEU 85 Ca 0.77 0.00 0.26 0.00 -1.03 0.00 0.00 54.13 54.13 3mbh s LEU 85 Cb -0.40 -2.25 0.79 0.00 0.03 0.00 0.00 46.19 44.36 3mbh s LEU 85 CO 0.34 0.23 1.75 1.23 0.23 0.00 0.00 176.35 180.12 3mbh h GLY 86 N 3.81 0.00 -3.91 -3.19 0.00 -1.94 -3.47 103.07 94.37 3mbh h GLY 86 Ca -0.48 0.00 0.11 0.00 0.00 0.00 0.00 47.33 46.96 3mbh h GLY 86 CO 0.62 0.00 0.56 -1.35 0.00 0.00 0.00 176.54 176.36 3mbh s SER 87 N -5.10 -0.34 0.50 0.19 1.04 -1.26 -4.91 113.70 103.82 3mbh s SER 87 Ca 0.07 0.18 0.16 0.00 0.48 0.00 0.00 55.95 56.84 3mbh s SER 87 Cb 0.09 0.32 1.21 0.00 0.10 0.00 0.00 66.02 67.74 3mbh s SER 87 CO 0.57 -0.44 2.11 -0.65 0.98 0.00 0.00 173.24 175.80 3mbh h PRO 88 N 2.25 0.11 -0.27 4.02 0.11 -1.90 -1.14 132.00 135.18 3mbh h PRO 88 Ca -0.19 -0.01 0.08 0.00 0.11 0.00 0.00 66.00 66.00 3mbh h PRO 88 Cb 1.20 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 3mbh h PRO 88 CO 0.30 0.07 0.29 0.00 -0.21 0.00 0.00 178.00 178.46 3mbh h ARG 89 N 0.11 0.00 0.00 1.05 3.08 -1.95 -2.56 114.38 114.11 3mbh h ARG 89 Ca 0.07 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 3mbh h ARG 89 Cb 0.15 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 3mbh h ARG 89 CO -0.01 0.00 -0.07 1.96 -1.07 0.00 0.00 179.97 180.78 3mbh h GLN 90 N 0.00 0.00 -0.69 0.04 4.20 -1.60 -3.20 115.11 113.87 3mbh h GLN 90 Ca 0.13 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.84 3mbh h GLN 90 Cb 0.72 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.46 3mbh h GLN 90 CO -0.00 0.07 0.43 0.82 -0.67 0.00 0.00 178.83 179.48 3mbh h ILE 91 N 0.00 1.19 -0.39 2.54 5.03 -1.63 0.08 117.51 124.33 3mbh h ILE 91 Ca -0.00 -0.40 0.03 0.00 -0.12 0.00 0.00 64.86 64.37 3mbh h ILE 91 Cb 0.72 0.22 -0.03 0.00 -3.03 0.00 0.00 36.82 34.70 3mbh h ILE 91 CO 0.01 0.19 0.19 -0.61 -0.68 0.00 0.00 178.15 177.26 3mbh h GLN 92 N 0.94 0.38 -0.53 2.37 5.75 -1.76 0.21 115.11 122.47 3mbh h GLN 92 Ca 0.25 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 58.70 3mbh h GLN 92 Cb -0.05 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.39 3mbh h GLN 92 CO -0.05 0.25 0.24 0.82 -2.65 0.00 0.00 178.83 177.44 3mbh h ILE 93 N 0.39 1.21 -0.37 2.39 2.04 -1.55 -1.16 117.51 120.45 3mbh h ILE 93 Ca 0.17 -0.61 -0.16 0.00 1.00 0.00 0.00 64.86 65.26 3mbh h ILE 93 Cb 0.08 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 3mbh h ILE 93 CO -0.12 0.24 -0.40 0.58 0.00 0.00 0.00 178.15 178.44 3mbh h VAL 94 N 0.71 1.27 -0.40 1.67 2.07 -0.67 0.03 116.25 120.93 3mbh h VAL 94 Ca 0.18 -1.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.09 3mbh h VAL 94 Cb 0.15 1.41 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 3mbh h VAL 94 CO -0.02 0.53 0.11 -1.28 0.02 0.00 0.00 177.57 176.92 3mbh h SER 95 N 0.75 0.60 -0.75 0.57 0.87 -0.50 0.81 113.55 115.90 3mbh h SER 95 Ca 0.06 -0.22 -0.04 0.00 -1.23 0.00 0.00 61.79 60.35 3mbh h SER 95 Cb 1.00 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.77 3mbh h SER 95 CO 0.10 0.66 0.30 0.44 -0.53 0.00 0.00 176.83 177.80 3mbh h ASP 96 N 0.50 1.03 -0.23 6.23 3.32 -1.15 -0.65 116.42 125.47 3mbh h ASP 96 Ca 0.13 -0.17 0.05 0.00 0.02 0.00 0.00 57.03 57.05 3mbh h ASP 96 Cb 0.29 -0.27 -0.05 0.00 0.22 0.00 0.00 39.33 39.53 3mbh h ASP 96 CO -0.00 0.93 -0.08 0.15 -1.72 0.00 0.00 179.24 178.52 3mbh h PHE 97 N 1.08 -0.17 -0.57 4.55 3.57 -0.76 0.39 116.94 125.03 3mbh h PHE 97 Ca 0.25 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.76 3mbh h PHE 97 Cb 0.22 0.11 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 3mbh h PHE 97 CO 0.02 -0.13 0.30 0.82 -2.23 0.00 0.00 178.31 177.09 3mbh h ILE 98 N -0.03 1.20 -0.53 1.41 2.04 -0.59 0.34 117.51 121.35 3mbh h ILE 98 Ca 0.11 -0.52 0.06 0.00 1.00 0.00 0.00 64.86 65.51 3mbh h ILE 98 Cb 0.20 0.49 -0.05 0.00 -0.74 0.00 0.00 36.82 36.73 3mbh h ILE 98 CO -0.25 0.22 0.24 0.50 0.00 0.00 0.00 178.15 178.85 3mbh h LYS 99 N 0.77 0.44 0.00 2.37 3.64 -0.83 0.45 116.57 123.42 3mbh h LYS 99 Ca 0.20 -0.03 -0.11 0.00 -1.27 0.00 0.00 60.65 59.44 3mbh h LYS 99 Cb 0.08 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 3mbh h LYS 99 CO -0.03 0.29 -0.75 -0.44 -2.27 0.00 0.00 179.45 176.25 3mbh h ASP 100 N 0.45 0.00 -0.02 4.20 3.32 -0.61 -3.33 116.42 120.43 3mbh h ASP 100 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 3mbh h ASP 100 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3mbh h ASP 100 CO -0.21 0.45 -0.25 0.49 -1.72 0.00 0.00 179.24 178.01 3mbh n PHE 101 N -3.09 0.00 -2.41 4.55 3.01 0.08 -5.00 117.46 114.61 3mbh n PHE 101 Ca -0.01 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.10 3mbh n PHE 101 Cb 0.74 0.00 -0.02 0.00 -0.01 0.00 0.00 39.48 40.19 3mbh n PHE 101 CO 0.00 0.00 0.00 -0.98 1.01 0.00 0.00 176.76 176.79 3mbh s ARG 102 N -1.85 3.68 0.23 -1.08 1.70 0.13 -4.70 118.95 117.06 3mbh s ARG 102 Ca 0.16 1.51 0.06 0.00 -0.47 0.00 0.00 55.73 57.00 3mbh s ARG 102 Cb 0.14 -2.15 -0.05 0.00 -0.57 0.00 0.00 34.95 32.33 3mbh s ARG 102 CO 0.37 -0.56 -0.09 -0.65 -1.08 0.00 0.00 175.30 173.29 3mbh s GLN 103 N -3.11 1.40 0.36 3.89 -0.21 -1.26 -5.00 119.66 115.72 3mbh s GLN 103 Ca 0.68 -1.67 0.11 0.00 0.02 0.00 0.00 55.36 54.50 3mbh s GLN 103 Cb -0.21 -1.02 0.88 0.00 1.00 0.00 0.00 33.01 33.66 3mbh s GLN 103 CO 0.25 0.08 1.83 -1.35 -2.12 0.00 0.00 175.29 173.98 3mbh h PRO 104 N 2.45 0.61 -0.51 2.91 0.11 -1.99 0.36 132.00 135.94 3mbh h PRO 104 Ca -0.39 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3mbh h PRO 104 Cb 1.22 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3mbh h PRO 104 CO 0.65 0.40 0.00 -0.25 -0.21 0.00 0.00 178.00 178.59 3mbh n ASP 105 N -4.61 4.71 -4.75 -2.05 8.00 -1.26 -5.00 116.55 111.59 3mbh n ASP 105 Ca 0.20 -2.69 -0.40 0.00 0.71 0.00 0.00 54.79 52.61 3mbh n ASP 105 Cb 0.58 -0.57 0.02 0.00 -0.02 0.00 0.00 41.12 41.13 3mbh n ASP 105 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3mbh n SER 106 N 0.54 3.14 -4.55 -2.24 7.64 0.11 -4.95 113.62 113.32 3mbh n SER 106 Ca 0.24 1.09 -0.37 0.00 1.01 0.00 0.00 58.87 60.85 3mbh n SER 106 Cb 0.95 -1.59 -0.11 0.00 -1.01 0.00 0.00 64.21 62.45 3mbh n SER 106 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 3mbh s LEU 107 N -2.69 3.76 -0.20 -3.43 2.96 -0.69 -4.93 118.68 113.46 3mbh s LEU 107 Ca 0.63 -0.06 -0.04 0.00 -0.22 0.00 0.00 54.13 54.44 3mbh s LEU 107 Cb -0.45 -2.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.22 3mbh s LEU 107 CO 0.56 0.01 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.93 3mbh s ILE 108 N 1.37 3.50 -0.14 6.68 -1.09 -1.26 -1.88 121.20 128.39 3mbh s ILE 108 Ca 0.06 -0.46 0.03 0.00 -2.23 0.00 0.00 60.65 58.04 3mbh s ILE 108 Cb -0.15 -2.57 0.01 0.00 -1.58 0.00 0.00 42.46 38.17 3mbh s ILE 108 CO 0.05 0.44 -0.22 -0.69 -1.23 0.00 0.00 174.94 173.30 3mbh s VAL 109 N 1.13 2.04 -0.20 2.92 1.01 0.16 -0.76 120.40 126.70 3mbh s VAL 109 Ca 0.02 -0.97 0.01 0.00 0.00 0.00 0.00 61.98 61.04 3mbh s VAL 109 Cb -0.15 -1.80 0.03 0.00 0.00 0.00 0.00 36.38 34.46 3mbh s VAL 109 CO -0.00 0.55 -0.17 0.00 0.00 0.00 0.00 175.10 175.47 3mbh s ALA 110 N 0.77 2.32 -0.35 5.51 0.00 -0.32 -0.82 121.76 128.88 3mbh s ALA 110 Ca -0.08 -1.31 -0.22 0.00 0.00 0.00 0.00 51.96 50.35 3mbh s ALA 110 Cb -0.16 -1.26 0.00 0.00 0.00 0.00 0.00 23.12 21.71 3mbh s ALA 110 CO -0.01 -0.56 0.73 0.34 0.00 0.00 0.00 175.76 176.26 3mbh s ASP 111 N 1.27 6.53 -1.30 0.00 -1.08 0.02 -3.11 116.67 118.99 3mbh s ASP 111 Ca 0.02 0.34 -0.14 0.00 -0.52 0.00 0.00 52.55 52.24 3mbh s ASP 111 Cb -0.15 -2.37 0.11 0.00 -1.46 0.00 0.00 42.92 39.05 3mbh s ASP 111 CO -0.11 -0.66 1.76 -0.81 0.52 0.00 0.00 175.17 175.88 3mbh n PRO 112 N 6.24 3.26 -2.17 4.34 -0.04 -1.26 -4.14 135.00 141.23 3mbh n PRO 112 Ca 0.02 -3.37 -0.43 0.00 -0.04 0.00 0.00 63.50 59.68 3mbh n PRO 112 Cb 0.48 -3.22 -0.02 0.00 -0.04 0.00 0.00 33.50 30.70 3mbh n PRO 112 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3mbh s VAL 113 N 2.56 3.68 0.00 0.52 1.01 -1.26 -4.71 120.40 122.19 3mbh s VAL 113 Ca 0.47 0.69 0.00 0.00 0.00 0.00 0.00 61.98 63.13 3mbh s VAL 113 Cb 0.05 -3.93 0.00 0.00 0.00 0.00 0.00 36.38 32.49 3mbh s VAL 113 CO 0.01 -0.60 0.00 0.18 0.00 0.00 0.00 175.10 174.69 3mbh n LEU 114 N 9.61 0.32 0.00 3.92 4.77 -1.26 -4.79 117.00 129.57 3mbh n LEU 114 Ca 0.20 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 3mbh n LEU 114 Cb 0.47 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 3mbh n LEU 114 CO 0.70 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.42 3mbh n GLY 115 N 1.68 -1.71 3.80 -0.72 0.00 -1.26 -0.39 105.19 106.59 3mbh n GLY 115 Ca 0.00 -1.10 -0.08 0.00 0.00 0.00 0.00 46.02 44.84 3mbh n GLY 115 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3mbh s ASP 116 N -0.88 -0.24 -1.48 1.61 -1.08 -0.45 -4.54 116.67 109.60 3mbh s ASP 116 Ca 0.00 -0.65 -0.13 0.00 -0.52 0.00 0.00 52.55 51.26 3mbh s ASP 116 Cb 0.00 0.70 0.09 0.00 -1.46 0.00 0.00 42.92 42.25 3mbh s ASP 116 CO 0.00 -1.30 0.77 0.59 0.52 0.00 0.00 175.17 175.75 3mbh n ASN 117 N -0.44 -4.36 -0.34 -0.34 5.03 -1.26 -1.73 115.26 111.81 3mbh n ASN 117 Ca -0.04 -0.65 -0.04 0.00 0.87 0.00 0.00 54.58 54.72 3mbh n ASN 117 Cb 0.60 -3.53 -0.02 0.00 -1.02 0.00 0.00 39.78 35.81 3mbh n ASN 117 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3mbh n GLY 118 N -1.46 0.73 3.20 7.41 0.00 -1.26 -5.00 105.19 108.80 3mbh n GLY 118 Ca 0.02 -0.75 -0.13 0.00 0.00 0.00 0.00 46.02 45.16 3mbh n GLY 118 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3mbh s ARG 119 N -2.22 0.46 0.52 1.61 3.52 -0.71 -5.02 118.95 117.12 3mbh s ARG 119 Ca 0.00 0.18 -0.22 0.00 -0.13 0.00 0.00 55.73 55.56 3mbh s ARG 119 Cb 0.00 0.21 -0.06 0.00 -1.56 0.00 0.00 34.95 33.55 3mbh s ARG 119 CO 0.00 -0.09 1.26 -0.51 -0.81 0.00 0.00 175.30 175.15 3mbh s LEU 120 N -0.40 3.90 0.82 -0.88 1.43 -1.26 -1.34 118.68 120.94 3mbh s LEU 120 Ca -0.05 2.54 -0.13 0.00 -1.03 0.00 0.00 54.13 55.46 3mbh s LEU 120 Cb -0.03 -4.29 0.09 0.00 0.03 0.00 0.00 46.19 41.98 3mbh s LEU 120 CO 0.02 -1.31 1.20 -0.31 0.23 0.00 0.00 176.35 176.17 3mbh s TYR 121 N -1.43 1.79 0.18 0.29 2.02 0.48 -4.84 117.35 115.83 3mbh s TYR 121 Ca 0.69 1.69 -0.33 0.00 -0.37 0.00 0.00 57.07 58.75 3mbh s TYR 121 Cb -0.35 -3.46 -0.14 0.00 -0.40 0.00 0.00 41.96 37.61 3mbh s TYR 121 CO 0.41 -2.83 1.38 2.41 -1.57 0.00 0.00 175.55 175.34 3mbh n THR 122 N -3.42 0.59 -0.46 -0.71 -1.04 -1.26 -1.23 114.28 106.75 3mbh n THR 122 Ca 0.13 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 61.99 3mbh n THR 122 Cb 0.51 -1.25 0.00 0.00 -1.82 0.00 0.00 70.33 67.77 3mbh n THR 122 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3mbh n ASN 123 N 2.45 0.00 -4.79 8.00 3.02 -1.26 -5.01 115.26 117.67 3mbh n ASN 123 Ca 0.15 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.36 3mbh n ASN 123 Cb 0.27 -1.08 -0.00 0.00 -0.61 0.00 0.00 39.78 38.36 3mbh n ASN 123 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3mbh s PHE 124 N -2.29 2.86 0.00 3.10 0.40 -0.36 -5.15 117.98 116.54 3mbh s PHE 124 Ca 0.00 1.55 0.00 0.00 -0.60 0.00 0.00 56.93 57.88 3mbh s PHE 124 Cb 0.00 -3.12 0.00 0.00 0.51 0.00 0.00 43.02 40.41 3mbh s PHE 124 CO 0.00 -1.22 0.00 -0.40 0.70 0.00 0.00 175.22 174.30 3mbh n ASP 125 N -1.53 0.00 -1.72 1.36 5.68 -1.26 -4.87 116.55 114.21 3mbh n ASP 125 Ca 0.10 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.39 3mbh n ASP 125 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 3mbh n ASP 125 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3mbh n GLU 127 N 0.00 -2.01 0.00 0.11 -0.58 -1.26 -4.76 120.64 112.15 3mbh n GLU 127 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3mbh n GLU 127 Cb 0.00 -3.94 0.00 0.00 -0.57 0.00 0.00 31.44 26.93 3mbh n GLU 127 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 3mbh n VAL 129 N -1.70 0.00 -0.34 2.62 0.31 -1.26 -2.22 118.33 115.74 3mbh n VAL 129 Ca 0.00 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.30 3mbh n VAL 129 Cb 0.26 0.00 0.09 0.00 -0.91 0.00 0.00 33.84 33.28 3mbh n VAL 129 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 3mbh h LYS 130 N 0.00 1.22 -1.64 5.55 1.57 -1.93 -1.65 116.57 119.69 3mbh h LYS 130 Ca 0.00 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.69 3mbh h LYS 130 Cb 0.00 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.04 3mbh h LYS 130 CO 0.00 0.83 0.00 0.39 -0.57 0.00 0.00 179.45 180.10 3mbh n GLU 131 N -4.42 0.37 0.00 3.15 -0.58 -0.94 -3.38 120.64 114.84 3mbh n GLU 131 Ca 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 3mbh n GLU 131 Cb 0.03 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 29.59 3mbh n GLU 131 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 3mbh n ARG 133 N 0.84 0.00 -0.04 3.49 1.74 -0.62 -1.55 116.66 120.52 3mbh n ARG 133 Ca 0.00 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.93 3mbh n ARG 133 Cb 0.19 0.00 -0.08 0.00 -1.02 0.00 0.00 32.46 31.54 3mbh n ARG 133 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3mbh h HIS 134 N 0.00 0.64 -1.01 -1.55 2.76 -1.85 -3.32 115.15 110.82 3mbh h HIS 134 Ca 0.00 -0.26 0.06 0.00 -2.20 0.00 0.00 60.37 57.96 3mbh h HIS 134 Cb 0.00 -0.10 -0.07 0.00 1.55 0.00 0.00 27.41 28.79 3mbh h HIS 134 CO 0.00 1.02 0.65 1.25 -1.30 0.00 0.00 177.93 179.55 3mbh h LEU 135 N 0.07 1.06 -2.02 0.26 5.85 -1.62 -1.36 115.31 117.55 3mbh h LEU 135 Ca -0.02 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.69 3mbh h LEU 135 Cb 1.04 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.85 3mbh h LEU 135 CO 0.09 0.69 -0.07 0.16 -0.34 0.00 0.00 178.44 178.96 3mbh h ILE 136 N 1.20 0.83 0.00 4.05 3.07 -1.85 -1.62 117.51 123.19 3mbh h ILE 136 Ca 0.43 -0.26 0.00 0.00 1.55 0.00 0.00 64.86 66.57 3mbh h ILE 136 Cb 0.13 1.15 0.00 0.00 -0.27 0.00 0.00 36.82 37.83 3mbh h ILE 136 CO -0.16 0.07 0.02 0.71 -1.05 0.00 0.00 178.15 177.73 3mbh h THR 137 N 0.00 0.00 -0.01 0.16 1.35 -1.37 -1.38 112.91 111.66 3mbh h THR 137 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3mbh h THR 137 Cb 0.15 0.51 0.00 0.00 -1.73 0.00 0.00 68.15 67.08 3mbh h THR 137 CO 0.01 0.00 -0.50 0.29 -0.25 0.00 0.00 175.52 175.07 3mbh n LYS 138 N -2.32 0.51 -3.86 4.72 4.76 -0.61 -4.70 118.16 116.65 3mbh n LYS 138 Ca -0.02 -0.35 -0.29 0.00 -2.87 0.00 0.00 58.31 54.79 3mbh n LYS 138 Cb 0.05 -1.49 -0.04 0.00 -1.84 0.00 0.00 35.03 31.71 3mbh n LYS 138 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3mbh s ALA 139 N -2.73 3.94 0.02 7.82 0.00 -0.52 -4.92 121.76 125.37 3mbh s ALA 139 Ca 0.16 -0.88 -0.04 0.00 0.00 0.00 0.00 51.96 51.21 3mbh s ALA 139 Cb 0.18 -1.87 -0.28 0.00 0.00 0.00 0.00 23.12 21.15 3mbh s ALA 139 CO 0.64 0.64 0.92 -0.44 0.00 0.00 0.00 175.76 177.52 3mbh h ASP 140 N 2.52 0.41 -3.52 0.00 3.32 -1.25 -3.20 116.42 114.70 3mbh h ASP 140 Ca -0.47 -0.53 -0.44 0.00 0.02 0.00 0.00 57.03 55.61 3mbh h ASP 140 Cb 1.18 -0.13 -0.33 0.00 0.22 0.00 0.00 39.33 40.26 3mbh h ASP 140 CO 0.72 1.44 -0.78 -0.69 -1.72 0.00 0.00 179.24 178.20 3mbh s VAL 141 N -2.62 0.72 0.09 -1.35 1.01 -0.89 -1.22 120.40 116.14 3mbh s VAL 141 Ca -0.08 -0.25 0.06 0.00 0.00 0.00 0.00 61.98 61.71 3mbh s VAL 141 Cb 0.07 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.72 3mbh s VAL 141 CO 0.86 0.26 -0.16 0.27 0.00 0.00 0.00 175.10 176.33 3mbh s ILE 142 N 0.70 1.31 -0.35 2.22 -4.36 -0.64 -1.17 121.20 118.91 3mbh s ILE 142 Ca -0.11 -1.47 0.15 0.00 -0.26 0.00 0.00 60.65 58.96 3mbh s ILE 142 Cb -0.14 -1.31 0.44 0.00 1.25 0.00 0.00 42.46 42.70 3mbh s ILE 142 CO 0.01 -0.24 0.95 0.35 0.24 0.00 0.00 174.94 176.26 3mbh n THR 143 N 1.03 1.14 -1.69 8.37 -2.24 -1.18 -0.89 114.28 118.82 3mbh n THR 143 Ca -0.19 -3.62 -0.43 0.00 -2.27 0.00 0.00 64.05 57.55 3mbh n THR 143 Cb 0.55 0.18 -0.01 0.00 -2.10 0.00 0.00 70.33 68.95 3mbh n THR 143 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 3mbh n PRO 144 N -0.09 2.09 -1.63 -0.78 -0.04 -1.10 -4.67 135.00 128.78 3mbh n PRO 144 Ca 0.16 0.73 -0.29 0.00 -0.04 0.00 0.00 63.50 64.06 3mbh n PRO 144 Cb 0.76 -2.30 0.17 0.00 -0.04 0.00 0.00 33.50 32.09 3mbh n PRO 144 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3mbh s ASN 145 N -0.31 2.91 0.33 3.54 2.20 -1.26 -1.20 114.94 121.14 3mbh s ASN 145 Ca 0.56 0.61 0.02 0.00 -0.94 0.00 0.00 52.86 53.10 3mbh s ASN 145 Cb -0.58 -0.90 0.56 0.00 -2.00 0.00 0.00 41.25 38.34 3mbh s ASN 145 CO 0.62 -2.89 1.94 0.25 -2.94 0.00 0.00 177.10 174.08 3mbh h LEU 146 N -1.74 0.71 -0.55 3.54 5.85 -1.55 -0.56 115.31 121.00 3mbh h LEU 146 Ca -0.46 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.19 3mbh h LEU 146 Cb 1.29 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 3mbh h LEU 146 CO 0.47 0.60 0.33 0.74 -0.34 0.00 0.00 178.44 180.24 3mbh h THR 147 N 0.79 1.17 -0.33 1.05 2.02 -1.88 -2.75 112.91 112.99 3mbh h THR 147 Ca 0.20 -0.40 -0.10 0.00 0.77 0.00 0.00 66.41 66.88 3mbh h THR 147 Cb 0.07 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 66.90 3mbh h THR 147 CO -0.03 0.18 -0.23 -0.33 0.37 0.00 0.00 175.52 175.48 3mbh h GLU 148 N 0.74 0.64 -0.47 6.66 5.08 -1.59 -2.35 114.58 123.29 3mbh h GLU 148 Ca 0.20 -0.25 0.06 0.00 -1.00 0.00 0.00 59.36 58.37 3mbh h GLU 148 Cb 0.00 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.17 3mbh h GLU 148 CO -0.04 0.82 0.18 1.25 -1.00 0.00 0.00 179.01 180.23 3mbh h LEU 149 N 0.56 0.21 0.15 1.33 5.85 -0.84 0.45 115.31 123.02 3mbh h LEU 149 Ca 0.08 0.05 -0.29 0.00 0.84 0.00 0.00 57.88 58.56 3mbh h LEU 149 Cb 0.70 0.02 0.02 0.00 0.37 0.00 0.00 40.66 41.76 3mbh h LEU 149 CO 0.05 0.15 -1.30 -0.26 -0.34 0.00 0.00 178.44 176.75 3mbh h PHE 150 N 0.37 0.66 -0.66 1.25 0.04 -1.33 -0.94 116.94 116.33 3mbh h PHE 150 Ca 0.22 -0.47 0.06 0.00 2.80 0.00 0.00 57.97 60.58 3mbh h PHE 150 Cb 0.20 -0.03 -0.06 0.00 2.20 0.00 0.00 35.95 38.27 3mbh h PHE 150 CO -0.14 1.36 0.36 1.88 -0.60 0.00 0.00 178.31 181.17 3mbh h TYR 151 N 0.11 0.66 -0.48 -0.55 0.05 -1.17 0.63 116.97 116.22 3mbh h TYR 151 Ca -0.17 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.62 3mbh h TYR 151 Cb 2.01 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 39.53 3mbh h TYR 151 CO 0.08 0.31 0.22 -0.07 -1.05 0.00 0.00 178.16 177.65 3mbh h LEU 152 N 0.66 0.65 -0.15 3.88 3.38 0.12 -2.60 115.31 121.24 3mbh h LEU 152 Ca 0.30 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.13 3mbh h LEU 152 Cb 0.21 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.79 3mbh h LEU 152 CO -0.19 0.61 0.00 0.18 0.09 0.00 0.00 178.44 179.13 3mbh n LEU 153 N -4.60 0.24 -3.59 1.67 4.77 -0.38 -4.91 117.00 110.20 3mbh n LEU 153 Ca 0.02 -0.09 -0.24 0.00 -0.03 0.00 0.00 56.01 55.67 3mbh n LEU 153 Cb 0.13 -0.01 0.05 0.00 -2.33 0.00 0.00 43.42 41.26 3mbh n LEU 153 CO 0.37 0.04 -0.05 -0.67 -1.33 0.00 0.00 177.39 175.76 3mbh n ASP 154 N -0.74 -3.93 -4.26 -1.43 2.03 -0.51 -5.02 116.55 102.70 3mbh n ASP 154 Ca 0.20 -0.87 -0.14 0.00 0.52 0.00 0.00 54.79 54.50 3mbh n ASP 154 Cb 0.13 -4.07 -0.10 0.00 -0.72 0.00 0.00 41.12 36.35 3mbh n ASP 154 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3mbh s GLU 155 N -5.61 1.12 0.45 -0.67 0.41 0.10 -5.04 118.70 109.45 3mbh s GLU 155 Ca 0.28 -1.52 -0.22 0.00 -0.41 0.00 0.00 54.97 53.11 3mbh s GLU 155 Cb -0.08 -0.47 -0.08 0.00 -1.78 0.00 0.00 34.13 31.72 3mbh s GLU 155 CO 0.81 -0.03 1.06 -2.14 -0.49 0.00 0.00 175.26 174.47 3mbh s PRO 156 N -3.83 3.91 0.18 0.39 0.02 -1.26 -4.22 135.00 130.19 3mbh s PRO 156 Ca 0.21 1.47 -0.33 0.00 0.02 0.00 0.00 61.00 62.37 3mbh s PRO 156 Cb 0.05 -2.29 -0.14 0.00 0.02 0.00 0.00 34.50 32.14 3mbh s PRO 156 CO 0.03 -0.35 1.52 0.98 -0.33 0.00 0.00 177.00 178.85 3mbh n TYR 157 N -0.59 2.23 -3.77 6.54 9.36 -1.26 -4.94 117.16 124.71 3mbh n TYR 157 Ca 0.08 0.33 -0.22 0.00 3.32 0.00 0.00 57.90 61.40 3mbh n TYR 157 Cb 0.51 -2.51 -0.18 0.00 -0.63 0.00 0.00 39.34 36.53 3mbh n TYR 157 CO 0.00 0.00 0.00 -1.59 0.22 0.00 0.00 176.86 175.49 3mbh s LYS 158 N 0.50 0.50 0.33 2.98 -2.85 -1.26 -5.05 119.74 114.89 3mbh s LYS 158 Ca 0.76 0.14 0.17 0.00 -1.00 0.00 0.00 55.97 56.04 3mbh s LYS 158 Cb -0.68 -0.88 0.47 0.00 -2.06 0.00 0.00 37.83 34.68 3mbh s LYS 158 CO 0.42 -0.30 1.63 0.00 0.10 0.00 0.00 175.35 177.20 3mbh h ALA 159 N 8.28 0.87 -3.30 0.59 0.00 -2.00 -3.40 119.26 120.30 3mbh h ALA 159 Ca -0.20 -0.40 -0.63 0.00 0.00 0.00 0.00 54.91 53.67 3mbh h ALA 159 Cb 1.12 -0.07 -0.41 0.00 0.00 0.00 0.00 17.79 18.43 3mbh h ALA 159 CO 0.26 0.56 -0.63 0.16 0.00 0.00 0.00 179.25 179.60 3mbh s ASP 160 N -6.46 4.36 0.03 0.00 1.47 -1.26 -4.48 116.67 110.33 3mbh s ASP 160 Ca 0.01 -3.16 0.02 0.00 1.18 0.00 0.00 52.55 50.60 3mbh s ASP 160 Cb 0.10 -1.60 -0.04 0.00 -0.34 0.00 0.00 42.92 41.04 3mbh s ASP 160 CO 0.71 -0.20 0.04 -0.44 0.68 0.00 0.00 175.17 175.96 3mbh s SER 161 N -0.49 5.34 0.79 2.11 0.01 -1.26 -5.13 113.70 115.07 3mbh s SER 161 Ca 0.19 0.00 -0.11 0.00 1.31 0.00 0.00 55.95 57.34 3mbh s SER 161 Cb -0.22 -1.42 0.07 0.00 0.21 0.00 0.00 66.02 64.66 3mbh s SER 161 CO -0.03 0.23 1.10 0.42 0.41 0.00 0.00 173.24 175.37 3mbh s THR 162 N -1.22 3.12 0.30 1.44 -4.23 -1.26 -4.84 115.64 108.95 3mbh s THR 162 Ca 0.24 0.37 -0.01 0.00 -1.18 0.00 0.00 61.69 61.10 3mbh s THR 162 Cb -0.12 -2.79 0.25 0.00 1.34 0.00 0.00 72.50 71.18 3mbh s THR 162 CO 0.15 -0.47 1.95 0.44 -0.54 0.00 0.00 174.62 176.16 3mbh h ASP 163 N -1.19 0.90 -0.64 3.99 5.19 -2.00 0.73 116.42 123.40 3mbh h ASP 163 Ca -0.44 -0.04 -0.07 0.00 -0.62 0.00 0.00 57.03 55.86 3mbh h ASP 163 Cb 1.24 -0.23 -0.03 0.00 0.18 0.00 0.00 39.33 40.50 3mbh h ASP 163 CO 0.50 0.68 0.12 -0.33 -3.12 0.00 0.00 179.24 177.09 3mbh h GLU 164 N 1.04 1.07 -0.50 3.56 4.39 -1.99 0.36 114.58 122.50 3mbh h GLU 164 Ca 0.27 -0.27 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 3mbh h GLU 164 Cb -0.06 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.43 3mbh h GLU 164 CO -0.05 0.97 0.24 0.93 -1.16 0.00 0.00 179.01 179.94 3mbh h GLU 165 N 1.00 0.73 -0.88 2.33 5.08 -1.70 -1.10 114.58 120.04 3mbh h GLU 165 Ca 0.20 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.43 3mbh h GLU 165 Cb 0.42 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 3mbh h GLU 165 CO 0.01 0.61 0.48 -0.07 -1.00 0.00 0.00 179.01 179.05 3mbh h LEU 166 N 0.67 1.10 -0.71 1.33 3.38 -0.56 0.29 115.31 120.80 3mbh h LEU 166 Ca 0.17 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 3mbh h LEU 166 Cb 0.13 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3mbh h LEU 166 CO -0.02 0.88 0.20 0.11 0.09 0.00 0.00 178.44 179.70 3mbh h LYS 167 N 1.23 1.12 -0.35 1.13 1.57 -0.61 -1.37 116.57 119.30 3mbh h LYS 167 Ca 0.31 -0.26 0.05 0.00 -1.87 0.00 0.00 60.65 58.88 3mbh h LYS 167 Cb 0.03 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.14 3mbh h LYS 167 CO -0.05 0.98 0.09 0.93 -0.57 0.00 0.00 179.45 180.83 3mbh h GLU 168 N 1.06 0.22 -0.59 3.15 4.39 -0.60 -1.55 114.58 120.66 3mbh h GLU 168 Ca 0.23 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.90 3mbh h GLU 168 Cb 0.34 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.91 3mbh h GLU 168 CO -0.00 0.15 0.30 1.88 -1.16 0.00 0.00 179.01 180.18 3mbh h TYR 169 N 0.23 0.81 -0.57 4.33 0.05 -0.49 -0.03 116.97 121.30 3mbh h TYR 169 Ca 0.16 -0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.84 3mbh h TYR 169 Cb 0.16 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.62 3mbh h TYR 169 CO -0.16 0.58 0.03 -0.07 -1.05 0.00 0.00 178.16 177.49 3mbh h LEU 170 N 0.83 0.95 -0.16 3.88 3.38 -0.87 -1.86 115.31 121.46 3mbh h LEU 170 Ca 0.21 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 3mbh h LEU 170 Cb 0.06 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.55 3mbh h LEU 170 CO -0.03 1.01 -0.07 0.03 0.09 0.00 0.00 178.44 179.47 3mbh h ARG 171 N 0.87 0.33 -0.68 1.13 3.08 -0.75 -1.60 114.38 116.76 3mbh h ARG 171 Ca 0.16 -0.14 0.13 0.00 0.07 0.00 0.00 59.98 60.20 3mbh h ARG 171 Cb 0.50 -0.01 -0.09 0.00 0.08 0.00 0.00 29.97 30.45 3mbh h ARG 171 CO 0.02 0.64 0.23 -0.07 -1.07 0.00 0.00 179.97 179.72 3mbh h LEU 172 N 0.01 0.17 -0.72 3.04 3.38 -0.88 -0.51 115.31 119.80 3mbh h LEU 172 Ca 0.04 0.11 -0.13 0.00 0.09 0.00 0.00 57.88 57.99 3mbh h LEU 172 Cb 0.54 0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 3mbh h LEU 172 CO 0.02 0.07 -0.37 -0.07 0.09 0.00 0.00 178.44 178.19 3mbh h LEU 173 N 0.37 0.59 -1.29 1.67 3.38 -1.25 -3.02 115.31 115.76 3mbh h LEU 173 Ca 0.37 -0.25 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 3mbh h LEU 173 Cb 0.54 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 3mbh h LEU 173 CO -0.39 0.90 -0.35 -1.28 0.09 0.00 0.00 178.44 177.40 3mbh h SER 174 N 0.47 0.00 0.51 -0.43 0.87 -0.12 -1.53 113.55 113.32 3mbh h SER 174 Ca 0.05 0.00 -0.03 0.00 -1.23 0.00 0.00 61.79 60.57 3mbh h SER 174 Cb 0.85 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.81 3mbh h SER 174 CO 0.07 0.35 -0.16 0.44 -0.53 0.00 0.00 176.83 177.01 3mbh h ASP 175 N 0.00 0.00 0.56 6.23 3.32 -1.05 -1.39 116.42 124.09 3mbh h ASP 175 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3mbh h ASP 175 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 3mbh h ASP 175 CO 0.05 0.16 0.00 0.29 -1.72 0.00 0.00 179.24 178.02 3mbh n LYS 176 N -3.59 0.03 0.00 3.56 4.76 -0.58 -4.90 118.16 117.45 3mbh n LYS 176 Ca -0.01 0.19 0.00 0.00 -2.87 0.00 0.00 58.31 55.62 3mbh n LYS 176 Cb 0.30 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.99 3mbh n LYS 176 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3mbh n GLY 177 N 0.28 3.13 3.76 0.72 0.00 -0.53 -4.24 105.19 108.31 3mbh n GLY 177 Ca 0.05 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 3mbh n GLY 177 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3mbh s PRO 178 N 0.00 4.17 0.14 1.61 0.02 -1.21 -4.92 135.00 134.81 3mbh s PRO 178 Ca 0.00 2.48 -0.06 0.00 0.02 0.00 0.00 61.00 63.44 3mbh s PRO 178 Cb 0.00 -3.04 -0.05 0.00 0.02 0.00 0.00 34.50 31.43 3mbh s PRO 178 CO 0.00 -0.53 1.36 0.37 -0.33 0.00 0.00 177.00 177.87 3mbh h GLN 179 N 4.46 0.55 -5.13 5.54 4.15 -1.65 -3.39 115.11 119.65 3mbh h GLN 179 Ca -0.48 -0.47 -0.66 0.00 0.77 0.00 0.00 58.65 57.81 3mbh h GLN 179 Cb 1.22 0.11 -0.29 0.00 0.21 0.00 0.00 27.48 28.72 3mbh h GLN 179 CO 0.75 1.10 -0.78 0.08 -1.93 0.00 0.00 178.83 178.06 3mbh s VAL 180 N -3.60 2.89 -0.08 2.39 1.01 -0.35 -0.64 120.40 122.01 3mbh s VAL 180 Ca -0.07 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 61.26 3mbh s VAL 180 Cb 0.09 -2.26 0.00 0.00 0.00 0.00 0.00 36.38 34.22 3mbh s VAL 180 CO 0.87 0.49 -0.20 -0.69 0.00 0.00 0.00 175.10 175.57 3mbh s VAL 181 N 1.03 1.71 -0.09 2.92 1.01 -0.87 -1.62 120.40 124.50 3mbh s VAL 181 Ca -0.01 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.16 3mbh s VAL 181 Cb -0.15 -1.50 0.02 0.00 0.00 0.00 0.00 36.38 34.75 3mbh s VAL 181 CO -0.02 0.48 -0.12 -0.63 0.00 0.00 0.00 175.10 174.81 3mbh s ILE 182 N 0.41 1.23 -0.21 2.22 1.01 -0.06 -1.16 121.20 124.64 3mbh s ILE 182 Ca -0.16 -0.49 -0.05 0.00 0.00 0.00 0.00 60.65 59.96 3mbh s ILE 182 Cb -0.17 -1.15 -0.02 0.00 0.01 0.00 0.00 42.46 41.13 3mbh s ILE 182 CO 0.07 0.39 -0.01 -0.63 0.00 0.00 0.00 174.94 174.75 3mbh s ILE 183 N 1.04 3.74 0.45 2.92 1.01 0.49 -2.71 121.20 128.15 3mbh s ILE 183 Ca -0.07 -0.38 0.08 0.00 0.00 0.00 0.00 60.65 60.28 3mbh s ILE 183 Cb -0.15 -2.70 0.01 0.00 0.01 0.00 0.00 42.46 39.63 3mbh s ILE 183 CO -0.01 0.42 0.49 0.42 0.00 0.00 0.00 174.94 176.25 3mbh s THR 184 N 1.23 2.58 -1.42 2.92 -4.23 -0.34 -1.35 115.64 115.02 3mbh s THR 184 Ca 0.03 -1.22 -0.11 0.00 -1.18 0.00 0.00 61.69 59.22 3mbh s THR 184 Cb -0.15 -2.80 0.04 0.00 1.34 0.00 0.00 72.50 70.94 3mbh s THR 184 CO 0.00 0.00 1.10 -1.20 -0.54 0.00 0.00 174.62 173.99 3mbh n SER 185 N -1.75 -5.66 -4.67 3.99 7.64 -1.18 -1.73 113.62 110.27 3mbh n SER 185 Ca 0.06 -0.63 -0.39 0.00 1.01 0.00 0.00 58.87 58.91 3mbh n SER 185 Cb 0.61 -4.60 -0.06 0.00 -1.01 0.00 0.00 64.21 59.15 3mbh n SER 185 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3mbh s VAL 186 N -3.32 5.09 0.65 0.44 1.01 -0.57 -4.43 120.40 119.27 3mbh s VAL 186 Ca 0.60 1.03 -0.17 0.00 0.00 0.00 0.00 61.98 63.44 3mbh s VAL 186 Cb -0.28 -3.87 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 3mbh s VAL 186 CO 0.77 0.18 1.00 -2.65 0.00 0.00 0.00 175.10 174.39 3mbh n PRO 187 N 4.70 0.77 -3.71 2.72 -0.02 -1.26 -0.31 135.00 137.89 3mbh n PRO 187 Ca -0.04 0.31 -0.38 0.00 -2.02 0.00 0.00 63.50 61.37 3mbh n PRO 187 Cb 0.50 -2.23 -0.12 0.00 -0.02 0.00 0.00 33.50 31.63 3mbh n PRO 187 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3mbh s VAL 188 N -1.61 4.06 -0.14 -1.45 1.01 -1.25 -4.71 120.40 116.32 3mbh s VAL 188 Ca 0.76 -0.92 -0.40 0.00 0.00 0.00 0.00 61.98 61.43 3mbh s VAL 188 Cb -0.38 -3.23 -0.17 0.00 0.00 0.00 0.00 36.38 32.60 3mbh s VAL 188 CO 0.47 -0.11 1.46 1.57 0.00 0.00 0.00 175.10 178.49 3mbh n HIS 189 N 4.88 1.56 -3.31 5.22 -0.00 -1.26 -0.52 115.22 121.79 3mbh n HIS 189 Ca -0.13 0.76 -0.23 0.00 0.46 0.00 0.00 57.72 58.58 3mbh n HIS 189 Cb 0.46 -2.31 0.01 0.00 -0.12 0.00 0.00 29.99 28.03 3mbh n HIS 189 CO 0.00 0.00 0.00 -0.25 0.46 0.00 0.00 176.34 176.55 3mbh n ASP 190 N 3.46 -4.28 -3.34 0.26 9.92 -1.26 -4.93 116.55 116.38 3mbh n ASP 190 Ca 0.23 -0.39 -0.20 0.00 -0.53 0.00 0.00 54.79 53.91 3mbh n ASP 190 Cb 0.11 -3.51 -0.08 0.00 -0.64 0.00 0.00 41.12 37.00 3mbh n ASP 190 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 3mbh s GLU 191 N -5.97 0.71 0.00 -1.24 2.02 0.32 -5.03 118.70 109.51 3mbh s GLU 191 Ca 0.39 -1.17 0.28 0.00 0.02 0.00 0.00 54.97 54.49 3mbh s GLU 191 Cb -0.20 -0.88 1.44 0.00 0.10 0.00 0.00 34.13 34.59 3mbh s GLU 191 CO 0.48 -1.24 1.96 -0.35 0.02 0.00 0.00 175.26 176.13 3mbh n PRO 192 N 3.86 0.49 -0.21 0.39 -0.04 -1.26 -2.71 135.00 135.52 3mbh n PRO 192 Ca 0.15 0.02 0.12 0.00 -0.04 0.00 0.00 63.50 63.75 3mbh n PRO 192 Cb 0.45 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.66 3mbh n PRO 192 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 3mbh n HIS 193 N -1.23 0.55 -4.39 0.54 1.44 -1.26 -4.98 115.22 105.89 3mbh n HIS 193 Ca 0.15 -0.27 -0.20 0.00 -2.01 0.00 0.00 57.72 55.39 3mbh n HIS 193 Cb 0.19 0.00 -0.10 0.00 0.12 0.00 0.00 29.99 30.20 3mbh n HIS 193 CO 0.00 0.00 0.00 0.15 -2.81 0.00 0.00 176.34 173.68 3mbh s LYS 194 N -1.45 1.44 0.14 -1.40 1.02 -1.10 -3.58 119.74 114.82 3mbh s LYS 194 Ca 0.39 -1.70 0.02 0.00 0.02 0.00 0.00 55.97 54.70 3mbh s LYS 194 Cb 0.22 -1.08 -0.04 0.00 -0.52 0.00 0.00 37.83 36.41 3mbh s LYS 194 CO 0.31 0.07 -0.03 -0.08 -0.92 0.00 0.00 175.35 174.71 3mbh s THR 195 N -3.05 0.68 0.08 2.17 -1.32 0.32 -3.87 115.64 110.65 3mbh s THR 195 Ca 0.27 -1.96 -0.02 0.00 -1.21 0.00 0.00 61.69 58.76 3mbh s THR 195 Cb 0.02 -1.94 -0.03 0.00 -1.51 0.00 0.00 72.50 69.04 3mbh s THR 195 CO 0.10 -0.63 0.02 -0.94 -2.21 0.00 0.00 174.62 170.96 3mbh s SER 196 N -3.12 0.39 -0.05 8.08 1.04 0.57 -0.28 113.70 120.35 3mbh s SER 196 Ca 0.19 -1.00 0.05 0.00 0.48 0.00 0.00 55.95 55.67 3mbh s SER 196 Cb 0.06 0.24 -0.00 0.00 0.10 0.00 0.00 66.02 66.42 3mbh s SER 196 CO 0.00 -0.65 -0.18 -0.69 0.98 0.00 0.00 173.24 172.70 3mbh s VAL 197 N -3.94 1.52 0.00 5.02 1.01 -0.19 -1.51 120.40 122.31 3mbh s VAL 197 Ca 0.11 -0.77 0.08 0.00 0.00 0.00 0.00 61.98 61.40 3mbh s VAL 197 Cb 0.07 -1.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.12 3mbh s VAL 197 CO -0.07 0.44 -0.24 -0.31 0.00 0.00 0.00 175.10 174.91 3mbh s TYR 198 N 0.02 2.38 0.03 5.22 1.51 -0.45 -0.80 117.35 125.25 3mbh s TYR 198 Ca -0.04 -0.39 -0.02 0.00 -1.01 0.00 0.00 57.07 55.61 3mbh s TYR 198 Cb -0.12 -1.47 -0.02 0.00 -0.11 0.00 0.00 41.96 40.24 3mbh s TYR 198 CO 0.02 0.06 0.01 0.00 -1.11 0.00 0.00 175.55 174.53 3mbh s ALA 199 N -0.71 0.14 -0.02 3.71 0.00 0.12 -0.38 121.76 124.61 3mbh s ALA 199 Ca 0.11 -0.69 0.01 0.00 0.00 0.00 0.00 51.96 51.39 3mbh s ALA 199 Cb -0.10 0.19 0.01 0.00 0.00 0.00 0.00 23.12 23.22 3mbh s ALA 199 CO 0.01 -0.24 -0.05 -0.47 0.00 0.00 0.00 175.76 175.01 3mbh s TYR 200 N -2.23 0.59 -0.23 0.00 5.04 -0.31 -0.13 117.35 120.08 3mbh s TYR 200 Ca -0.09 -0.13 -0.01 0.00 -2.44 0.00 0.00 57.07 54.40 3mbh s TYR 200 Cb -0.04 -0.49 0.02 0.00 0.35 0.00 0.00 41.96 41.80 3mbh s TYR 200 CO -0.04 -0.10 -0.08 1.21 -1.34 0.00 0.00 175.55 175.20 3mbh s ASN 201 N 0.46 4.14 0.40 4.32 3.84 0.83 -2.05 114.94 126.88 3mbh s ASN 201 Ca -0.06 -0.77 0.17 0.00 0.21 0.00 0.00 52.86 52.41 3mbh s ASN 201 Cb -0.09 -1.65 0.84 0.00 -0.55 0.00 0.00 41.25 39.80 3mbh s ASN 201 CO -0.00 -0.09 1.85 -0.09 -2.79 0.00 0.00 177.10 175.97 3mbh h ARG 202 N 8.01 0.00 -6.43 0.43 2.43 -1.17 -0.64 114.38 117.01 3mbh h ARG 202 Ca -0.36 0.00 -0.57 0.00 -0.81 0.00 0.00 59.98 58.24 3mbh h ARG 202 Cb 1.12 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.62 3mbh h ARG 202 CO 0.59 0.33 1.11 -1.14 -1.51 0.00 0.00 179.97 179.34 3mbh s GLN 203 N -4.07 3.59 0.00 0.20 2.00 -1.26 -2.33 119.66 117.79 3mbh s GLN 203 Ca -0.02 1.15 0.00 0.00 -2.00 0.00 0.00 55.36 54.48 3mbh s GLN 203 Cb 0.13 -4.04 0.00 0.00 0.80 0.00 0.00 33.01 29.90 3mbh s GLN 203 CO 0.69 -1.54 0.00 0.41 -0.50 0.00 0.00 175.29 174.35 3mbh n GLY 204 N 5.01 1.75 3.70 2.59 0.00 -1.26 -4.51 105.19 112.48 3mbh n GLY 204 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 3mbh n GLY 204 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3mbh n ASN 205 N 0.00 -2.11 -4.55 1.61 5.15 -0.65 -4.96 115.26 109.76 3mbh n ASN 205 Ca 0.00 -0.87 -0.32 0.00 -0.60 0.00 0.00 54.58 52.78 3mbh n ASN 205 Cb 0.00 -3.87 -0.11 0.00 -0.53 0.00 0.00 39.78 35.27 3mbh n ASN 205 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3mbh s ARG 206 N -5.95 2.51 -0.05 1.20 0.52 -0.34 -4.95 118.95 111.88 3mbh s ARG 206 Ca 0.11 -0.72 0.06 0.00 -0.52 0.00 0.00 55.73 54.66 3mbh s ARG 206 Cb -0.03 -2.45 -0.01 0.00 0.52 0.00 0.00 34.95 32.98 3mbh s ARG 206 CO 0.83 0.61 -0.24 0.71 0.02 0.00 0.00 175.30 177.23 3mbh s TYR 207 N -0.90 2.44 0.18 -0.53 1.51 -1.26 -0.12 117.35 118.67 3mbh s TYR 207 Ca 0.15 -0.59 0.07 0.00 -1.01 0.00 0.00 57.07 55.69 3mbh s TYR 207 Cb -0.11 -1.58 -0.04 0.00 -0.11 0.00 0.00 41.96 40.12 3mbh s TYR 207 CO 0.05 -0.13 -0.14 -1.58 -1.11 0.00 0.00 175.55 172.64 3mbh s TRP 208 N -0.32 1.60 -0.02 2.71 0.52 0.81 -1.29 118.94 122.95 3mbh s TRP 208 Ca 0.01 -0.60 -0.05 0.00 0.02 0.00 0.00 56.10 55.48 3mbh s TRP 208 Cb -0.12 -0.77 0.00 0.00 -1.15 0.00 0.00 33.47 31.43 3mbh s TRP 208 CO 0.02 0.28 0.11 0.21 0.02 0.00 0.00 176.95 177.59 3mbh s LYS 209 N -3.48 0.31 -0.02 4.98 2.20 -0.28 -0.71 119.74 122.73 3mbh s LYS 209 Ca 0.19 -0.15 0.02 0.00 -0.36 0.00 0.00 55.97 55.67 3mbh s LYS 209 Cb -0.01 0.13 0.01 0.00 -1.51 0.00 0.00 37.83 36.45 3mbh s LYS 209 CO 0.05 -0.06 -0.06 0.08 -0.36 0.00 0.00 175.35 175.00 3mbh s VAL 210 N -0.71 0.54 -0.18 4.02 1.01 0.02 -1.40 120.40 123.69 3mbh s VAL 210 Ca -0.08 -0.21 -0.08 0.00 0.00 0.00 0.00 61.98 61.61 3mbh s VAL 210 Cb -0.05 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.78 3mbh s VAL 210 CO 0.01 0.19 0.08 -0.89 0.00 0.00 0.00 175.10 174.48 3mbh s THR 211 N 0.38 4.92 -0.03 3.92 2.01 -1.26 -1.03 115.64 124.55 3mbh s THR 211 Ca -0.05 0.01 0.06 0.00 0.31 0.00 0.00 61.69 62.03 3mbh s THR 211 Cb -0.09 -3.22 -0.01 0.00 0.01 0.00 0.00 72.50 69.19 3mbh s THR 211 CO 0.00 0.46 -0.21 0.00 -0.69 0.00 0.00 174.62 174.18 3mbh n PRO 213 N 2.76 3.81 -3.68 0.00 -0.04 -1.26 -0.52 135.00 136.07 3mbh n PRO 213 Ca -0.16 -3.80 -0.09 0.00 -0.04 0.00 0.00 63.50 59.40 3mbh n PRO 213 Cb 0.52 -2.83 -0.03 0.00 -0.04 0.00 0.00 33.50 31.13 3mbh n PRO 213 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 3mbh s TYR 214 N -0.32 -0.28 -0.47 0.54 -0.85 -1.23 -4.95 117.35 109.78 3mbh s TYR 214 Ca 0.38 -0.06 0.03 0.00 -0.52 0.00 0.00 57.07 56.89 3mbh s TYR 214 Cb 0.08 0.57 0.12 0.00 0.38 0.00 0.00 41.96 43.11 3mbh s TYR 214 CO 0.03 -1.02 0.21 -0.51 -1.52 0.00 0.00 175.55 172.74 3mbh s LEU 215 N -2.85 4.65 0.52 -3.49 1.43 -1.26 -3.26 118.68 114.41 3mbh s LEU 215 Ca 0.07 -2.65 0.18 0.00 -1.03 0.00 0.00 54.13 50.70 3mbh s LEU 215 Cb -0.03 -1.68 1.30 0.00 0.03 0.00 0.00 46.19 45.81 3mbh s LEU 215 CO -0.02 -0.32 2.14 1.55 0.23 0.00 0.00 176.35 179.93 3mbh h PRO 216 N 7.03 0.00 0.00 1.29 0.13 -1.98 -2.11 132.00 136.36 3mbh h PRO 216 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 3mbh h PRO 216 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 3mbh h PRO 216 CO 0.64 0.03 0.00 0.00 -0.23 0.00 0.00 178.00 178.44 3mbh n ALA 217 N -2.51 1.54 0.35 -0.56 0.00 -1.26 -0.61 120.51 117.47 3mbh n ALA 217 Ca -0.03 0.08 0.14 0.00 0.00 0.00 0.00 53.44 53.63 3mbh n ALA 217 Cb 0.11 -1.34 0.57 0.00 0.00 0.00 0.00 19.45 18.79 3mbh n ALA 217 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3mbh h HIS 218 N 0.00 0.00 -3.44 0.00 3.86 -1.80 -3.41 115.15 110.36 3mbh h HIS 218 Ca 0.00 0.00 -0.62 0.00 -1.16 0.00 0.00 60.37 58.59 3mbh h HIS 218 Cb 0.28 0.00 -0.40 0.00 1.06 0.00 0.00 27.41 28.35 3mbh h HIS 218 CO 0.00 0.00 -0.74 0.71 0.86 0.00 0.00 177.93 178.76 3mbh s TYR 219 N -3.46 2.76 0.39 2.45 2.02 0.22 -4.61 117.35 117.13 3mbh s TYR 219 Ca 0.03 -2.37 -0.25 0.00 -0.37 0.00 0.00 57.07 54.11 3mbh s TYR 219 Cb 0.09 -2.31 -0.11 0.00 -0.40 0.00 0.00 41.96 39.23 3mbh s TYR 219 CO 0.48 -0.91 1.01 -2.30 -1.57 0.00 0.00 175.55 172.26 3mbh n PRO 220 N 4.54 1.37 -0.58 -1.71 -0.02 -1.26 -2.55 135.00 134.79 3mbh n PRO 220 Ca 0.01 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 3mbh n PRO 220 Cb 0.42 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 3mbh n PRO 220 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3mbh n GLY 221 N 1.19 0.79 0.18 -1.23 0.00 -1.26 -4.58 105.19 100.27 3mbh n GLY 221 Ca 0.09 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.12 3mbh n GLY 221 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3mbh h THR 222 N 0.00 1.32 -0.86 2.61 1.35 -1.77 -0.98 112.91 114.58 3mbh h THR 222 Ca 0.00 -1.53 0.05 0.00 -0.55 0.00 0.00 66.41 64.39 3mbh h THR 222 Cb 0.00 1.80 -0.05 0.00 -1.73 0.00 0.00 68.15 68.17 3mbh h THR 222 CO 0.00 0.44 0.56 1.23 -0.25 0.00 0.00 175.52 177.50 3mbh h GLY 223 N 1.32 1.22 1.08 5.82 0.00 -1.92 0.17 103.07 110.76 3mbh h GLY 223 Ca -0.00 -0.40 -0.13 0.00 0.00 0.00 0.00 47.33 46.80 3mbh h GLY 223 CO 0.06 0.31 -0.26 -0.55 0.00 0.00 0.00 176.54 176.10 3mbh h ASP 224 N 0.99 0.96 -0.14 0.19 3.32 -1.59 -0.61 116.42 119.53 3mbh h ASP 224 Ca 0.36 -0.42 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 3mbh h ASP 224 Cb 0.15 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.43 3mbh h ASP 224 CO -0.12 1.17 0.06 0.74 -1.72 0.00 0.00 179.24 179.36 3mbh h THR 225 N 0.74 1.16 -0.23 0.35 2.02 -1.05 -0.48 112.91 115.42 3mbh h THR 225 Ca 0.09 -0.47 0.05 0.00 0.77 0.00 0.00 66.41 66.84 3mbh h THR 225 Cb 0.84 1.20 -0.04 0.00 -1.74 0.00 0.00 68.15 68.41 3mbh h THR 225 CO 0.07 0.14 -0.05 0.15 0.37 0.00 0.00 175.52 176.21 3mbh h PHE 226 N 0.07 -0.11 -0.01 3.16 3.57 -0.54 -1.78 116.94 121.31 3mbh h PHE 226 Ca 0.05 0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.39 3mbh h PHE 226 Cb 0.18 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 3mbh h PHE 226 CO -0.01 -0.09 -0.81 1.15 -2.23 0.00 0.00 178.31 176.31 3mbh h THR 227 N 0.01 1.49 -0.47 4.41 2.02 -1.01 -0.73 112.91 118.63 3mbh h THR 227 Ca 0.11 -2.53 0.00 0.00 0.77 0.00 0.00 66.41 64.76 3mbh h THR 227 Cb 0.17 2.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.94 3mbh h THR 227 CO -0.23 0.74 0.31 0.28 0.37 0.00 0.00 175.52 176.98 3mbh h SER 228 N 0.09 0.54 -0.25 4.18 0.02 -0.82 -0.44 113.55 116.87 3mbh h SER 228 Ca -0.03 -0.02 -0.18 0.00 -0.84 0.00 0.00 61.79 60.72 3mbh h SER 228 Cb 1.42 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.82 3mbh h SER 228 CO 0.12 0.39 -0.53 0.58 -1.14 0.00 0.00 176.83 176.25 3mbh h VAL 229 N 0.63 1.28 -0.12 2.27 2.07 -0.85 -2.21 116.25 119.32 3mbh h VAL 229 Ca 0.17 -1.73 0.02 0.00 0.82 0.00 0.00 66.70 65.99 3mbh h VAL 229 Cb -0.07 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.30 3mbh h VAL 229 CO -0.04 0.56 -0.02 0.40 0.02 0.00 0.00 177.57 178.49 3mbh h ILE 230 N 0.65 0.89 0.14 4.57 1.08 -0.99 -0.41 117.51 123.44 3mbh h ILE 230 Ca 0.02 -0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.50 3mbh h ILE 230 Cb 1.13 0.88 -0.03 0.00 -3.07 0.00 0.00 36.82 35.73 3mbh h ILE 230 CO 0.12 0.00 -0.28 0.74 -0.69 0.00 0.00 178.15 178.04 3mbh h THR 231 N 0.01 0.40 -0.74 -0.27 2.02 -0.95 -0.12 112.91 113.27 3mbh h THR 231 Ca 0.06 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.19 3mbh h THR 231 Cb 0.08 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 66.86 3mbh h THR 231 CO -0.12 0.00 0.29 1.23 0.37 0.00 0.00 175.52 177.29 3mbh h GLY 232 N -0.50 1.19 0.82 2.16 0.00 -1.26 -3.07 103.07 102.41 3mbh h GLY 232 Ca 0.03 -0.64 -0.00 0.00 0.00 0.00 0.00 47.33 46.71 3mbh h GLY 232 CO -0.15 0.60 0.01 0.23 0.00 0.00 0.00 176.54 177.23 3mbh h SER 233 N 1.08 0.04 0.00 0.19 0.87 -0.89 0.09 113.55 114.93 3mbh h SER 233 Ca 0.25 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 3mbh h SER 233 Cb 0.21 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 3mbh h SER 233 CO -0.02 0.22 0.00 0.18 -0.53 0.00 0.00 176.83 176.68 3mbh n LEU 234 N -4.97 0.05 0.00 2.23 4.77 -0.07 -2.02 117.00 116.99 3mbh n LEU 234 Ca -0.07 -0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 3mbh n LEU 234 Cb 0.12 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3mbh n LEU 234 CO 0.33 0.01 0.00 0.00 -1.33 0.00 0.00 177.39 176.40 3mbh n GLN 236 N 0.92 0.00 0.00 3.23 6.02 0.02 -4.15 117.38 123.42 3mbh n GLN 236 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 3mbh n GLN 236 Cb 0.01 -0.01 0.00 0.00 1.02 0.00 0.00 30.24 31.26 3mbh n GLN 236 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3mbh n GLY 237 N 0.01 0.76 3.75 1.08 0.00 -1.07 -5.09 105.19 104.64 3mbh n GLY 237 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 3mbh n GLY 237 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3mbh s ASP 238 N -2.47 4.96 0.77 1.61 1.01 -0.86 -5.04 116.67 116.66 3mbh s ASP 238 Ca 0.00 2.18 -0.11 0.00 0.71 0.00 0.00 52.55 55.33 3mbh s ASP 238 Cb 0.00 -2.57 0.05 0.00 1.01 0.00 0.00 42.92 41.41 3mbh s ASP 238 CO 0.00 -1.74 1.08 -0.94 0.21 0.00 0.00 175.17 173.78 3mbh s SER 239 N -2.16 4.65 0.11 0.27 1.04 -1.26 -4.53 113.70 111.82 3mbh s SER 239 Ca 0.71 1.54 -0.23 0.00 0.48 0.00 0.00 55.95 58.45 3mbh s SER 239 Cb -0.25 -2.31 -0.10 0.00 0.10 0.00 0.00 66.02 63.46 3mbh s SER 239 CO 0.39 -1.90 1.70 0.25 0.98 0.00 0.00 173.24 174.66 3mbh h LEU 240 N -1.04 -0.25 -2.49 2.42 5.85 -1.99 -0.73 115.31 117.09 3mbh h LEU 240 Ca -0.46 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.30 3mbh h LEU 240 Cb 1.24 0.11 0.00 0.00 0.37 0.00 0.00 40.66 42.38 3mbh h LEU 240 CO 0.56 -0.13 0.00 -0.81 -0.34 0.00 0.00 178.44 177.72 3mbh n PRO 241 N -5.21 0.08 0.00 5.25 -0.04 -1.26 -1.34 135.00 132.48 3mbh n PRO 241 Ca -0.06 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.40 3mbh n PRO 241 Cb 0.14 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 3mbh n PRO 241 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3mbh n ALA 243 N 1.22 0.00 -0.21 0.55 0.00 -0.28 -1.85 120.51 119.93 3mbh n ALA 243 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 3mbh n ALA 243 Cb 0.04 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.56 3mbh n ALA 243 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3mbh h LEU 244 N 0.00 0.53 -0.04 0.00 3.38 -1.49 -1.04 115.31 116.66 3mbh h LEU 244 Ca 0.00 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3mbh h LEU 244 Cb 0.00 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 3mbh h LEU 244 CO 0.00 0.36 0.02 0.44 0.09 0.00 0.00 178.44 179.35 3mbh h ASP 245 N 0.66 0.05 -0.44 -0.43 3.32 -1.64 -0.98 116.42 116.96 3mbh h ASP 245 Ca 0.26 -0.09 0.02 0.00 0.02 0.00 0.00 57.03 57.25 3mbh h ASP 245 Cb 0.12 -0.01 -0.03 0.00 0.22 0.00 0.00 39.33 39.63 3mbh h ASP 245 CO -0.15 0.12 0.26 0.03 -1.72 0.00 0.00 179.24 177.78 3mbh h ARG 246 N -0.02 0.51 -0.26 3.56 3.08 -1.76 -1.57 114.38 117.90 3mbh h ARG 246 Ca 0.01 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.99 3mbh h ARG 246 Cb 0.08 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3mbh h ARG 246 CO -0.00 0.34 -0.01 0.00 -1.07 0.00 0.00 179.97 179.22 3mbh h ALA 247 N 1.20 0.36 -0.21 0.04 0.00 -1.12 -1.27 119.26 118.25 3mbh h ALA 247 Ca 0.18 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.67 3mbh h ALA 247 Cb 0.01 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3mbh h ALA 247 CO -0.08 0.11 -0.60 1.79 0.00 0.00 0.00 179.25 180.47 3mbh h THR 248 N 0.25 1.30 -0.34 0.00 1.35 -1.09 -1.14 112.91 113.25 3mbh h THR 248 Ca 0.07 -1.82 -0.10 0.00 -0.55 0.00 0.00 66.41 64.01 3mbh h THR 248 Cb 0.44 1.77 -0.02 0.00 -1.73 0.00 0.00 68.15 68.62 3mbh h THR 248 CO 0.02 0.58 -0.20 1.56 -0.25 0.00 0.00 175.52 177.22 3mbh h GLN 249 N 0.53 0.64 -0.17 4.72 1.08 -1.25 -0.45 115.11 120.20 3mbh h GLN 249 Ca -0.00 -0.24 -0.04 0.00 -1.45 0.00 0.00 58.65 56.92 3mbh h GLN 249 Cb 1.18 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 28.56 3mbh h GLN 249 CO 0.12 0.80 -0.06 0.35 -0.95 0.00 0.00 178.83 179.09 3mbh h PHE 250 N 0.57 0.38 -0.67 2.96 3.57 -0.96 -2.07 116.94 120.72 3mbh h PHE 250 Ca 0.09 -0.09 -0.04 0.00 3.53 0.00 0.00 57.97 61.45 3mbh h PHE 250 Cb 0.66 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 39.28 3mbh h PHE 250 CO 0.03 0.63 0.25 0.82 -2.23 0.00 0.00 178.31 177.80 3mbh h ILE 251 N 0.03 1.25 -0.63 1.41 2.04 -1.07 -1.48 117.51 119.06 3mbh h ILE 251 Ca 0.04 -0.80 0.09 0.00 1.00 0.00 0.00 64.86 65.19 3mbh h ILE 251 Cb 0.51 0.50 -0.07 0.00 -0.74 0.00 0.00 36.82 37.02 3mbh h ILE 251 CO 0.02 0.32 0.26 0.25 0.00 0.00 0.00 178.15 179.00 3mbh h LEU 252 N 0.97 0.29 -0.32 1.44 5.85 -0.93 0.80 115.31 123.40 3mbh h LEU 252 Ca 0.22 0.07 -0.06 0.00 0.84 0.00 0.00 57.88 58.95 3mbh h LEU 252 Cb 0.24 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 3mbh h LEU 252 CO -0.01 0.17 -0.04 1.56 -0.34 0.00 0.00 178.44 179.78 3mbh h GLN 253 N 0.46 0.60 -0.78 1.25 4.20 -0.93 -0.65 115.11 119.26 3mbh h GLN 253 Ca 0.31 -0.21 0.06 0.00 0.06 0.00 0.00 58.65 58.88 3mbh h GLN 253 Cb 0.37 -0.04 -0.05 0.00 0.30 0.00 0.00 27.48 28.06 3mbh h GLN 253 CO -0.29 0.75 0.51 0.78 -0.67 0.00 0.00 178.83 179.91 3mbh h GLY 254 N 0.38 1.07 0.55 3.46 0.00 -0.79 0.32 103.07 108.06 3mbh h GLY 254 Ca 0.09 -0.34 -0.06 0.00 0.00 0.00 0.00 47.33 47.01 3mbh h GLY 254 CO 0.02 0.25 -0.22 -2.22 0.00 0.00 0.00 176.54 174.37 3mbh h ILE 255 N 0.84 1.48 -0.26 2.60 2.04 -0.67 -1.99 117.51 121.55 3mbh h ILE 255 Ca 0.33 -1.72 -0.00 0.00 1.00 0.00 0.00 64.86 64.47 3mbh h ILE 255 Cb 0.23 2.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.78 3mbh h ILE 255 CO -0.12 0.48 0.14 0.03 0.00 0.00 0.00 178.15 178.69 3mbh h ARG 256 N -0.36 0.35 0.00 2.37 3.08 -0.90 -1.65 114.38 117.27 3mbh h ARG 256 Ca -0.02 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.01 3mbh h ARG 256 Cb 0.90 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.87 3mbh h ARG 256 CO 0.05 0.26 0.00 0.00 -1.07 0.00 0.00 179.97 179.20 3mbh h ALA 257 N 1.81 1.00 -0.01 0.04 0.00 -0.99 -1.56 119.26 119.54 3mbh h ALA 257 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3mbh h ALA 257 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3mbh h ALA 257 CO -0.02 0.00 -0.11 0.25 0.00 0.00 0.00 179.25 179.37 3mbh n THR 258 N -2.40 0.00 -3.23 0.00 -2.24 -0.62 -4.95 114.28 100.85 3mbh n THR 258 Ca -0.01 -0.24 -0.34 0.00 -2.27 0.00 0.00 64.05 61.18 3mbh n THR 258 Cb 0.06 0.63 -0.06 0.00 -2.10 0.00 0.00 70.33 68.87 3mbh n THR 258 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 3mbh s PHE 259 N -2.19 3.51 0.00 4.78 0.08 -0.59 -4.34 117.98 119.24 3mbh s PHE 259 Ca 0.31 1.17 0.00 0.00 0.12 0.00 0.00 56.93 58.53 3mbh s PHE 259 Cb 0.20 -2.47 0.00 0.00 -0.57 0.00 0.00 43.02 40.18 3mbh s PHE 259 CO 0.40 0.27 0.00 0.41 -0.10 0.00 0.00 175.22 176.20 3mbh n GLY 260 N 0.25 0.82 3.83 4.36 0.00 -1.26 -5.04 105.19 108.15 3mbh n GLY 260 Ca -0.01 -0.15 -0.07 0.00 0.00 0.00 0.00 46.02 45.79 3mbh n GLY 260 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3mbh s TYR 261 N -2.00 -0.12 0.01 1.61 1.13 -1.26 -5.12 117.35 111.60 3mbh s TYR 261 Ca 0.00 -0.33 -0.30 0.00 -1.41 0.00 0.00 57.07 55.03 3mbh s TYR 261 Cb 0.00 0.65 -0.06 0.00 -1.10 0.00 0.00 41.96 41.45 3mbh s TYR 261 CO 0.00 -1.21 1.40 -2.00 -2.51 0.00 0.00 175.55 171.23 3mbh s GLU 262 N -3.93 4.29 -0.03 -3.49 -6.30 -1.26 -4.97 118.70 103.01 3mbh s GLU 262 Ca 0.12 1.98 -0.02 0.00 -2.50 0.00 0.00 54.97 54.55 3mbh s GLU 262 Cb -0.05 -3.54 0.02 0.00 0.00 0.00 0.00 34.13 30.55 3mbh s GLU 262 CO 0.07 -0.56 0.07 -0.47 0.02 0.00 0.00 175.26 174.40 3mbh s TYR 263 N 2.27 -0.07 -0.60 5.30 5.04 -1.26 -5.09 117.35 122.93 3mbh s TYR 263 Ca 0.64 0.22 -0.20 0.00 -2.44 0.00 0.00 57.07 55.29 3mbh s TYR 263 Cb -0.32 -0.03 0.09 0.00 0.35 0.00 0.00 41.96 42.05 3mbh s TYR 263 CO 0.27 -0.06 0.79 0.34 -1.34 0.00 0.00 175.55 175.54 3mbh s ASP 264 N 0.37 6.19 0.63 4.32 -1.08 -1.26 -4.91 116.67 120.93 3mbh s ASP 264 Ca -0.03 -1.20 0.30 0.00 -0.52 0.00 0.00 52.55 51.10 3mbh s ASP 264 Cb -0.04 -2.34 1.62 0.00 -1.46 0.00 0.00 42.92 40.69 3mbh s ASP 264 CO -0.01 -1.20 1.90 0.78 0.52 0.00 0.00 175.17 177.16 3mbh h ASN 265 N 9.29 0.00 0.58 -0.34 2.35 -1.90 -0.77 115.58 124.79 3mbh h ASN 265 Ca -0.29 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.46 3mbh h ASN 265 Cb 1.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.45 3mbh h ASN 265 CO 1.11 0.00 0.00 0.03 -1.65 0.00 0.00 177.43 176.92 3mbh h ARG 266 N 0.00 0.00 0.00 0.81 3.08 -1.91 -1.49 114.38 114.87 3mbh h ARG 266 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3mbh h ARG 266 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.64 3mbh h ARG 266 CO 0.00 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.29 3mbh n GLU 267 N -3.05 0.10 0.00 0.04 1.02 -0.29 -4.56 120.64 113.89 3mbh n GLU 267 Ca -0.01 0.26 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 3mbh n GLU 267 Cb 0.20 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 29.96 3mbh n GLU 267 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3mbh n GLY 268 N 0.44 -3.90 3.73 0.62 0.00 -0.56 -3.32 105.19 102.19 3mbh n GLY 268 Ca 0.04 -2.10 -0.31 0.00 0.00 0.00 0.00 46.02 43.65 3mbh n GLY 268 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3mbh s ILE 269 N -0.82 2.83 -1.23 -0.61 -4.36 -1.26 -4.90 121.20 110.84 3mbh s ILE 269 Ca 0.00 0.27 -0.10 0.00 -0.26 0.00 0.00 60.65 60.56 3mbh s ILE 269 Cb 0.00 -2.60 0.19 0.00 1.25 0.00 0.00 42.46 41.30 3mbh s ILE 269 CO 0.00 -0.35 1.68 0.18 0.24 0.00 0.00 174.94 176.69 3mbh n LEU 270 N -3.82 6.22 -0.00 0.37 4.77 -0.75 -4.83 117.00 118.95 3mbh n LEU 270 Ca 0.09 -4.70 -0.10 0.00 -0.03 0.00 0.00 56.01 51.28 3mbh n LEU 270 Cb 0.53 -1.49 -0.03 0.00 -2.33 0.00 0.00 43.42 40.10 3mbh n LEU 270 CO 0.52 1.26 0.70 0.25 -1.33 0.00 0.00 177.39 178.80 3mbh h LEU 271 N 7.93 -0.72 -1.16 2.23 5.85 -1.91 -2.70 115.31 124.83 3mbh h LEU 271 Ca 0.34 0.12 -0.08 0.00 0.84 0.00 0.00 57.88 59.10 3mbh h LEU 271 Cb 0.70 0.32 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 3mbh h LEU 271 CO 1.47 -0.28 -0.37 -0.33 -0.34 0.00 0.00 178.44 178.59 3mbh h GLU 272 N -0.29 0.00 -0.06 1.25 3.07 -2.00 -0.71 114.58 115.84 3mbh h GLU 272 Ca 0.10 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.86 3mbh h GLU 272 Cb 0.44 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.34 3mbh h GLU 272 CO -0.31 0.37 -0.42 -0.22 -1.40 0.00 0.00 179.01 177.03 3mbh h LYS 273 N 0.00 0.14 -0.10 2.33 1.63 -1.89 -3.28 116.57 115.40 3mbh h LYS 273 Ca -0.00 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.73 3mbh h LYS 273 Cb 0.76 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.39 3mbh h LYS 273 CO 0.05 0.53 0.00 1.33 -3.45 0.00 0.00 179.45 177.91 3mbh n VAL 274 N -4.03 0.29 -0.23 2.00 0.24 -0.72 -4.73 118.33 111.15 3mbh n VAL 274 Ca -0.02 -0.64 0.12 0.00 -2.04 0.00 0.00 64.34 61.76 3mbh n VAL 274 Cb 0.47 1.00 0.40 0.00 -1.47 0.00 0.00 33.84 34.24 3mbh n VAL 274 CO 0.00 0.00 0.00 0.25 -2.14 0.00 0.00 176.83 174.94 3mbh h LEU 275 N 1.87 0.60 0.00 1.34 5.85 -1.22 -0.74 115.31 123.01 3mbh h LEU 275 Ca 0.00 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3mbh h LEU 275 Cb 0.49 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.43 3mbh h LEU 275 CO 0.00 0.32 0.00 1.41 -0.34 0.00 0.00 178.44 179.83 3mbh n HIS 276 N -4.53 0.00 1.11 1.25 8.25 -1.26 -2.20 115.22 117.84 3mbh n HIS 276 Ca 0.15 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.75 3mbh n HIS 276 Cb 0.44 -0.30 0.47 0.00 1.12 0.00 0.00 29.99 31.71 3mbh n HIS 276 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 3mbh n ASN 277 N -1.30 0.34 0.22 0.41 3.02 -0.28 -2.86 115.26 114.81 3mbh n ASN 277 Ca 0.10 -0.10 0.08 0.00 -0.03 0.00 0.00 54.58 54.64 3mbh n ASN 277 Cb 0.18 -0.09 0.52 0.00 -0.61 0.00 0.00 39.78 39.78 3mbh n ASN 277 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3mbh h LEU 278 N 0.18 0.00 -4.52 3.41 3.38 -1.59 -3.47 115.31 112.70 3mbh h LEU 278 Ca 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.70 3mbh h LEU 278 Cb 0.47 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 3mbh h LEU 278 CO 0.00 0.25 0.88 0.47 0.09 0.00 0.00 178.44 180.13 3mbh n ASP 279 N -3.68 5.02 -4.93 -0.43 8.00 -1.13 -5.08 116.55 114.32 3mbh n ASP 279 Ca -0.01 -2.33 -0.23 0.00 0.71 0.00 0.00 54.79 52.92 3mbh n ASP 279 Cb 0.36 -1.19 -0.03 0.00 -0.02 0.00 0.00 41.12 40.24 3mbh n ASP 279 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 3mbh s PRO 281 N 1.84 3.32 -0.42 -0.24 0.04 -1.26 -5.17 135.00 133.11 3mbh s PRO 281 Ca 0.54 -0.75 -0.22 0.00 0.04 0.00 0.00 61.00 60.61 3mbh s PRO 281 Cb 0.22 -2.85 0.02 0.00 0.04 0.00 0.00 34.50 31.92 3mbh s PRO 281 CO -0.01 0.47 0.73 0.42 0.04 0.00 0.00 177.00 178.64 3mbh s ILE 282 N -1.89 4.74 -0.58 0.56 -1.09 -1.26 -5.17 121.20 116.51 3mbh s ILE 282 Ca 0.34 0.44 -0.05 0.00 -2.23 0.00 0.00 60.65 59.14 3mbh s ILE 282 Cb -0.10 -4.24 -0.01 0.00 -1.58 0.00 0.00 42.46 36.53 3mbh s ILE 282 CO 0.28 -0.59 2.91 0.00 -1.23 0.00 0.00 174.94 176.30 3mbh n GLN 283 N 6.47 2.79 -3.70 2.79 6.02 -1.26 -5.07 117.38 125.42 3mbh n GLN 283 Ca 0.01 -2.24 -0.17 0.00 -0.01 0.00 0.00 57.00 54.59 3mbh n GLN 283 Cb 0.48 -2.24 -0.16 0.00 1.02 0.00 0.00 30.24 29.34 3mbh n GLN 283 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3mbh s ALA 285 N -0.77 -0.04 -0.44 -1.58 0.00 -1.26 -5.28 121.76 112.39 3mbh s ALA 285 Ca 0.61 0.45 0.14 0.00 0.00 0.00 0.00 51.96 53.16 3mbh s ALA 285 Cb 0.32 -0.61 -0.18 0.00 0.00 0.00 0.00 23.12 22.65 3mbh s ALA 285 CO -0.14 -0.39 0.51 0.45 0.00 0.00 0.00 175.76 176.18 3mbh n SER 286 N 4.92 1.01 -4.81 0.00 2.88 -1.26 -5.05 113.62 111.32 3mbh n SER 286 Ca -0.12 -0.54 -0.33 0.00 -1.33 0.00 0.00 58.87 56.56 3mbh n SER 286 Cb 0.50 1.24 0.00 0.00 -0.75 0.00 0.00 64.21 65.21 3mbh n SER 286 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 3mbh s TYR 287 N -2.60 3.07 0.03 0.66 -0.85 -1.26 -4.68 117.35 111.72 3mbh s TYR 287 Ca 0.02 1.51 0.01 0.00 -0.52 0.00 0.00 57.07 58.08 3mbh s TYR 287 Cb 0.10 -2.97 -0.02 0.00 0.38 0.00 0.00 41.96 39.45 3mbh s TYR 287 CO 0.60 -0.98 -0.05 -1.83 -1.52 0.00 0.00 175.55 171.77 3mbh s GLU 288 N -4.04 0.41 0.21 -3.49 -1.05 -0.49 -4.98 118.70 105.27 3mbh s GLU 288 Ca 0.63 -0.66 -0.30 0.00 -0.15 0.00 0.00 54.97 54.49 3mbh s GLU 288 Cb -0.15 -0.11 -0.08 0.00 -0.44 0.00 0.00 34.13 33.35 3mbh s GLU 288 CO 0.35 0.01 0.97 -1.17 0.95 0.00 0.00 175.26 176.37 3mbh s LEU 289 N -1.44 4.60 0.00 1.83 0.20 -1.26 -1.12 118.68 121.48 3mbh s LEU 289 Ca -0.12 1.95 0.00 0.00 0.69 0.00 0.00 54.13 56.65 3mbh s LEU 289 Cb -0.10 -3.61 0.00 0.00 -0.43 0.00 0.00 46.19 42.06 3mbh s LEU 289 CO -0.00 0.06 0.23 2.30 -0.29 0.00 0.00 176.35 178.65