#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3bdm s ARG 10 N 0.00 0.27 0.22 -0.67 3.52 -1.26 -5.16 118.95 115.88 3bdm s ARG 10 Ca 0.00 0.54 -0.17 0.00 -0.13 0.00 0.00 55.73 55.97 3bdm s ARG 10 Cb 0.00 0.31 -0.11 0.00 -1.56 0.00 0.00 34.95 33.58 3bdm s ARG 10 CO 0.00 -0.25 0.20 0.41 -0.81 0.00 0.00 175.30 174.85 3bdm n GLY 11 N 5.34 -1.62 0.17 8.12 0.00 -1.26 -4.83 105.19 111.11 3bdm n GLY 11 Ca -0.07 0.10 0.13 0.00 0.00 0.00 0.00 46.02 46.19 3bdm n GLY 11 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3bdm h VAL 12 N 0.44 0.00 -0.47 1.61 -1.51 -1.97 -2.69 116.25 111.65 3bdm h VAL 12 Ca -0.23 -0.24 -0.25 0.00 -1.23 0.00 0.00 66.70 64.74 3bdm h VAL 12 Cb 1.02 1.00 -0.15 0.00 -2.13 0.00 0.00 31.29 31.02 3bdm h VAL 12 CO 0.36 0.00 0.03 -1.54 -1.23 0.00 0.00 177.57 175.19 3bdm n SER 13 N -2.43 2.78 -4.82 4.19 3.41 -1.26 -4.44 113.62 111.05 3bdm n SER 13 Ca 0.01 -3.77 -0.33 0.00 -0.26 0.00 0.00 58.87 54.52 3bdm n SER 13 Cb 0.21 -0.67 -0.07 0.00 -0.26 0.00 0.00 64.21 63.42 3bdm n SER 13 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3bdm s THR 14 N -3.32 4.39 -0.13 6.66 2.01 -1.02 -5.03 115.64 119.21 3bdm s THR 14 Ca 0.47 1.48 -0.09 0.00 0.31 0.00 0.00 61.69 63.87 3bdm s THR 14 Cb 0.42 -3.64 -0.04 0.00 0.01 0.00 0.00 72.50 69.25 3bdm s THR 14 CO 0.01 -0.27 0.17 -0.36 -0.69 0.00 0.00 174.62 173.49 3bdm s PHE 15 N -2.12 3.57 0.49 4.92 0.08 -1.26 -3.26 117.98 120.40 3bdm s PHE 15 Ca 0.60 0.54 -0.11 0.00 0.12 0.00 0.00 56.93 58.08 3bdm s PHE 15 Cb -0.10 -2.04 -0.06 0.00 -0.57 0.00 0.00 43.02 40.25 3bdm s PHE 15 CO 0.14 0.62 0.89 -1.54 -0.10 0.00 0.00 175.22 175.22 3bdm s SER 16 N -0.68 6.45 0.47 1.36 1.04 0.18 -4.92 113.70 117.60 3bdm s SER 16 Ca 0.15 1.28 0.28 0.00 0.48 0.00 0.00 55.95 58.14 3bdm s SER 16 Cb -0.12 -2.39 1.52 0.00 0.10 0.00 0.00 66.02 65.13 3bdm s SER 16 CO 0.04 -0.58 1.84 -0.65 0.98 0.00 0.00 173.24 174.87 3bdm h PRO 17 N 0.68 0.00 -0.04 4.02 0.11 -1.99 0.20 132.00 134.98 3bdm h PRO 17 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 3bdm h PRO 17 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3bdm h PRO 17 CO 0.62 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.80 3bdm n GLU 18 N -2.55 1.70 -0.80 1.05 4.71 -1.26 -4.93 120.64 118.56 3bdm n GLU 18 Ca -0.02 -1.02 0.00 0.00 -0.01 0.00 0.00 57.16 56.11 3bdm n GLU 18 Cb 0.14 -1.47 0.00 0.00 -1.01 0.00 0.00 31.44 29.10 3bdm n GLU 18 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3bdm n GLY 19 N 1.18 0.91 3.50 0.62 0.00 0.71 -5.09 105.19 107.01 3bdm n GLY 19 Ca 0.18 -0.53 -0.24 0.00 0.00 0.00 0.00 46.02 45.43 3bdm n GLY 19 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3bdm s ARG 20 N -1.84 1.72 -0.38 1.61 0.52 -1.25 -4.87 118.95 114.46 3bdm s ARG 20 Ca 0.00 -1.86 -0.16 0.00 -0.52 0.00 0.00 55.73 53.19 3bdm s ARG 20 Cb 0.00 -1.63 0.00 0.00 0.52 0.00 0.00 34.95 33.85 3bdm s ARG 20 CO 0.00 0.18 0.40 -0.51 0.02 0.00 0.00 175.30 175.40 3bdm s LEU 21 N -3.55 4.64 0.11 2.53 1.43 -1.26 0.49 118.68 123.07 3bdm s LEU 21 Ca 0.31 -0.44 -0.22 0.00 -1.03 0.00 0.00 54.13 52.76 3bdm s LEU 21 Cb 0.00 -2.37 -0.05 0.00 0.03 0.00 0.00 46.19 43.80 3bdm s LEU 21 CO 0.15 -0.46 1.37 -0.26 0.23 0.00 0.00 176.35 177.38 3bdm h PHE 22 N 8.59 -1.28 -0.85 0.29 -1.00 -1.89 -1.05 116.94 119.75 3bdm h PHE 22 Ca -0.28 0.08 0.20 0.00 2.81 0.00 0.00 57.97 60.79 3bdm h PHE 22 Cb 1.13 0.64 -0.12 0.00 3.61 0.00 0.00 35.95 41.20 3bdm h PHE 22 CO 0.66 -0.27 0.32 1.96 -1.61 0.00 0.00 178.31 179.37 3bdm h GLN 23 N -0.05 0.35 -0.48 1.51 1.08 -1.86 0.49 115.11 116.14 3bdm h GLN 23 Ca 0.10 -0.02 -0.05 0.00 -1.45 0.00 0.00 58.65 57.23 3bdm h GLN 23 Cb 0.31 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.64 3bdm h GLN 23 CO -0.60 0.23 0.12 0.28 -0.95 0.00 0.00 178.83 177.91 3bdm h VAL 24 N 0.36 1.24 0.68 -0.54 2.07 -1.57 0.21 116.25 118.69 3bdm h VAL 24 Ca 0.52 -0.84 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 3bdm h VAL 24 Cb 0.96 0.86 0.01 0.00 -1.52 0.00 0.00 31.29 31.60 3bdm h VAL 24 CO -0.53 0.30 -0.33 -0.33 0.02 0.00 0.00 177.57 176.70 3bdm h GLU 25 N 0.66 -0.88 -0.90 1.57 4.39 -0.00 -1.80 114.58 117.62 3bdm h GLU 25 Ca 0.15 0.06 0.19 0.00 0.34 0.00 0.00 59.36 60.10 3bdm h GLU 25 Cb 0.33 0.20 -0.07 0.00 -0.10 0.00 0.00 28.75 29.11 3bdm h GLU 25 CO 0.00 -0.57 0.59 1.88 -1.16 0.00 0.00 179.01 179.75 3bdm h TYR 26 N -0.97 0.64 -1.00 4.33 0.05 -0.96 0.39 116.97 119.46 3bdm h TYR 26 Ca -0.09 0.02 0.03 0.00 0.05 0.00 0.00 58.73 58.73 3bdm h TYR 26 Cb 0.72 -0.20 -0.05 0.00 1.01 0.00 0.00 36.73 38.20 3bdm h TYR 26 CO -0.02 0.18 0.66 1.03 -1.05 0.00 0.00 178.16 178.96 3bdm h SER 27 N 0.49 1.11 0.48 3.88 0.87 -0.26 -1.26 113.55 118.87 3bdm h SER 27 Ca 0.47 -0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.97 3bdm h SER 27 Cb 1.05 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.74 3bdm h SER 27 CO -0.20 0.78 -0.21 -0.07 -0.53 0.00 0.00 176.83 176.60 3bdm h LEU 28 N 1.30 0.00 -0.10 2.23 -0.00 0.58 -2.93 115.31 116.39 3bdm h LEU 28 Ca 0.38 0.00 -0.02 0.00 -0.00 0.00 0.00 57.88 58.24 3bdm h LEU 28 Cb -0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.60 3bdm h LEU 28 CO -0.11 0.21 -0.03 -0.33 -0.00 0.00 0.00 178.44 178.18 3bdm h GLU 29 N 0.00 0.19 -0.66 1.13 4.39 -0.84 -2.64 114.58 116.15 3bdm h GLU 29 Ca -0.00 -0.08 0.15 0.00 0.34 0.00 0.00 59.36 59.77 3bdm h GLU 29 Cb 0.51 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.11 3bdm h GLU 29 CO 0.03 0.53 0.45 0.00 -1.16 0.00 0.00 179.01 178.86 3bdm h ALA 30 N 0.66 2.26 -0.42 3.43 0.00 -1.33 -0.51 119.26 123.35 3bdm h ALA 30 Ca 0.02 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3bdm h ALA 30 Cb 0.47 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3bdm h ALA 30 CO 0.01 -0.44 -0.17 0.82 0.00 0.00 0.00 179.25 179.48 3bdm h ILE 31 N 0.26 1.26 0.00 0.00 1.08 -1.36 -2.56 117.51 116.20 3bdm h ILE 31 Ca 0.32 -1.26 -0.02 0.00 -0.39 0.00 0.00 64.86 63.51 3bdm h ILE 31 Cb 0.89 1.12 -0.00 0.00 -3.07 0.00 0.00 36.82 35.76 3bdm h ILE 31 CO -0.07 0.42 -0.12 0.11 -0.69 0.00 0.00 178.15 177.81 3bdm h LYS 32 N 0.70 0.00 0.00 2.37 1.57 -0.78 -0.54 116.57 119.89 3bdm h LYS 32 Ca 0.11 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3bdm h LYS 32 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 3bdm h LYS 32 CO 0.05 0.12 0.00 1.28 -0.57 0.00 0.00 179.45 180.33 3bdm n LEU 33 N -4.26 0.00 -4.89 2.94 4.77 -0.97 -2.42 117.00 112.17 3bdm n LEU 33 Ca -0.03 0.33 -0.30 0.00 -0.03 0.00 0.00 56.01 55.99 3bdm n LEU 33 Cb 0.19 -0.33 0.06 0.00 -2.33 0.00 0.00 43.42 41.01 3bdm n LEU 33 CO 0.34 -0.01 0.75 -0.83 -1.33 0.00 0.00 177.39 176.32 3bdm s GLY 34 N -2.66 1.62 0.93 -0.72 0.00 -0.21 -4.76 107.32 101.52 3bdm s GLY 34 Ca 0.25 -0.46 -0.12 0.00 0.00 0.00 0.00 44.72 44.39 3bdm s GLY 34 CO 0.47 -0.06 0.65 1.44 0.00 0.00 0.00 173.10 175.60 3bdm n SER 35 N -3.08 -1.27 -4.81 1.64 7.64 -1.26 0.00 113.62 112.48 3bdm n SER 35 Ca 0.07 0.37 -0.34 0.00 1.01 0.00 0.00 58.87 59.98 3bdm n SER 35 Cb 0.58 -1.30 -0.07 0.00 -1.01 0.00 0.00 64.21 62.42 3bdm n SER 35 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3bdm s THR 36 N -2.46 4.39 -0.13 0.44 2.01 -1.26 -4.03 115.64 114.60 3bdm s THR 36 Ca 0.60 1.49 -0.07 0.00 0.31 0.00 0.00 61.69 64.03 3bdm s THR 36 Cb -0.22 -3.73 0.05 0.00 0.01 0.00 0.00 72.50 68.62 3bdm s THR 36 CO 0.64 -0.15 0.31 0.00 -0.69 0.00 0.00 174.62 174.74 3bdm s ALA 37 N -1.96 -0.76 0.07 7.40 0.00 0.10 -1.63 121.76 124.97 3bdm s ALA 37 Ca 0.57 1.22 0.05 0.00 0.00 0.00 0.00 51.96 53.79 3bdm s ALA 37 Cb -0.12 -0.78 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 3bdm s ALA 37 CO 0.17 -0.26 -0.14 0.42 0.00 0.00 0.00 175.76 175.95 3bdm s ILE 38 N 1.40 1.08 -0.03 0.00 1.01 0.38 -0.46 121.20 124.59 3bdm s ILE 38 Ca -0.09 -1.28 -0.01 0.00 0.00 0.00 0.00 60.65 59.27 3bdm s ILE 38 Cb -0.10 -1.05 0.02 0.00 0.01 0.00 0.00 42.46 41.35 3bdm s ILE 38 CO -0.10 -0.22 0.05 -0.83 0.00 0.00 0.00 174.94 173.84 3bdm s GLY 39 N -1.70 0.03 -0.06 6.18 0.00 0.25 -0.39 107.32 111.63 3bdm s GLY 39 Ca -0.02 0.30 0.02 0.00 0.00 0.00 0.00 44.72 45.02 3bdm s GLY 39 CO 0.02 0.53 -0.11 -0.42 0.00 0.00 0.00 173.10 173.11 3bdm s ILE 40 N 0.70 1.07 -0.09 0.90 -1.09 -0.16 -0.96 121.20 121.57 3bdm s ILE 40 Ca -0.06 -0.45 -0.02 0.00 -2.23 0.00 0.00 60.65 57.90 3bdm s ILE 40 Cb -0.08 -0.98 -0.03 0.00 -1.58 0.00 0.00 42.46 39.79 3bdm s ILE 40 CO -0.02 0.34 -0.01 0.00 -1.23 0.00 0.00 174.94 174.01 3bdm s ALA 41 N 0.63 3.22 0.04 9.38 0.00 0.24 -0.11 121.76 135.16 3bdm s ALA 41 Ca -0.13 -0.82 -0.01 0.00 0.00 0.00 0.00 51.96 51.00 3bdm s ALA 41 Cb -0.15 -1.46 -0.04 0.00 0.00 0.00 0.00 23.12 21.47 3bdm s ALA 41 CO 0.03 0.54 -0.03 0.95 0.00 0.00 0.00 175.76 177.25 3bdm s THR 42 N -0.73 0.21 -2.00 0.00 -4.23 0.74 -4.89 115.64 104.73 3bdm s THR 42 Ca 0.11 -1.62 0.03 0.00 -1.18 0.00 0.00 61.69 59.03 3bdm s THR 42 Cb -0.12 -1.25 0.08 0.00 1.34 0.00 0.00 72.50 72.55 3bdm s THR 42 CO 0.02 -0.89 0.47 0.29 -0.54 0.00 0.00 174.62 173.97 3bdm n LYS 43 N 0.43 0.18 -0.00 3.99 5.02 -1.26 -0.41 118.16 126.11 3bdm n LYS 43 Ca -0.16 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.14 3bdm n LYS 43 Cb 0.60 -1.23 0.02 0.00 -0.02 0.00 0.00 35.03 34.40 3bdm n LYS 43 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3bdm n GLU 44 N -0.73 -0.29 -0.09 1.97 1.02 -1.26 -5.05 120.64 116.21 3bdm n GLU 44 Ca 0.02 -0.76 0.00 0.00 -0.02 0.00 0.00 57.16 56.40 3bdm n GLU 44 Cb 0.01 -1.06 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 3bdm n GLU 44 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3bdm n GLY 45 N 0.14 0.94 3.21 0.62 0.00 0.45 -4.78 105.19 105.77 3bdm n GLY 45 Ca 0.02 -1.93 -0.28 0.00 0.00 0.00 0.00 46.02 43.83 3bdm n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3bdm s VAL 46 N -1.15 1.66 -0.13 1.61 1.01 -0.78 -0.19 120.40 122.44 3bdm s VAL 46 Ca 0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 61.98 61.09 3bdm s VAL 46 Cb 0.00 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 3bdm s VAL 46 CO 0.00 0.47 -0.09 -0.69 0.00 0.00 0.00 175.10 174.79 3bdm s VAL 47 N -0.34 3.42 -0.06 2.92 1.01 0.84 -1.77 120.40 126.41 3bdm s VAL 47 Ca 0.04 -0.54 0.05 0.00 0.00 0.00 0.00 61.98 61.53 3bdm s VAL 47 Cb -0.09 -2.45 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 3bdm s VAL 47 CO 0.00 0.53 -0.20 -0.76 0.00 0.00 0.00 175.10 174.67 3bdm s LEU 48 N 0.14 2.38 0.00 3.92 1.02 -0.57 -0.99 118.68 124.59 3bdm s LEU 48 Ca -0.04 -0.37 0.01 0.00 0.02 0.00 0.00 54.13 53.74 3bdm s LEU 48 Cb -0.14 -1.46 -0.01 0.00 0.02 0.00 0.00 46.19 44.60 3bdm s LEU 48 CO 0.04 0.28 -0.03 -0.83 0.02 0.00 0.00 176.35 175.83 3bdm s GLY 49 N -0.35 0.17 0.06 -3.19 0.00 0.48 -2.32 107.32 102.16 3bdm s GLY 49 Ca 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 44.72 44.53 3bdm s GLY 49 CO 0.02 -0.22 -0.05 -1.34 0.00 0.00 0.00 173.10 171.52 3bdm s VAL 50 N -0.33 0.39 -0.40 1.40 -7.23 -0.77 -0.47 120.40 112.98 3bdm s VAL 50 Ca -0.02 -1.59 -0.17 0.00 -1.81 0.00 0.00 61.98 58.39 3bdm s VAL 50 Cb -0.03 -1.22 0.01 0.00 0.56 0.00 0.00 36.38 35.70 3bdm s VAL 50 CO -0.00 -0.79 0.46 -0.70 -0.31 0.00 0.00 175.10 173.76 3bdm s GLU 51 N -3.13 3.27 0.10 4.82 2.12 -0.64 -2.17 118.70 123.06 3bdm s GLU 51 Ca 0.02 -0.57 -0.33 0.00 0.36 0.00 0.00 54.97 54.45 3bdm s GLU 51 Cb 0.01 -3.92 -0.14 0.00 0.26 0.00 0.00 34.13 30.35 3bdm s GLU 51 CO -0.05 -0.79 1.58 0.87 -0.54 0.00 0.00 175.26 176.33 3bdm h LYS 52 N 8.67 -0.79 -4.59 4.30 6.56 -1.04 -3.42 116.57 126.26 3bdm h LYS 52 Ca -0.27 0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.37 3bdm h LYS 52 Cb 1.12 0.18 0.00 0.00 -0.57 0.00 0.00 32.23 32.95 3bdm h LYS 52 CO 0.79 -0.52 -0.43 -2.13 -2.06 0.00 0.00 179.45 175.09 3bdm n ARG 53 N -5.51 -1.87 -3.08 3.15 0.63 -1.24 -4.99 116.66 103.75 3bdm n ARG 53 Ca -0.10 1.76 -0.40 0.00 -0.92 0.00 0.00 57.85 58.20 3bdm n ARG 53 Cb 0.41 -4.38 -0.05 0.00 0.45 0.00 0.00 32.46 28.89 3bdm n ARG 53 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3bdm s ALA 54 N -1.91 3.45 -1.95 5.13 0.00 -1.26 -4.95 121.76 120.26 3bdm s ALA 54 Ca 0.14 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.04 3bdm s ALA 54 Cb -0.04 -2.97 0.00 0.00 0.00 0.00 0.00 23.12 20.12 3bdm s ALA 54 CO 0.55 -0.32 0.88 0.25 0.00 0.00 0.00 175.76 177.11 3bdm n THR 55 N 4.21 0.00 -3.63 0.00 -2.24 -1.26 -4.84 114.28 106.53 3bdm n THR 55 Ca -0.01 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.74 3bdm n THR 55 Cb 0.50 -0.07 -0.02 0.00 -2.10 0.00 0.00 70.33 68.64 3bdm n THR 55 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3bdm s SER 56 N -1.05 -0.06 0.28 3.42 0.15 -1.26 -5.03 113.70 110.14 3bdm s SER 56 Ca 0.00 0.01 0.14 0.00 0.70 0.00 0.00 55.95 56.80 3bdm s SER 56 Cb 0.00 0.07 0.25 0.00 -1.71 0.00 0.00 66.02 64.63 3bdm s SER 56 CO 0.00 -0.10 1.53 1.55 1.20 0.00 0.00 173.24 177.41 3bdm h PRO 57 N 2.01 0.00 0.00 5.44 0.13 -2.05 -3.21 132.00 134.32 3bdm h PRO 57 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 3bdm h PRO 57 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3bdm h PRO 57 CO 0.21 0.58 0.00 -0.07 -0.23 0.00 0.00 178.00 178.48 3bdm h LEU 58 N 0.00 0.00 -9.21 1.56 3.38 -2.00 -3.44 115.31 105.61 3bdm h LEU 58 Ca -0.01 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.40 3bdm h LEU 58 Cb 1.27 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.98 3bdm h LEU 58 CO 0.08 0.00 0.88 -0.22 0.09 0.00 0.00 178.44 179.27 3bdm s LEU 59 N -5.55 4.22 -0.76 1.67 1.98 -1.22 -4.93 118.68 114.09 3bdm s LEU 59 Ca 0.05 1.80 -0.25 0.00 -2.89 0.00 0.00 54.13 52.83 3bdm s LEU 59 Cb 0.09 -3.54 -0.03 0.00 0.66 0.00 0.00 46.19 43.36 3bdm s LEU 59 CO 0.55 -0.74 1.88 -1.61 -1.89 0.00 0.00 176.35 174.53 3bdm s GLU 60 N 3.24 2.63 0.62 1.98 2.02 -1.26 -4.84 118.70 123.08 3bdm s GLU 60 Ca 0.57 0.12 0.23 0.00 0.02 0.00 0.00 54.97 55.91 3bdm s GLU 60 Cb -0.24 -4.73 0.99 0.00 0.10 0.00 0.00 34.13 30.25 3bdm s GLU 60 CO 0.18 -3.02 1.48 0.66 0.02 0.00 0.00 175.26 174.58 3bdm h SER 61 N 12.97 0.00 -0.13 -0.19 4.64 -1.92 -0.67 113.55 128.25 3bdm h SER 61 Ca -0.08 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 3bdm h SER 61 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.17 3bdm h SER 61 CO 1.22 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 176.28 3bdm n ASP 62 N -3.19 1.70 -1.02 4.97 3.85 -1.26 -3.17 116.55 118.42 3bdm n ASP 62 Ca 0.12 -1.67 0.07 0.00 -0.71 0.00 0.00 54.79 52.61 3bdm n ASP 62 Cb 1.08 -0.08 0.23 0.00 -1.35 0.00 0.00 41.12 41.00 3bdm n ASP 62 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 3bdm n SER 63 N 0.33 2.96 -4.34 -1.12 3.41 -0.26 -4.71 113.62 109.90 3bdm n SER 63 Ca 0.17 -2.11 -0.45 0.00 -0.26 0.00 0.00 58.87 56.22 3bdm n SER 63 Cb 0.35 -0.39 -0.07 0.00 -0.26 0.00 0.00 64.21 63.84 3bdm n SER 63 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3bdm s ILE 64 N -1.48 5.15 -0.53 -1.33 1.01 -1.19 -5.03 121.20 117.80 3bdm s ILE 64 Ca 0.34 -1.31 -0.14 0.00 0.00 0.00 0.00 60.65 59.55 3bdm s ILE 64 Cb 0.19 -4.19 0.13 0.00 0.01 0.00 0.00 42.46 38.60 3bdm s ILE 64 CO 0.21 -0.72 0.46 -0.70 0.00 0.00 0.00 174.94 174.19 3bdm s GLU 65 N 1.60 2.85 0.00 2.79 2.12 -1.26 -4.86 118.70 121.94 3bdm s GLU 65 Ca 0.04 -1.76 0.02 0.00 0.36 0.00 0.00 54.97 53.63 3bdm s GLU 65 Cb -0.27 -4.18 0.05 0.00 0.26 0.00 0.00 34.13 29.98 3bdm s GLU 65 CO 0.05 -1.29 0.94 1.63 -0.54 0.00 0.00 175.26 176.05 3bdm n LYS 66 N 5.09 2.15 -3.72 4.30 5.02 -1.26 -4.90 118.16 124.83 3bdm n LYS 66 Ca -0.11 -1.39 -0.24 0.00 -2.02 0.00 0.00 58.31 54.55 3bdm n LYS 66 Cb 0.40 -1.05 -0.17 0.00 -0.02 0.00 0.00 35.03 34.19 3bdm n LYS 66 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3bdm s ILE 67 N -0.82 0.29 0.28 -0.18 1.01 -1.26 -2.06 121.20 118.47 3bdm s ILE 67 Ca 0.04 -0.08 0.09 0.00 0.00 0.00 0.00 60.65 60.69 3bdm s ILE 67 Cb 0.02 -0.64 -0.06 0.00 0.01 0.00 0.00 42.46 41.80 3bdm s ILE 67 CO 0.03 0.03 -0.11 0.68 0.00 0.00 0.00 174.94 175.57 3bdm s VAL 68 N 1.99 1.99 -0.13 2.92 -7.23 -0.77 -4.97 120.40 114.20 3bdm s VAL 68 Ca 0.03 -2.22 -0.12 0.00 -1.81 0.00 0.00 61.98 57.85 3bdm s VAL 68 Cb -0.14 -2.39 -0.05 0.00 0.56 0.00 0.00 36.38 34.36 3bdm s VAL 68 CO -0.06 -0.35 0.27 -0.70 -0.31 0.00 0.00 175.10 173.94 3bdm s GLU 69 N -3.64 4.06 -0.20 4.82 2.12 -1.26 -1.27 118.70 123.33 3bdm s GLU 69 Ca 0.29 0.07 -0.17 0.00 0.36 0.00 0.00 54.97 55.52 3bdm s GLU 69 Cb 0.01 -3.35 -0.13 0.00 0.26 0.00 0.00 34.13 30.92 3bdm s GLU 69 CO 0.13 0.40 -0.05 -0.89 -0.54 0.00 0.00 175.26 174.31 3bdm n ILE 70 N 3.04 1.50 -3.93 -3.70 2.08 0.96 -4.96 119.36 114.35 3bdm n ILE 70 Ca -0.14 -0.03 -0.09 0.00 0.56 0.00 0.00 62.75 63.05 3bdm n ILE 70 Cb 0.52 -2.12 -0.02 0.00 -0.75 0.00 0.00 39.64 37.27 3bdm n ILE 70 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 3bdm n ASP 71 N -4.44 -0.74 0.26 4.38 4.64 -0.71 -4.60 116.55 115.34 3bdm n ASP 71 Ca -0.29 -2.18 0.17 0.00 -1.38 0.00 0.00 54.79 51.11 3bdm n ASP 71 Cb 0.61 1.42 0.81 0.00 -1.04 0.00 0.00 41.12 42.92 3bdm n ASP 71 CO 0.00 0.00 0.00 -0.09 -0.82 0.00 0.00 177.20 176.29 3bdm h ARG 72 N 0.00 0.00 0.00 -0.67 2.43 -1.96 -2.73 114.38 111.45 3bdm h ARG 72 Ca -0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 3bdm h ARG 72 Cb 0.72 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.27 3bdm h ARG 72 CO 0.22 0.00 -0.01 -2.39 -1.51 0.00 0.00 179.97 176.28 3bdm n HIS 73 N -2.84 0.00 -3.73 2.20 1.44 -1.26 -1.16 115.22 109.86 3bdm n HIS 73 Ca -0.00 -0.72 -0.13 0.00 -2.01 0.00 0.00 57.72 54.86 3bdm n HIS 73 Cb 0.19 -0.10 -0.14 0.00 0.12 0.00 0.00 29.99 30.06 3bdm n HIS 73 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3bdm s ILE 74 N -1.86 -0.06 0.11 0.61 1.01 -1.03 -2.20 121.20 117.79 3bdm s ILE 74 Ca 0.15 0.17 -0.02 0.00 0.00 0.00 0.00 60.65 60.95 3bdm s ILE 74 Cb 0.13 -0.32 -0.04 0.00 0.01 0.00 0.00 42.46 42.25 3bdm s ILE 74 CO 0.01 0.07 0.07 -0.83 0.00 0.00 0.00 174.94 174.26 3bdm s GLY 75 N 1.28 0.78 0.14 6.18 0.00 -0.20 -0.03 107.32 115.47 3bdm s GLY 75 Ca -0.09 -1.31 -0.08 0.00 0.00 0.00 0.00 44.72 43.24 3bdm s GLY 75 CO -0.07 -1.27 0.24 0.00 0.00 0.00 0.00 173.10 171.99 3bdm s ALA 77 N -3.94 1.76 0.08 0.00 0.00 0.34 -1.84 121.76 118.16 3bdm s ALA 77 Ca 0.14 -1.00 0.10 0.00 0.00 0.00 0.00 51.96 51.20 3bdm s ALA 77 Cb 0.04 -0.38 -0.03 0.00 0.00 0.00 0.00 23.12 22.74 3bdm s ALA 77 CO -0.03 0.41 -0.25 0.00 0.00 0.00 0.00 175.76 175.89 3bdm s MET 78 N -0.91 1.70 -0.02 0.00 0.23 -0.87 -0.33 119.30 119.09 3bdm s MET 78 Ca 0.08 -1.18 0.01 0.00 -1.03 0.00 0.00 55.69 53.57 3bdm s MET 78 Cb -0.09 -1.99 0.02 0.00 -1.53 0.00 0.00 34.83 31.24 3bdm s MET 78 CO 0.01 0.49 -0.02 0.45 -2.03 0.00 0.00 175.02 173.92 3bdm s SER 79 N -1.59 0.54 0.00 -1.18 0.15 -0.81 -4.88 113.70 105.92 3bdm s SER 79 Ca 0.13 -0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.72 3bdm s SER 79 Cb -0.10 -0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.00 3bdm s SER 79 CO 0.04 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.06 3bdm n GLY 80 N 3.69 0.25 3.55 9.45 0.00 -1.26 -1.11 105.19 119.75 3bdm n GLY 80 Ca -0.22 -1.89 -0.38 0.00 0.00 0.00 0.00 46.02 43.54 3bdm n GLY 80 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3bdm s LEU 81 N 0.00 3.29 0.33 0.99 1.43 0.11 -4.78 118.68 120.06 3bdm s LEU 81 Ca 0.00 0.34 0.17 0.00 -1.03 0.00 0.00 54.13 53.62 3bdm s LEU 81 Cb 0.00 -2.53 0.42 0.00 0.03 0.00 0.00 46.19 44.11 3bdm s LEU 81 CO 0.00 -2.44 1.61 0.71 0.23 0.00 0.00 176.35 176.46 3bdm h THR 82 N 6.97 0.86 0.00 5.49 1.35 -1.89 -3.02 112.91 122.67 3bdm h THR 82 Ca -0.24 -1.83 -0.00 0.00 -0.55 0.00 0.00 66.41 63.79 3bdm h THR 82 Cb 1.16 2.15 -0.00 0.00 -1.73 0.00 0.00 68.15 69.73 3bdm h THR 82 CO 1.21 0.42 -0.01 0.00 -0.25 0.00 0.00 175.52 176.89 3bdm h ALA 83 N 1.57 1.69 -0.32 6.62 0.00 -1.98 -0.46 119.26 126.38 3bdm h ALA 83 Ca -0.00 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3bdm h ALA 83 Cb 1.11 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 3bdm h ALA 83 CO 0.06 0.02 -0.15 -0.44 0.00 0.00 0.00 179.25 178.73 3bdm h ASP 84 N 0.00 0.55 0.32 0.00 3.45 -1.92 -3.01 116.42 115.80 3bdm h ASP 84 Ca -0.00 -0.16 -0.01 0.00 0.43 0.00 0.00 57.03 57.29 3bdm h ASP 84 Cb 0.03 -0.15 -0.00 0.00 -0.56 0.00 0.00 39.33 38.65 3bdm h ASP 84 CO 0.00 0.72 -0.07 0.00 -1.57 0.00 0.00 179.24 178.33 3bdm h ALA 85 N 1.33 1.23 -0.27 3.45 0.00 -1.20 -3.30 119.26 120.51 3bdm h ALA 85 Ca 0.09 -0.06 0.05 0.00 0.00 0.00 0.00 54.91 54.99 3bdm h ALA 85 Cb 0.56 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.26 3bdm h ALA 85 CO 0.04 0.08 -0.44 0.00 0.00 0.00 0.00 179.25 178.93 3bdm h ARG 86 N 0.00 -0.40 0.00 0.00 2.47 -1.58 0.10 114.38 114.96 3bdm h ARG 86 Ca -0.00 0.03 -0.02 0.00 -1.26 0.00 0.00 59.98 58.73 3bdm h ARG 86 Cb 0.25 0.09 -0.00 0.00 -1.65 0.00 0.00 29.97 28.66 3bdm h ARG 86 CO 0.01 -0.27 -0.07 0.66 0.56 0.00 0.00 179.97 180.86 3bdm h SER 87 N -0.42 0.00 0.05 7.04 4.64 -1.81 -1.69 113.55 121.36 3bdm h SER 87 Ca 0.10 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.20 3bdm h SER 87 Cb 0.61 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.71 3bdm h SER 87 CO -0.49 0.07 -0.82 0.24 -0.87 0.00 0.00 176.83 174.96 3bdm h MET 88 N 0.00 0.62 -0.11 4.77 2.86 -1.31 -2.22 114.93 119.55 3bdm h MET 88 Ca -0.00 -0.55 -0.02 0.00 -2.06 0.00 0.00 59.70 57.07 3bdm h MET 88 Cb 0.38 0.13 -0.00 0.00 0.06 0.00 0.00 31.60 32.16 3bdm h MET 88 CO 0.01 1.17 -0.01 0.82 1.06 0.00 0.00 176.91 179.96 3bdm h ILE 89 N 0.41 1.27 -0.38 -1.22 1.08 -0.36 -0.20 117.51 118.11 3bdm h ILE 89 Ca -0.06 -0.86 0.06 0.00 -0.39 0.00 0.00 64.86 63.61 3bdm h ILE 89 Cb 1.44 1.63 -0.06 0.00 -3.07 0.00 0.00 36.82 36.77 3bdm h ILE 89 CO 0.16 0.25 0.04 -0.08 -0.69 0.00 0.00 178.15 177.82 3bdm h GLU 90 N -0.10 0.15 -0.09 2.37 4.57 -1.37 0.15 114.58 120.25 3bdm h GLU 90 Ca 0.03 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.20 3bdm h GLU 90 Cb 0.39 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.94 3bdm h GLU 90 CO 0.01 0.10 0.05 1.25 -1.18 0.00 0.00 179.01 179.24 3bdm h HIS 91 N 0.15 0.12 -0.76 0.92 2.76 -1.32 -0.39 115.15 116.63 3bdm h HIS 91 Ca 0.19 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.41 3bdm h HIS 91 Cb 0.24 -0.04 -0.06 0.00 1.55 0.00 0.00 27.41 29.11 3bdm h HIS 91 CO -0.23 0.12 0.46 0.00 -1.30 0.00 0.00 177.93 176.98 3bdm h ALA 92 N 0.99 1.03 -0.25 5.26 0.00 -0.39 0.13 119.26 126.03 3bdm h ALA 92 Ca 0.03 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3bdm h ALA 92 Cb 0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3bdm h ALA 92 CO -0.01 0.19 -0.05 0.00 0.00 0.00 0.00 179.25 179.38 3bdm h ARG 93 N 0.85 0.47 -0.33 0.00 3.08 -0.52 -1.11 114.38 116.82 3bdm h ARG 93 Ca 0.33 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 60.21 3bdm h ARG 93 Cb 0.14 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 3bdm h ARG 93 CO -0.16 0.69 0.22 1.15 -1.07 0.00 0.00 179.97 180.79 3bdm h THR 94 N 0.22 1.08 -0.80 2.04 2.02 -0.76 -0.82 112.91 115.90 3bdm h THR 94 Ca 0.06 -0.15 0.05 0.00 0.77 0.00 0.00 66.41 67.14 3bdm h THR 94 Cb 0.50 0.59 -0.05 0.00 -1.74 0.00 0.00 68.15 67.45 3bdm h THR 94 CO 0.02 0.08 0.49 0.00 0.37 0.00 0.00 175.52 176.49 3bdm h ALA 95 N 1.12 1.07 -0.24 6.16 0.00 -0.59 0.44 119.26 127.23 3bdm h ALA 95 Ca 0.12 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.97 3bdm h ALA 95 Cb -0.05 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3bdm h ALA 95 CO -0.03 0.25 -0.05 0.00 0.00 0.00 0.00 179.25 179.43 3bdm h ALA 96 N 1.37 0.32 -0.41 0.00 0.00 -0.67 -1.03 119.26 118.84 3bdm h ALA 96 Ca 0.34 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 3bdm h ALA 96 Cb 0.11 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3bdm h ALA 96 CO -0.15 0.11 -0.29 0.28 0.00 0.00 0.00 179.25 179.20 3bdm h VAL 97 N 0.19 1.28 -0.13 0.00 2.07 -0.92 -2.87 116.25 115.87 3bdm h VAL 97 Ca 0.06 -1.45 -0.01 0.00 0.82 0.00 0.00 66.70 66.12 3bdm h VAL 97 Cb 0.50 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 3bdm h VAL 97 CO 0.02 0.49 0.06 0.74 0.02 0.00 0.00 177.57 178.90 3bdm h THR 98 N 0.73 1.14 -0.78 2.57 2.02 -0.10 -1.11 112.91 117.38 3bdm h THR 98 Ca 0.08 -0.41 0.14 0.00 0.77 0.00 0.00 66.41 67.00 3bdm h THR 98 Cb 0.87 1.17 -0.05 0.00 -1.74 0.00 0.00 68.15 68.40 3bdm h THR 98 CO 0.08 0.13 0.52 -0.74 0.37 0.00 0.00 175.52 175.87 3bdm h HIS 99 N 0.06 0.57 -0.30 3.16 6.17 -1.17 -0.12 115.15 123.52 3bdm h HIS 99 Ca 0.04 0.02 -0.14 0.00 0.71 0.00 0.00 60.37 61.00 3bdm h HIS 99 Cb 0.15 -0.18 -0.00 0.00 2.52 0.00 0.00 27.41 29.89 3bdm h HIS 99 CO -0.02 0.22 -0.35 -0.97 0.71 0.00 0.00 177.93 177.52 3bdm h ASN 100 N 0.49 0.83 -0.74 3.26 -0.73 -1.15 -0.41 115.58 117.13 3bdm h ASN 100 Ca 0.38 -0.49 0.05 0.00 1.87 0.00 0.00 56.30 58.12 3bdm h ASN 100 Cb 0.79 -0.23 -0.05 0.00 0.27 0.00 0.00 38.32 39.09 3bdm h ASN 100 CO -0.14 1.15 0.45 0.25 -0.37 0.00 0.00 177.43 178.77 3bdm h LEU 101 N 0.53 0.71 0.00 0.34 5.85 0.18 0.31 115.31 123.22 3bdm h LEU 101 Ca 0.04 0.01 -0.19 0.00 0.84 0.00 0.00 57.88 58.59 3bdm h LEU 101 Cb 0.93 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 3bdm h LEU 101 CO 0.08 0.47 -1.02 1.88 -0.34 0.00 0.00 178.44 179.51 3bdm h TYR 102 N 0.84 0.00 -0.01 1.25 0.05 -1.27 -3.38 116.97 114.46 3bdm h TYR 102 Ca 0.32 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.10 3bdm h TYR 102 Cb 0.12 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.86 3bdm h TYR 102 CO -0.05 0.81 0.00 0.66 -1.05 0.00 0.00 178.16 178.53 3bdm n TYR 103 N -3.21 0.00 -3.80 4.88 4.02 -0.17 -5.01 117.16 113.87 3bdm n TYR 103 Ca -0.03 -0.03 -0.29 0.00 -0.01 0.00 0.00 57.90 57.53 3bdm n TYR 103 Cb 0.89 -0.00 0.02 0.00 -0.02 0.00 0.00 39.34 40.22 3bdm n TYR 103 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 3bdm n ASP 104 N 0.06 -3.11 -3.57 7.72 4.64 0.11 -4.95 116.55 117.44 3bdm n ASP 104 Ca 0.01 -1.01 -0.06 0.00 -1.38 0.00 0.00 54.79 52.35 3bdm n ASP 104 Cb 0.06 -3.25 -0.02 0.00 -1.04 0.00 0.00 41.12 36.87 3bdm n ASP 104 CO 0.00 0.00 0.00 -1.83 -0.82 0.00 0.00 177.20 174.55 3bdm s GLU 105 N -6.24 0.77 0.39 -0.67 -1.05 -1.25 -5.08 118.70 105.58 3bdm s GLU 105 Ca 0.27 -0.33 -0.24 0.00 -0.15 0.00 0.00 54.97 54.51 3bdm s GLU 105 Cb -0.10 0.33 -0.09 0.00 -0.44 0.00 0.00 34.13 33.83 3bdm s GLU 105 CO 0.87 -0.34 1.06 -0.51 0.95 0.00 0.00 175.26 177.29 3bdm s ASP 106 N -2.55 6.76 0.08 0.83 -0.00 -1.26 -3.77 116.67 116.75 3bdm s ASP 106 Ca 0.08 2.08 -0.30 0.00 -0.00 0.00 0.00 52.55 54.41 3bdm s ASP 106 Cb -0.01 -2.59 -0.05 0.00 -0.00 0.00 0.00 42.92 40.27 3bdm s ASP 106 CO -0.06 -0.49 1.03 -0.51 -0.00 0.00 0.00 175.17 175.13 3bdm s ILE 107 N -1.60 4.45 0.21 0.77 1.10 -1.26 -4.99 121.20 119.88 3bdm s ILE 107 Ca 0.57 1.90 -0.30 0.00 -0.51 0.00 0.00 60.65 62.31 3bdm s ILE 107 Cb -0.24 -4.22 -0.09 0.00 0.15 0.00 0.00 42.46 38.06 3bdm s ILE 107 CO 0.30 0.23 1.39 0.20 -2.11 0.00 0.00 174.94 174.95 3bdm s ASN 108 N 0.48 6.76 0.35 4.50 0.02 -1.26 -4.86 114.94 120.93 3bdm s ASN 108 Ca 0.51 2.53 0.14 0.00 -1.02 0.00 0.00 52.86 55.03 3bdm s ASN 108 Cb -0.24 -2.61 1.02 0.00 0.02 0.00 0.00 41.25 39.44 3bdm s ASN 108 CO 0.30 -0.64 1.72 0.58 0.02 0.00 0.00 177.10 179.08 3bdm h VAL 109 N 3.70 0.46 -0.27 1.60 2.07 -1.94 0.03 116.25 121.90 3bdm h VAL 109 Ca -0.45 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 66.84 3bdm h VAL 109 Cb 1.21 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 3bdm h VAL 109 CO 0.79 0.08 -0.14 -0.08 0.02 0.00 0.00 177.57 178.25 3bdm h GLU 110 N 0.45 0.57 -0.79 1.57 4.81 -1.99 -2.18 114.58 117.01 3bdm h GLU 110 Ca 0.66 -0.25 -0.04 0.00 -0.13 0.00 0.00 59.36 59.60 3bdm h GLU 110 Cb 1.48 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 30.81 3bdm h GLU 110 CO -0.44 0.82 0.34 0.77 -0.73 0.00 0.00 179.01 179.77 3bdm h SER 111 N 0.30 1.07 -0.40 1.04 0.02 -1.43 0.42 113.55 114.56 3bdm h SER 111 Ca 0.06 -0.16 0.02 0.00 -0.84 0.00 0.00 61.79 60.87 3bdm h SER 111 Cb 0.65 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.89 3bdm h SER 111 CO 0.04 0.93 0.22 0.25 -1.14 0.00 0.00 176.83 177.13 3bdm h LEU 112 N 1.13 0.35 0.42 5.07 7.12 -1.13 0.82 115.31 129.09 3bdm h LEU 112 Ca 0.27 0.01 -0.02 0.00 0.13 0.00 0.00 57.88 58.27 3bdm h LEU 112 Cb 0.17 -0.06 0.00 0.00 -0.53 0.00 0.00 40.66 40.25 3bdm h LEU 112 CO -0.03 0.25 -0.21 0.74 -0.13 0.00 0.00 178.44 179.06 3bdm h THR 113 N 0.45 0.57 -0.74 1.05 2.02 -0.69 -2.34 112.91 113.23 3bdm h THR 113 Ca 0.16 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.51 3bdm h THR 113 Cb 0.03 0.57 -0.05 0.00 -1.74 0.00 0.00 68.15 66.97 3bdm h THR 113 CO -0.09 0.00 0.50 -0.61 0.37 0.00 0.00 175.52 175.69 3bdm h GLN 114 N -0.58 0.30 -0.41 6.66 5.75 0.11 -1.29 115.11 125.66 3bdm h GLN 114 Ca -0.06 -0.02 -0.05 0.00 -0.15 0.00 0.00 58.65 58.38 3bdm h GLN 114 Cb 0.45 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.91 3bdm h GLN 114 CO 0.09 0.20 0.07 1.03 -2.65 0.00 0.00 178.83 177.57 3bdm h SER 115 N 0.31 0.64 -0.56 -0.69 0.87 -0.31 -2.71 113.55 111.09 3bdm h SER 115 Ca 0.37 -0.25 -0.07 0.00 -1.23 0.00 0.00 61.79 60.60 3bdm h SER 115 Cb 0.98 -0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.75 3bdm h SER 115 CO -0.10 0.73 0.07 0.58 -0.53 0.00 0.00 176.83 177.58 3bdm h VAL 116 N 0.52 1.26 0.00 2.23 2.07 -0.91 -2.75 116.25 118.66 3bdm h VAL 116 Ca 0.12 -1.01 -0.01 0.00 0.82 0.00 0.00 66.70 66.62 3bdm h VAL 116 Cb 0.36 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 3bdm h VAL 116 CO 0.01 0.37 -0.07 0.00 0.02 0.00 0.00 177.57 177.90 3bdm h ASP 118 N 0.00 0.00 0.71 0.00 3.45 -1.17 -2.48 116.42 116.94 3bdm h ASP 118 Ca -0.00 0.00 -0.26 0.00 0.43 0.00 0.00 57.03 57.20 3bdm h ASP 118 Cb 0.19 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 38.93 3bdm h ASP 118 CO 0.01 0.00 -1.38 -0.07 -1.57 0.00 0.00 179.24 176.23 3bdm h LEU 119 N 0.00 0.03 -0.19 1.55 3.38 -1.47 -3.41 115.31 115.20 3bdm h LEU 119 Ca 0.00 -0.05 0.02 0.00 0.09 0.00 0.00 57.88 57.94 3bdm h LEU 119 Cb 0.41 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3bdm h LEU 119 CO 0.00 1.04 -0.11 0.00 0.09 0.00 0.00 178.44 179.46 3bdm n ALA 120 N -2.47 -0.12 1.98 1.53 0.00 -0.93 -1.15 120.51 119.34 3bdm n ALA 120 Ca -0.09 0.16 0.06 0.00 0.00 0.00 0.00 53.44 53.57 3bdm n ALA 120 Cb 1.00 0.24 0.38 0.00 0.00 0.00 0.00 19.45 21.07 3bdm n ALA 120 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3bdm n LEU 121 N -3.31 0.00 -3.28 0.00 4.77 -1.26 -4.54 117.00 109.39 3bdm n LEU 121 Ca 0.00 0.00 -0.30 0.00 -0.03 0.00 0.00 56.01 55.69 3bdm n LEU 121 Cb 0.05 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 3bdm n LEU 121 CO -0.03 0.00 2.66 0.54 -1.33 0.00 0.00 177.39 179.23 3bdm n ARG 122 N -0.70 2.54 -4.06 3.23 1.74 -0.30 -4.85 116.66 114.26 3bdm n ARG 122 Ca 0.10 -1.76 -0.08 0.00 -0.77 0.00 0.00 57.85 55.34 3bdm n ARG 122 Cb 0.04 -2.63 -0.09 0.00 -1.02 0.00 0.00 32.46 28.76 3bdm n ARG 122 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 3bdm s PHE 123 N 3.17 0.54 -5.00 -1.55 -0.71 -1.26 -4.02 117.98 109.15 3bdm s PHE 123 Ca 0.50 -1.02 0.00 0.00 -1.04 0.00 0.00 56.93 55.37 3bdm s PHE 123 Cb 0.13 -0.35 0.00 0.00 -1.21 0.00 0.00 43.02 41.59 3bdm s PHE 123 CO -0.03 -0.45 0.00 0.41 -1.34 0.00 0.00 175.22 173.81 3bdm n GLY 12 N 0.02 0.19 0.11 1.99 0.00 -0.58 -4.78 105.19 102.14 3bdm n GLY 12 Ca -0.12 -1.50 0.01 0.00 0.00 0.00 0.00 46.02 44.41 3bdm n GLY 12 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3bdm n GLU 12 N 0.00 0.93 0.00 1.61 1.02 -1.26 -4.45 120.64 118.48 3bdm n GLU 12 Ca 0.00 -1.11 0.00 0.00 -0.02 0.00 0.00 57.16 56.03 3bdm n GLU 12 Cb 0.00 -0.75 0.00 0.00 -0.02 0.00 0.00 31.44 30.67 3bdm n GLU 12 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3bdm n GLY 12 N -0.31 0.00 3.63 0.62 0.00 -1.26 -5.13 105.19 102.74 3bdm n GLY 12 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 3bdm n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3bdm s ALA 12 N 0.00 3.14 -0.43 4.61 0.00 -1.26 -4.88 121.76 122.94 3bdm s ALA 12 Ca 0.00 0.95 -0.23 0.00 0.00 0.00 0.00 51.96 52.68 3bdm s ALA 12 Cb 0.00 -3.95 -0.23 0.00 0.00 0.00 0.00 23.12 18.93 3bdm s ALA 12 CO 0.00 -2.19 1.75 0.43 0.00 0.00 0.00 175.76 175.75 3bdm n SER 12 N 9.59 1.92 0.00 0.00 7.64 -1.26 -3.81 113.62 127.70 3bdm n SER 12 Ca 0.24 -2.55 0.00 0.00 1.01 0.00 0.00 58.87 57.57 3bdm n SER 12 Cb 0.43 -0.84 0.00 0.00 -1.01 0.00 0.00 64.21 62.80 3bdm n SER 12 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3bdm n GLY 12 N 4.64 0.44 0.00 0.23 0.00 -1.26 -5.13 105.19 104.11 3bdm n GLY 12 Ca 0.46 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.48 3bdm n GLY 12 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3bdm n GLU 12 N 0.00 0.00 -3.03 1.61 2.13 -1.25 -5.02 120.64 115.08 3bdm n GLU 12 Ca 0.00 0.00 -0.17 0.00 0.66 0.00 0.00 57.16 57.65 3bdm n GLU 12 Cb 0.00 0.00 -0.02 0.00 0.27 0.00 0.00 31.44 31.69 3bdm n GLU 12 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 3bdm n GLU 125 N 0.00 1.22 -2.01 5.31 2.13 -1.26 -4.98 120.64 121.05 3bdm n GLU 125 Ca 0.00 -3.47 -0.26 0.00 0.66 0.00 0.00 57.16 54.08 3bdm n GLU 125 Cb 0.00 -1.64 -0.05 0.00 0.27 0.00 0.00 31.44 30.02 3bdm n GLU 125 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 3bdm s ARG 126 N -2.69 2.49 -0.33 5.31 3.03 -1.26 -4.93 118.95 120.56 3bdm s ARG 126 Ca 0.38 -0.19 -0.11 0.00 2.03 0.00 0.00 55.73 57.84 3bdm s ARG 126 Cb 0.37 -5.01 -0.00 0.00 -1.03 0.00 0.00 34.95 29.28 3bdm s ARG 126 CO -0.06 -3.43 0.19 -1.17 -1.13 0.00 0.00 175.30 169.70 3bdm s LEU 127 N 10.40 4.36 0.00 -1.89 2.96 -1.26 -3.95 118.68 129.31 3bdm s LEU 127 Ca 0.72 -0.59 0.00 0.00 -0.22 0.00 0.00 54.13 54.04 3bdm s LEU 127 Cb -0.07 -2.05 0.00 0.00 0.50 0.00 0.00 46.19 44.57 3bdm s LEU 127 CO 0.01 -0.25 0.00 0.80 -1.32 0.00 0.00 176.35 175.59 3bdm n MET 128 N 5.03 0.00 0.07 1.98 1.56 -1.26 -4.92 117.12 119.57 3bdm n MET 128 Ca -0.13 0.00 -0.01 0.00 -0.27 0.00 0.00 57.70 57.29 3bdm n MET 128 Cb 0.49 0.00 0.28 0.00 2.15 0.00 0.00 33.22 36.14 3bdm n MET 128 CO 0.00 0.00 0.00 0.66 -0.73 0.00 0.00 175.97 175.90 3bdm h SER 129 N 0.00 0.34 -5.50 6.12 4.64 -1.90 -1.55 113.55 115.70 3bdm h SER 129 Ca 0.00 -0.10 -0.30 0.00 -0.47 0.00 0.00 61.79 60.92 3bdm h SER 129 Cb 0.00 -0.09 -0.15 0.00 -0.31 0.00 0.00 62.40 61.85 3bdm h SER 129 CO 0.00 0.57 -0.59 0.00 -0.87 0.00 0.00 176.83 175.93 3bdm s ARG 130 N -4.56 1.34 0.91 4.77 1.70 -1.26 -4.33 118.95 117.51 3bdm s ARG 130 Ca -0.06 -1.72 -0.13 0.00 -0.47 0.00 0.00 55.73 53.34 3bdm s ARG 130 Cb 0.14 0.21 0.14 0.00 -0.57 0.00 0.00 34.95 34.88 3bdm s ARG 130 CO 0.76 -0.43 1.18 -2.14 -1.08 0.00 0.00 175.30 173.59 3bdm s PRO 131 N -4.01 1.15 0.28 3.89 0.02 -1.26 -4.87 135.00 130.19 3bdm s PRO 131 Ca 0.39 0.11 -0.29 0.00 0.02 0.00 0.00 61.00 61.23 3bdm s PRO 131 Cb 0.06 -1.86 -0.09 0.00 0.02 0.00 0.00 34.50 32.63 3bdm s PRO 131 CO 0.15 -2.16 1.02 -0.06 -0.33 0.00 0.00 177.00 175.62 3bdm s PHE 132 N -3.44 3.73 -0.53 6.54 2.99 -1.26 -4.95 117.98 121.06 3bdm s PHE 132 Ca 0.65 1.79 0.02 0.00 0.00 0.00 0.00 56.93 59.39 3bdm s PHE 132 Cb -0.12 -3.12 0.54 0.00 0.00 0.00 0.00 43.02 40.32 3bdm s PHE 132 CO 0.52 -0.09 1.89 0.41 -0.00 0.00 0.00 175.22 177.95 3bdm n GLY 133 N 1.20 5.31 3.05 4.36 0.00 -1.26 -4.65 105.19 113.20 3bdm n GLY 133 Ca -0.01 -1.78 -0.11 0.00 0.00 0.00 0.00 46.02 44.12 3bdm n GLY 133 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3bdm s VAL 134 N -4.10 0.06 0.29 1.61 0.11 -1.26 0.05 120.40 117.16 3bdm s VAL 134 Ca 0.59 -0.47 0.08 0.00 -2.93 0.00 0.00 61.98 59.25 3bdm s VAL 134 Cb 0.48 -0.32 -0.04 0.00 -1.53 0.00 0.00 36.38 34.98 3bdm s VAL 134 CO 0.04 -0.26 0.16 0.00 -3.33 0.00 0.00 175.10 171.71 3bdm s ALA 135 N -0.87 3.53 0.04 1.54 0.00 -0.27 -4.37 121.76 121.36 3bdm s ALA 135 Ca -0.10 -1.59 0.03 0.00 0.00 0.00 0.00 51.96 50.30 3bdm s ALA 135 Cb -0.06 -1.06 -0.02 0.00 0.00 0.00 0.00 23.12 21.99 3bdm s ALA 135 CO 0.01 0.17 -0.09 -0.51 0.00 0.00 0.00 175.76 175.34 3bdm s LEU 136 N -3.84 2.24 -0.26 0.00 1.43 -0.62 -1.93 118.68 115.70 3bdm s LEU 136 Ca 0.35 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 52.93 3bdm s LEU 136 Cb -0.06 -0.25 0.04 0.00 0.03 0.00 0.00 46.19 45.95 3bdm s LEU 136 CO 0.24 -0.15 -0.08 -0.76 0.23 0.00 0.00 176.35 175.83 3bdm s LEU 137 N -1.47 3.34 -0.20 1.79 1.43 0.56 -1.31 118.68 122.82 3bdm s LEU 137 Ca -0.07 -1.11 -0.06 0.00 -1.03 0.00 0.00 54.13 51.85 3bdm s LEU 137 Cb -0.09 -1.62 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 3bdm s LEU 137 CO 0.01 -0.17 0.03 -0.63 0.23 0.00 0.00 176.35 175.82 3bdm s ILE 138 N 1.23 4.31 -0.00 -0.59 1.01 0.17 -0.50 121.20 126.83 3bdm s ILE 138 Ca -0.04 -0.19 0.03 0.00 0.00 0.00 0.00 60.65 60.45 3bdm s ILE 138 Cb -0.18 -2.95 -0.01 0.00 0.01 0.00 0.00 42.46 39.33 3bdm s ILE 138 CO -0.05 0.43 -0.09 0.00 0.00 0.00 0.00 174.94 175.24 3bdm s ALA 139 N 0.80 0.71 0.00 9.38 0.00 -0.14 0.87 121.76 133.38 3bdm s ALA 139 Ca 0.02 -0.38 -0.07 0.00 0.00 0.00 0.00 51.96 51.52 3bdm s ALA 139 Cb -0.14 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 22.83 3bdm s ALA 139 CO 0.02 0.17 0.33 0.41 0.00 0.00 0.00 175.76 176.69 3bdm n GLY 140 N 2.83 0.61 2.96 0.00 0.00 -0.60 -1.04 105.19 109.95 3bdm n GLY 140 Ca -0.14 -0.90 -0.11 0.00 0.00 0.00 0.00 46.02 44.87 3bdm n GLY 140 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3bdm s HIS 141 N -3.10 0.28 0.03 1.61 2.46 -0.93 -0.07 115.29 115.56 3bdm s HIS 141 Ca 0.08 -0.36 -0.16 0.00 0.47 0.00 0.00 55.06 55.09 3bdm s HIS 141 Cb -0.00 -0.19 0.03 0.00 -0.13 0.00 0.00 32.58 32.29 3bdm s HIS 141 CO 0.00 -0.11 0.36 0.16 -2.47 0.00 0.00 174.74 172.68 3bdm s ASP 142 N -1.02 -0.21 0.41 9.88 3.84 -0.84 -4.85 116.67 123.88 3bdm s ASP 142 Ca -0.10 -0.05 0.23 0.00 -0.00 0.00 0.00 52.55 52.63 3bdm s ASP 142 Cb -0.07 0.38 1.27 0.00 -1.38 0.00 0.00 42.92 43.12 3bdm s ASP 142 CO -0.00 -0.61 1.69 0.00 -0.00 0.00 0.00 175.17 176.24 3bdm h ALA 143 N 3.22 1.09 0.07 2.11 0.00 -1.98 -0.48 119.26 123.29 3bdm h ALA 143 Ca -0.31 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.32 3bdm h ALA 143 Cb 1.20 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 3bdm h ALA 143 CO 0.44 -0.09 -1.50 -0.44 0.00 0.00 0.00 179.25 177.66 3bdm h ASP 144 N 0.00 0.23 0.00 0.00 5.19 -2.01 -3.42 116.42 116.41 3bdm h ASP 144 Ca 0.00 -0.75 -0.08 0.00 -0.62 0.00 0.00 57.03 55.58 3bdm h ASP 144 Cb 0.24 -0.08 -0.18 0.00 0.18 0.00 0.00 39.33 39.50 3bdm h ASP 144 CO 0.00 1.63 -0.73 0.47 -3.12 0.00 0.00 179.24 177.49 3bdm n ASP 14 N -4.01 1.33 0.00 6.45 9.92 -1.19 -5.12 116.55 123.95 3bdm n ASP 14 Ca -0.30 -2.91 0.00 0.00 -0.53 0.00 0.00 54.79 51.06 3bdm n ASP 14 Cb 0.85 -0.41 0.00 0.00 -0.64 0.00 0.00 41.12 40.92 3bdm n ASP 14 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3bdm n GLY 145 N -0.33 2.25 3.73 0.44 0.00 -0.20 -4.58 105.19 106.51 3bdm n GLY 145 Ca 0.12 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 3bdm n GLY 145 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3bdm s TYR 146 N 0.00 3.46 -0.01 1.61 2.02 -1.26 -1.99 117.35 121.19 3bdm s TYR 146 Ca 0.00 1.44 -0.04 0.00 -0.37 0.00 0.00 57.07 58.10 3bdm s TYR 146 Cb 0.00 -3.40 -0.00 0.00 -0.40 0.00 0.00 41.96 38.16 3bdm s TYR 146 CO 0.00 -1.09 0.08 -0.65 -1.57 0.00 0.00 175.55 172.32 3bdm s GLN 147 N -0.04 0.32 -0.05 -0.62 -0.21 0.89 -4.98 119.66 114.97 3bdm s GLN 147 Ca 0.53 -0.27 0.04 0.00 0.02 0.00 0.00 55.36 55.67 3bdm s GLN 147 Cb -0.31 0.13 0.00 0.00 1.00 0.00 0.00 33.01 33.83 3bdm s GLN 147 CO 0.35 -0.07 -0.15 -1.17 -2.12 0.00 0.00 175.29 172.13 3bdm s LEU 148 N -0.93 1.84 0.05 2.90 2.96 -1.26 -1.56 118.68 122.68 3bdm s LEU 148 Ca -0.10 -0.34 0.04 0.00 -0.22 0.00 0.00 54.13 53.52 3bdm s LEU 148 Cb -0.06 -0.92 -0.02 0.00 0.50 0.00 0.00 46.19 45.69 3bdm s LEU 148 CO 0.00 0.11 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.66 3bdm s PHE 149 N 0.25 1.12 -0.22 5.38 0.08 0.25 -2.15 117.98 122.69 3bdm s PHE 149 Ca -0.08 -0.40 -0.00 0.00 0.12 0.00 0.00 56.93 56.57 3bdm s PHE 149 Cb -0.13 -0.66 0.02 0.00 -0.57 0.00 0.00 43.02 41.69 3bdm s PHE 149 CO 0.03 0.03 -0.11 -1.58 -0.10 0.00 0.00 175.22 173.49 3bdm s HIS 150 N -1.03 2.99 -0.15 0.36 5.65 0.12 -0.65 115.29 122.57 3bdm s HIS 150 Ca -0.01 -1.62 -0.01 0.00 0.25 0.00 0.00 55.06 53.67 3bdm s HIS 150 Cb -0.09 -2.00 -0.01 0.00 -1.18 0.00 0.00 32.58 29.30 3bdm s HIS 150 CO 0.01 -0.75 -0.10 0.00 -0.65 0.00 0.00 174.74 173.25 3bdm s ALA 151 N 1.30 2.72 0.34 1.58 0.00 -0.43 -1.93 121.76 125.34 3bdm s ALA 151 Ca 0.01 -0.94 0.09 0.00 0.00 0.00 0.00 51.96 51.12 3bdm s ALA 151 Cb -0.16 -1.37 -0.06 0.00 0.00 0.00 0.00 23.12 21.54 3bdm s ALA 151 CO -0.07 0.09 0.00 -1.21 0.00 0.00 0.00 175.76 174.57 3bdm s GLU 152 N 0.61 2.05 0.00 0.00 2.02 -0.99 -1.58 118.70 120.80 3bdm s GLU 152 Ca -0.06 -1.78 0.04 0.00 0.02 0.00 0.00 54.97 53.19 3bdm s GLU 152 Cb -0.15 -1.90 0.18 0.00 0.10 0.00 0.00 34.13 32.36 3bdm s GLU 152 CO 0.03 0.13 1.08 -2.30 0.02 0.00 0.00 175.26 174.22 3bdm n PRO 153 N -0.94 0.02 0.05 0.39 -0.02 -1.26 -1.50 135.00 131.73 3bdm n PRO 153 Ca -0.04 0.38 -0.09 0.00 -2.02 0.00 0.00 63.50 61.73 3bdm n PRO 153 Cb 0.63 -1.50 0.04 0.00 -0.02 0.00 0.00 33.50 32.64 3bdm n PRO 153 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3bdm h SER 154 N 0.00 0.48 0.00 2.55 4.64 -1.92 -3.41 113.55 115.89 3bdm h SER 154 Ca 0.00 -0.30 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 3bdm h SER 154 Cb 0.06 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.01 3bdm h SER 154 CO 0.00 1.03 0.00 0.61 -0.87 0.00 0.00 176.83 177.60 3bdm n GLY 155 N 0.50 0.94 3.79 -0.77 0.00 -0.56 -4.54 105.19 104.55 3bdm n GLY 155 Ca -0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 3bdm n GLY 155 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3bdm s THR 156 N -2.00 3.50 -0.02 2.61 -4.23 -1.26 -4.75 115.64 109.49 3bdm s THR 156 Ca 0.00 -1.53 -0.16 0.00 -1.18 0.00 0.00 61.69 58.82 3bdm s THR 156 Cb 0.00 -3.12 0.03 0.00 1.34 0.00 0.00 72.50 70.75 3bdm s THR 156 CO 0.00 -0.22 0.35 0.72 -0.54 0.00 0.00 174.62 174.93 3bdm s PHE 157 N -2.32 -0.24 0.22 3.99 -0.12 -1.26 -2.36 117.98 115.89 3bdm s PHE 157 Ca 0.38 0.39 0.07 0.00 -0.05 0.00 0.00 56.93 57.72 3bdm s PHE 157 Cb -0.05 0.13 -0.05 0.00 -0.63 0.00 0.00 43.02 42.42 3bdm s PHE 157 CO 0.24 -0.40 -0.11 0.71 -0.05 0.00 0.00 175.22 175.61 3bdm s TYR 158 N -1.23 1.71 -0.11 3.49 2.02 -0.81 -4.95 117.35 117.47 3bdm s TYR 158 Ca -0.13 -0.64 -0.02 0.00 -0.37 0.00 0.00 57.07 55.92 3bdm s TYR 158 Cb -0.05 -0.86 -0.03 0.00 -0.40 0.00 0.00 41.96 40.63 3bdm s TYR 158 CO 0.05 0.29 -0.04 0.50 -1.57 0.00 0.00 175.55 174.78 3bdm s ARG 159 N -3.69 3.20 0.12 -0.62 3.52 -1.26 -0.70 118.95 119.52 3bdm s ARG 159 Ca 0.24 -0.51 0.06 0.00 -0.13 0.00 0.00 55.73 55.39 3bdm s ARG 159 Cb 0.01 -2.77 -0.04 0.00 -1.56 0.00 0.00 34.95 30.59 3bdm s ARG 159 CO 0.07 0.49 -0.15 0.71 -0.81 0.00 0.00 175.30 175.61 3bdm s TYR 160 N -0.31 1.45 -0.12 5.12 1.51 -0.91 -4.99 117.35 119.11 3bdm s TYR 160 Ca 0.05 -0.53 0.15 0.00 -1.01 0.00 0.00 57.07 55.73 3bdm s TYR 160 Cb -0.12 -0.76 -0.08 0.00 -0.11 0.00 0.00 41.96 40.89 3bdm s TYR 160 CO 0.02 0.16 1.06 -0.91 -1.11 0.00 0.00 175.55 174.77 3bdm h ASN 161 N 3.56 0.00 -4.13 2.29 -0.26 -1.92 -3.37 115.58 111.75 3bdm h ASN 161 Ca -0.40 0.00 -0.04 0.00 -0.56 0.00 0.00 56.30 55.29 3bdm h ASN 161 Cb 1.20 0.00 -0.21 0.00 -1.06 0.00 0.00 38.32 38.25 3bdm h ASN 161 CO 0.50 0.59 0.14 0.00 -1.06 0.00 0.00 177.43 177.60 3bdm s ALA 162 N -2.91 -1.78 -0.24 -0.83 0.00 -1.26 -0.59 121.76 114.15 3bdm s ALA 162 Ca -0.00 1.94 -0.26 0.00 0.00 0.00 0.00 51.96 53.63 3bdm s ALA 162 Cb 0.08 -1.03 0.07 0.00 0.00 0.00 0.00 23.12 22.25 3bdm s ALA 162 CO 0.79 -0.34 0.73 0.21 0.00 0.00 0.00 175.76 177.15 3bdm s LYS 163 N 0.18 0.86 -0.03 0.00 2.47 -0.13 -4.99 119.74 118.09 3bdm s LYS 163 Ca -0.01 0.87 0.04 0.00 -1.56 0.00 0.00 55.97 55.31 3bdm s LYS 163 Cb -0.04 0.42 -0.00 0.00 -1.46 0.00 0.00 37.83 36.74 3bdm s LYS 163 CO 0.02 -0.13 -0.14 0.00 0.16 0.00 0.00 175.35 175.26 3bdm s ALA 164 N 0.14 1.26 0.06 3.13 0.00 -1.26 -0.58 121.76 124.51 3bdm s ALA 164 Ca -0.01 -0.58 0.04 0.00 0.00 0.00 0.00 51.96 51.40 3bdm s ALA 164 Cb -0.04 -0.40 -0.03 0.00 0.00 0.00 0.00 23.12 22.65 3bdm s ALA 164 CO 0.02 0.25 -0.11 0.96 0.00 0.00 0.00 175.76 176.88 3bdm s ILE 165 N -0.03 0.84 0.00 0.00 -4.36 0.40 -4.72 121.20 113.33 3bdm s ILE 165 Ca -0.01 -1.27 0.00 0.00 -0.26 0.00 0.00 60.65 59.12 3bdm s ILE 165 Cb -0.09 -0.92 0.00 0.00 1.25 0.00 0.00 42.46 42.70 3bdm s ILE 165 CO 0.01 -0.35 0.00 0.61 0.24 0.00 0.00 174.94 175.45 3bdm n GLY 166 N 1.24 0.24 0.37 6.27 0.00 -1.26 -0.73 105.19 111.32 3bdm n GLY 166 Ca -0.21 -2.31 0.13 0.00 0.00 0.00 0.00 46.02 43.63 3bdm n GLY 166 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3bdm h SER 167 N 0.00 0.72 -0.21 1.61 4.64 -0.07 -2.22 113.55 118.02 3bdm h SER 167 Ca 0.00 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3bdm h SER 167 Cb 0.00 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.03 3bdm h SER 167 CO 0.00 0.30 0.00 0.61 -0.87 0.00 0.00 176.83 176.87 3bdm n GLY 168 N -1.38 1.16 0.29 -0.77 0.00 -1.26 -4.72 105.19 98.51 3bdm n GLY 168 Ca 0.21 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.49 3bdm n GLY 168 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3bdm h SER 169 N 4.08 -1.33 -0.97 1.61 4.64 -1.67 -0.89 113.55 119.01 3bdm h SER 169 Ca 0.00 0.19 0.25 0.00 -0.47 0.00 0.00 61.79 61.76 3bdm h SER 169 Cb 0.88 0.57 -0.18 0.00 -0.31 0.00 0.00 62.40 63.36 3bdm h SER 169 CO 0.00 -0.22 -0.03 1.05 -0.87 0.00 0.00 176.83 176.76 3bdm h GLU 170 N -0.15 0.02 0.01 4.77 9.09 -1.84 1.05 114.58 127.52 3bdm h GLU 170 Ca 0.07 -0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.44 3bdm h GLU 170 Cb 0.34 -0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.44 3bdm h GLU 170 CO -0.50 0.01 -0.18 0.78 0.05 0.00 0.00 179.01 179.17 3bdm h GLY 171 N 0.02 0.12 0.81 1.06 0.00 -1.87 -3.16 103.07 100.05 3bdm h GLY 171 Ca 0.56 -0.23 0.08 0.00 0.00 0.00 0.00 47.33 47.74 3bdm h GLY 171 CO -0.92 0.20 0.57 0.00 0.00 0.00 0.00 176.54 176.39 3bdm h ALA 172 N 0.18 1.58 -0.70 3.60 0.00 0.32 -0.27 119.26 123.96 3bdm h ALA 172 Ca -0.03 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 3bdm h ALA 172 Cb 1.00 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 3bdm h ALA 172 CO 0.04 0.27 0.24 0.37 0.00 0.00 0.00 179.25 180.16 3bdm h GLN 173 N 0.95 1.06 -0.79 0.00 5.75 0.98 -1.23 115.11 121.83 3bdm h GLN 173 Ca 0.39 -0.21 -0.01 0.00 -0.15 0.00 0.00 58.65 58.67 3bdm h GLN 173 Cb 0.29 -0.16 -0.04 0.00 1.07 0.00 0.00 27.48 28.64 3bdm h GLN 173 CO -0.16 0.89 0.44 0.00 -2.65 0.00 0.00 178.83 177.35 3bdm h ALA 174 N 1.23 1.01 0.36 3.38 0.00 -1.05 -0.00 119.26 124.19 3bdm h ALA 174 Ca 0.23 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3bdm h ALA 174 Cb 0.26 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3bdm h ALA 174 CO -0.01 0.52 -0.25 1.49 0.00 0.00 0.00 179.25 181.00 3bdm h GLU 175 N 1.09 -0.57 -0.93 0.00 4.57 -0.45 -2.66 114.58 115.62 3bdm h GLU 175 Ca 0.28 0.04 0.13 0.00 -1.18 0.00 0.00 59.36 58.62 3bdm h GLU 175 Cb 0.03 0.13 -0.09 0.00 -0.16 0.00 0.00 28.75 28.66 3bdm h GLU 175 CO -0.05 -0.38 0.56 -0.07 -1.18 0.00 0.00 179.01 177.89 3bdm h LEU 176 N -0.60 0.78 -1.15 1.64 3.38 -0.85 0.05 115.31 118.56 3bdm h LEU 176 Ca -0.03 0.06 0.25 0.00 0.09 0.00 0.00 57.88 58.25 3bdm h LEU 176 Cb 0.50 -0.09 -0.11 0.00 0.09 0.00 0.00 40.66 41.06 3bdm h LEU 176 CO 0.02 0.39 0.63 0.25 0.09 0.00 0.00 178.44 179.82 3bdm h LEU 177 N 0.86 0.59 0.01 1.67 7.12 -0.64 -0.33 115.31 124.59 3bdm h LEU 177 Ca 0.48 0.11 -0.24 0.00 0.13 0.00 0.00 57.88 58.36 3bdm h LEU 177 Cb 0.53 0.02 -0.03 0.00 -0.53 0.00 0.00 40.66 40.65 3bdm h LEU 177 CO -0.29 0.11 -1.30 0.78 -0.13 0.00 0.00 178.44 177.61 3bdm h ASN 178 N 0.52 0.03 -0.52 1.25 2.35 -1.08 -3.41 115.58 114.71 3bdm h ASN 178 Ca 0.62 -0.53 0.01 0.00 -0.55 0.00 0.00 56.30 55.84 3bdm h ASN 178 Cb 1.31 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 39.65 3bdm h ASN 178 CO -0.39 1.51 0.34 -0.33 -1.65 0.00 0.00 177.43 176.91 3bdm h GLU 179 N -0.94 0.67 -7.01 0.81 4.39 -0.80 -3.45 114.58 108.25 3bdm h GLU 179 Ca -0.35 -0.04 -0.53 0.00 0.34 0.00 0.00 59.36 58.77 3bdm h GLU 179 Cb 1.35 -0.15 0.10 0.00 -0.10 0.00 0.00 28.75 29.95 3bdm h GLU 179 CO -0.19 0.45 0.58 -0.46 -1.16 0.00 0.00 179.01 178.22 3bdm s TRP 180 N -6.15 2.57 0.00 4.33 -0.00 -0.16 -5.07 118.94 114.46 3bdm s TRP 180 Ca -0.13 1.42 0.00 0.00 -0.00 0.00 0.00 56.10 57.39 3bdm s TRP 180 Cb 0.12 -3.66 0.00 0.00 -0.00 0.00 0.00 33.47 29.94 3bdm s TRP 180 CO 0.74 -2.34 0.00 -2.39 -0.00 0.00 0.00 176.95 172.96 3bdm n HIS 18 N -0.61 0.00 -0.09 5.86 1.44 -1.26 -4.99 115.22 115.57 3bdm n HIS 18 Ca 0.08 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.79 3bdm n HIS 18 Cb 0.45 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.56 3bdm n HIS 18 CO 0.00 0.00 0.00 -1.13 -2.81 0.00 0.00 176.34 172.40 3bdm n SER 18 N 0.00 0.00 -4.71 4.39 3.41 -1.26 -4.94 113.62 110.50 3bdm n SER 18 Ca 0.00 0.00 -0.36 0.00 -0.26 0.00 0.00 58.87 58.25 3bdm n SER 18 Cb 0.00 -0.17 0.09 0.00 -0.26 0.00 0.00 64.21 63.86 3bdm n SER 18 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3bdm n LEU 184 N -0.09 5.49 -4.90 1.04 4.77 -1.26 -5.03 117.00 117.03 3bdm n LEU 184 Ca 0.00 0.75 -0.20 0.00 -0.03 0.00 0.00 56.01 56.53 3bdm n LEU 184 Cb 0.00 -1.54 -0.02 0.00 -2.33 0.00 0.00 43.42 39.53 3bdm n LEU 184 CO 0.00 -1.24 -0.02 0.42 -1.33 0.00 0.00 177.39 175.22 3bdm s THR 185 N -1.62 3.52 0.12 -5.08 -4.23 -1.26 -4.41 115.64 102.69 3bdm s THR 185 Ca 0.80 -1.25 -0.20 0.00 -1.18 0.00 0.00 61.69 59.86 3bdm s THR 185 Cb -0.35 -3.21 -0.07 0.00 1.34 0.00 0.00 72.50 70.22 3bdm s THR 185 CO 0.44 -0.14 1.75 0.25 -0.54 0.00 0.00 174.62 176.38 3bdm h LEU 186 N 1.09 0.10 -0.33 4.79 5.85 -1.92 -1.44 115.31 123.45 3bdm h LEU 186 Ca -0.44 0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.34 3bdm h LEU 186 Cb 1.26 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.24 3bdm h LEU 186 CO 0.56 0.09 0.04 0.11 -0.34 0.00 0.00 178.44 178.89 3bdm h LYS 187 N 0.17 0.14 -0.27 1.25 1.79 -1.98 0.36 116.57 118.02 3bdm h LYS 187 Ca 0.08 -0.01 0.06 0.00 -2.18 0.00 0.00 60.65 58.60 3bdm h LYS 187 Cb 0.03 -0.03 -0.07 0.00 -1.58 0.00 0.00 32.23 30.58 3bdm h LYS 187 CO -0.06 0.09 -0.16 0.93 -1.08 0.00 0.00 179.45 179.17 3bdm h GLU 188 N 0.14 -0.12 -0.72 3.15 5.08 -1.87 -0.48 114.58 119.76 3bdm h GLU 188 Ca 0.16 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.56 3bdm h GLU 188 Cb 0.19 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 3bdm h GLU 188 CO -0.23 -0.08 0.47 0.00 -1.00 0.00 0.00 179.01 178.17 3bdm h ALA 189 N 1.07 1.61 0.07 3.43 0.00 -0.66 0.42 119.26 125.20 3bdm h ALA 189 Ca 0.15 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.02 3bdm h ALA 189 Cb 0.35 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3bdm h ALA 189 CO -0.35 0.31 -0.04 0.93 0.00 0.00 0.00 179.25 180.10 3bdm h GLU 190 N 0.85 -0.10 -0.54 0.00 5.08 0.61 0.13 114.58 120.62 3bdm h GLU 190 Ca 0.29 0.01 -0.05 0.00 -1.00 0.00 0.00 59.36 58.61 3bdm h GLU 190 Cb 0.09 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 3bdm h GLU 190 CO -0.09 -0.03 0.14 -0.07 -1.00 0.00 0.00 179.01 177.96 3bdm h LEU 191 N -0.14 0.81 -0.38 1.33 -0.00 -0.79 -1.40 115.31 114.74 3bdm h LEU 191 Ca -0.01 -0.23 0.03 0.00 -0.00 0.00 0.00 57.88 57.67 3bdm h LEU 191 Cb 0.11 -0.21 -0.03 0.00 -0.00 0.00 0.00 40.66 40.53 3bdm h LEU 191 CO 0.02 0.83 0.17 0.25 -0.00 0.00 0.00 178.44 179.70 3bdm h LEU 192 N 0.75 0.23 -0.19 1.67 5.85 -0.73 0.51 115.31 123.41 3bdm h LEU 192 Ca 0.17 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 3bdm h LEU 192 Cb 0.33 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 3bdm h LEU 192 CO 0.00 0.17 0.11 0.58 -0.34 0.00 0.00 178.44 178.97 3bdm h VAL 193 N 0.35 1.09 -0.64 1.05 2.07 -0.85 -1.07 116.25 118.25 3bdm h VAL 193 Ca 0.16 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.46 3bdm h VAL 193 Cb 0.10 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.73 3bdm h VAL 193 CO -0.13 0.08 0.39 0.25 0.02 0.00 0.00 177.57 178.19 3bdm h LEU 194 N 0.22 0.75 -0.10 2.57 5.85 -0.74 -1.72 115.31 122.15 3bdm h LEU 194 Ca 0.07 -0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 3bdm h LEU 194 Cb 0.04 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 40.88 3bdm h LEU 194 CO -0.01 0.57 -0.09 0.50 -0.34 0.00 0.00 178.44 179.07 3bdm h LYS 195 N 0.88 0.23 -0.51 1.25 3.64 0.52 -2.62 116.57 119.96 3bdm h LYS 195 Ca 0.23 -0.12 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 3bdm h LYS 195 Cb -0.05 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 3bdm h LYS 195 CO -0.05 0.65 0.17 0.82 -2.27 0.00 0.00 179.45 178.77 3bdm h ILE 196 N -0.18 1.20 -0.68 2.00 2.04 -1.04 -1.66 117.51 119.20 3bdm h ILE 196 Ca 0.02 -0.67 -0.04 0.00 1.00 0.00 0.00 64.86 65.16 3bdm h ILE 196 Cb 0.61 0.64 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 3bdm h ILE 196 CO 0.02 0.26 0.25 -0.07 0.00 0.00 0.00 178.15 178.61 3bdm h LEU 197 N 0.73 0.93 -0.60 1.44 3.38 -1.31 -2.24 115.31 117.64 3bdm h LEU 197 Ca 0.17 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 3bdm h LEU 197 Cb 0.20 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 3bdm h LEU 197 CO -0.01 0.84 0.19 0.50 0.09 0.00 0.00 178.44 180.05 3bdm h LYS 198 N 0.98 0.93 0.28 1.13 3.64 -0.93 -1.12 116.57 121.48 3bdm h LYS 198 Ca 0.23 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 3bdm h LYS 198 Cb 0.22 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3bdm h LYS 198 CO -0.02 0.83 -0.13 1.96 -2.27 0.00 0.00 179.45 179.82 3bdm h GLN 199 N 0.85 -0.36 0.00 1.90 4.20 -1.10 -3.25 115.11 117.35 3bdm h GLN 199 Ca 0.19 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.93 3bdm h GLN 199 Cb 0.29 0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.15 3bdm h GLN 199 CO -0.01 -0.11 0.00 -0.39 -0.67 0.00 0.00 178.83 177.65 3bdm h VAL 200 N -0.57 0.00 -3.43 -0.54 -1.51 -1.44 -3.46 116.25 105.30 3bdm h VAL 200 Ca -0.04 -0.67 -0.52 0.00 -1.23 0.00 0.00 66.70 64.24 3bdm h VAL 200 Cb 0.42 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 31.22 3bdm h VAL 200 CO 0.06 0.00 0.49 -0.04 -1.23 0.00 0.00 177.57 176.85 3bdm s MET 201 N -3.32 4.54 0.41 5.19 -1.94 -0.43 -4.79 119.30 118.97 3bdm s MET 201 Ca 0.06 1.69 0.11 0.00 -1.71 0.00 0.00 55.69 55.84 3bdm s MET 201 Cb 0.08 -3.32 0.85 0.00 2.01 0.00 0.00 34.83 34.45 3bdm s MET 201 CO 0.59 -0.04 1.94 0.93 -0.01 0.00 0.00 175.02 178.43 3bdm h GLU 202 N 5.84 0.16 -6.68 2.03 4.39 -1.89 -3.44 114.58 114.99 3bdm h GLU 202 Ca -0.43 -0.04 -0.45 0.00 0.34 0.00 0.00 59.36 58.79 3bdm h GLU 202 Cb 1.21 -0.02 0.03 0.00 -0.10 0.00 0.00 28.75 29.87 3bdm h GLU 202 CO 0.75 0.31 -0.11 -1.21 -1.16 0.00 0.00 179.01 177.59 3bdm s GLU 205 N -4.70 2.88 -0.24 2.33 0.41 -1.26 -5.04 118.70 113.08 3bdm s GLU 205 Ca -0.05 -0.70 -0.29 0.00 -0.41 0.00 0.00 54.97 53.52 3bdm s GLU 205 Cb 0.16 -2.58 0.01 0.00 -1.78 0.00 0.00 34.13 29.94 3bdm s GLU 205 CO 0.72 -0.38 1.06 0.21 -0.49 0.00 0.00 175.26 176.38 3bdm s LYS 206 N -4.57 4.23 0.11 1.61 2.20 -1.26 -4.96 119.74 117.09 3bdm s LYS 206 Ca 0.51 1.34 -0.31 0.00 -0.36 0.00 0.00 55.97 57.16 3bdm s LYS 206 Cb -0.10 -3.66 -0.10 0.00 -1.51 0.00 0.00 37.83 32.46 3bdm s LYS 206 CO 0.37 -0.68 1.79 -1.17 -0.36 0.00 0.00 175.35 175.30 3bdm s LEU 207 N 3.30 4.39 0.24 5.43 0.20 -1.26 -4.92 118.68 126.05 3bdm s LEU 207 Ca 0.45 2.69 -0.08 0.00 0.69 0.00 0.00 54.13 57.89 3bdm s LEU 207 Cb -0.15 -3.56 -0.02 0.00 -0.43 0.00 0.00 46.19 42.03 3bdm s LEU 207 CO 0.08 -0.98 0.35 1.51 -0.29 0.00 0.00 176.35 177.02 3bdm s ASP 208 N 2.68 0.06 -0.38 3.68 -4.77 -1.26 -5.07 116.67 111.61 3bdm s ASP 208 Ca 0.79 -1.13 -0.05 0.00 -3.30 0.00 0.00 52.55 48.86 3bdm s ASP 208 Cb -0.44 0.52 -0.14 0.00 -1.09 0.00 0.00 42.92 41.77 3bdm s ASP 208 CO 0.35 -1.04 2.48 -1.84 0.70 0.00 0.00 175.17 175.82 3bdm n GLU 209 N -0.35 1.73 0.00 2.11 0.00 -1.26 -3.09 120.64 119.77 3bdm n GLU 209 Ca -0.00 -1.01 0.00 0.00 0.00 0.00 0.00 57.16 56.15 3bdm n GLU 209 Cb 0.63 -2.08 0.00 0.00 0.00 0.00 0.00 31.44 29.99 3bdm n GLU 209 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 3bdm n ASN 20 N 3.16 0.00 -4.07 -1.84 0.23 -1.26 -4.78 115.26 106.70 3bdm n ASN 20 Ca 0.37 0.00 -0.08 0.00 -0.53 0.00 0.00 54.58 54.34 3bdm n ASN 20 Cb 0.45 0.00 -0.10 0.00 -2.08 0.00 0.00 39.78 38.05 3bdm n ASN 20 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3bdm s ALA 210 N 0.00 0.49 -0.27 -2.53 0.00 -1.18 -0.39 121.76 117.87 3bdm s ALA 210 Ca 0.00 -1.19 -0.21 0.00 0.00 0.00 0.00 51.96 50.56 3bdm s ALA 210 Cb 0.00 0.45 0.08 0.00 0.00 0.00 0.00 23.12 23.65 3bdm s ALA 210 CO 0.00 -0.42 0.71 -1.14 0.00 0.00 0.00 175.76 174.91 3bdm s GLN 211 N -3.94 0.77 0.47 0.00 0.74 -0.92 -4.82 119.66 111.96 3bdm s GLN 211 Ca 0.11 1.09 0.06 0.00 0.05 0.00 0.00 55.36 56.67 3bdm s GLN 211 Cb 0.07 0.28 -0.01 0.00 1.10 0.00 0.00 33.01 34.45 3bdm s GLN 211 CO -0.07 -0.12 0.23 -0.51 -0.55 0.00 0.00 175.29 174.27 3bdm s LEU 212 N 0.95 2.84 0.00 3.68 1.43 -1.26 -1.85 118.68 124.47 3bdm s LEU 212 Ca -0.04 -1.22 0.00 0.00 -1.03 0.00 0.00 54.13 51.83 3bdm s LEU 212 Cb -0.05 -1.26 0.00 0.00 0.03 0.00 0.00 46.19 44.91 3bdm s LEU 212 CO -0.09 -0.79 0.00 -1.54 0.23 0.00 0.00 176.35 174.17 3bdm n SER 213 N -1.43 0.00 -3.42 2.29 3.41 -0.98 -2.13 113.62 111.36 3bdm n SER 213 Ca -0.04 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.49 3bdm n SER 213 Cb 0.65 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.60 3bdm n SER 213 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3bdm s ILE 215 N -3.11 0.76 0.05 0.00 1.10 -0.73 -1.08 121.20 118.20 3bdm s ILE 215 Ca 0.13 -0.18 0.06 0.00 -0.51 0.00 0.00 60.65 60.16 3bdm s ILE 215 Cb -0.05 -0.79 -0.02 0.00 0.15 0.00 0.00 42.46 41.74 3bdm s ILE 215 CO 0.09 0.30 -0.16 0.42 -2.11 0.00 0.00 174.94 173.48 3bdm s THR 216 N 1.39 1.30 0.52 4.00 -4.23 -1.04 -1.86 115.64 115.73 3bdm s THR 216 Ca -0.02 -1.14 0.19 0.00 -1.18 0.00 0.00 61.69 59.53 3bdm s THR 216 Cb -0.13 -1.18 0.31 0.00 1.34 0.00 0.00 72.50 72.83 3bdm s THR 216 CO -0.03 0.02 2.11 0.50 -0.54 0.00 0.00 174.62 176.67 3bdm h LYS 217 N 4.75 0.00 0.05 3.99 3.64 -1.89 0.47 116.57 127.57 3bdm h LYS 217 Ca -0.40 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 58.89 3bdm h LYS 217 Cb 1.18 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.01 3bdm h LYS 217 CO 0.43 0.00 -0.35 0.37 -2.27 0.00 0.00 179.45 177.63 3bdm h GLN 218 N 0.00 0.15 -0.07 1.90 4.15 -1.97 -3.38 115.11 115.89 3bdm h GLN 218 Ca 0.07 -0.23 0.00 0.00 0.77 0.00 0.00 58.65 59.26 3bdm h GLN 218 Cb 0.27 0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.05 3bdm h GLN 218 CO -0.00 1.07 0.00 -0.25 -1.93 0.00 0.00 178.83 177.72 3bdm n ASP 219 N -4.41 2.02 0.00 -0.69 9.92 -1.17 -5.10 116.55 117.13 3bdm n ASP 219 Ca -0.11 -1.53 0.00 0.00 -0.53 0.00 0.00 54.79 52.62 3bdm n ASP 219 Cb 0.61 -0.04 0.00 0.00 -0.64 0.00 0.00 41.12 41.05 3bdm n ASP 219 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3bdm n GLY 220 N 0.54 0.24 3.65 0.44 0.00 0.16 -4.70 105.19 105.52 3bdm n GLY 220 Ca 0.07 -0.90 -0.43 0.00 0.00 0.00 0.00 46.02 44.76 3bdm n GLY 220 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3bdm s PHE 221 N 0.00 3.28 0.01 1.61 2.19 -0.31 -2.50 117.98 122.27 3bdm s PHE 221 Ca 0.00 1.35 0.03 0.00 0.33 0.00 0.00 56.93 58.64 3bdm s PHE 221 Cb 0.00 -3.35 -0.01 0.00 -1.31 0.00 0.00 43.02 38.34 3bdm s PHE 221 CO 0.00 -0.55 -0.09 0.15 1.83 0.00 0.00 175.22 176.56 3bdm s LYS 222 N 3.27 0.70 -0.24 10.12 -0.14 -0.24 -5.01 119.74 128.21 3bdm s LYS 222 Ca 0.43 -0.46 -0.06 0.00 -1.36 0.00 0.00 55.97 54.52 3bdm s LYS 222 Cb -0.14 -0.66 -0.02 0.00 -1.68 0.00 0.00 37.83 35.33 3bdm s LYS 222 CO 0.09 0.17 0.04 0.42 -0.76 0.00 0.00 175.35 175.31 3bdm s ILE 223 N -0.50 4.06 0.15 2.17 1.01 -1.26 -1.19 121.20 125.64 3bdm s ILE 223 Ca 0.01 -0.26 -0.32 0.00 0.00 0.00 0.00 60.65 60.08 3bdm s ILE 223 Cb -0.05 -2.89 -0.12 0.00 0.01 0.00 0.00 42.46 39.41 3bdm s ILE 223 CO 0.00 0.36 1.74 -1.22 0.00 0.00 0.00 174.94 175.82 3bdm n TYR 224 N 4.88 2.56 -2.12 3.97 0.53 -0.90 -4.96 117.16 121.11 3bdm n TYR 224 Ca -0.17 0.03 -0.32 0.00 -1.02 0.00 0.00 57.90 56.42 3bdm n TYR 224 Cb 0.51 -2.66 -0.00 0.00 -1.03 0.00 0.00 39.34 36.16 3bdm n TYR 224 CO 0.00 0.00 0.00 0.16 -1.02 0.00 0.00 176.86 176.00 3bdm s ASP 225 N 1.84 6.15 0.27 7.72 -4.77 -1.26 -4.64 116.67 121.98 3bdm s ASP 225 Ca 0.80 1.64 -0.05 0.00 -3.30 0.00 0.00 52.55 51.64 3bdm s ASP 225 Cb -0.56 -2.51 0.50 0.00 -1.09 0.00 0.00 42.92 39.26 3bdm s ASP 225 CO 0.37 -0.91 1.45 0.59 0.70 0.00 0.00 175.17 177.37 3bdm n ASN 226 N -2.04 -0.28 0.26 2.11 5.03 -1.26 -1.78 115.26 117.30 3bdm n ASN 226 Ca 0.07 1.59 -0.17 0.00 0.87 0.00 0.00 54.58 56.95 3bdm n ASN 226 Cb 0.54 -0.51 -0.09 0.00 -1.02 0.00 0.00 39.78 38.70 3bdm n ASN 226 CO 0.00 0.00 0.00 -0.33 -1.83 0.00 0.00 177.26 175.10 3bdm h GLU 227 N 0.00 -0.88 -0.97 3.52 3.07 -1.92 0.42 114.58 117.83 3bdm h GLU 227 Ca 0.48 0.06 0.19 0.00 -0.50 0.00 0.00 59.36 59.59 3bdm h GLU 227 Cb 0.80 0.20 -0.11 0.00 -0.84 0.00 0.00 28.75 28.80 3bdm h GLU 227 CO -0.94 -0.58 0.56 -0.22 -1.40 0.00 0.00 179.01 176.43 3bdm h LYS 228 N -0.91 0.67 0.23 2.33 3.64 -1.72 -2.17 116.57 118.64 3bdm h LYS 228 Ca -0.04 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 3bdm h LYS 228 Cb 0.81 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.48 3bdm h LYS 228 CO -0.09 0.44 -0.11 1.15 -2.27 0.00 0.00 179.45 178.58 3bdm h THR 229 N 0.69 0.79 -0.92 1.00 2.02 -1.07 -3.00 112.91 112.42 3bdm h THR 229 Ca 0.56 -0.84 0.26 0.00 0.77 0.00 0.00 66.41 67.16 3bdm h THR 229 Cb 0.90 1.22 -0.16 0.00 -1.74 0.00 0.00 68.15 68.37 3bdm h THR 229 CO -0.40 0.17 0.12 0.00 0.37 0.00 0.00 175.52 175.78 3bdm h ALA 230 N -0.22 1.22 0.13 6.16 0.00 0.41 0.11 119.26 127.07 3bdm h ALA 230 Ca -0.03 0.29 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3bdm h ALA 230 Cb 0.51 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3bdm h ALA 230 CO 0.05 -0.55 -0.06 0.93 0.00 0.00 0.00 179.25 179.62 3bdm h GLU 231 N 0.08 -0.17 -0.86 0.00 5.08 -1.44 -1.75 114.58 115.53 3bdm h GLU 231 Ca 0.58 0.01 0.16 0.00 -1.00 0.00 0.00 59.36 59.11 3bdm h GLU 231 Cb 1.20 0.04 -0.06 0.00 0.50 0.00 0.00 28.75 30.42 3bdm h GLU 231 CO -0.80 -0.02 0.56 -0.07 -1.00 0.00 0.00 179.01 177.69 3bdm h LEU 232 N -0.29 0.50 -0.22 1.33 3.38 -0.71 0.27 115.31 119.57 3bdm h LEU 232 Ca -0.02 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 3bdm h LEU 232 Cb 0.23 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 3bdm h LEU 232 CO 0.03 0.24 0.08 0.40 0.09 0.00 0.00 178.44 179.28 3bdm h ILE 233 N 0.52 1.18 0.28 1.22 2.04 -0.66 -1.20 117.51 120.90 3bdm h ILE 233 Ca 0.43 -0.55 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 3bdm h ILE 233 Cb 0.90 1.12 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 3bdm h ILE 233 CO -0.18 0.18 -0.14 0.50 0.00 0.00 0.00 178.15 178.52 3bdm h LYS 235 N 0.20 -0.36 -0.16 2.37 3.64 -0.06 -0.81 116.57 121.38 3bdm h LYS 235 Ca 0.07 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.53 3bdm h LYS 235 Cb 0.20 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 3bdm h LYS 235 CO -0.00 -0.23 0.23 1.49 -2.27 0.00 0.00 179.45 178.67 3bdm h GLU 236 N -0.40 0.00 0.12 1.90 4.81 -0.48 -1.46 114.58 119.07 3bdm h GLU 236 Ca -0.04 0.00 -0.17 0.00 -0.13 0.00 0.00 59.36 59.03 3bdm h GLU 236 Cb 0.30 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.70 3bdm h GLU 236 CO 0.06 0.00 -0.74 1.25 -0.73 0.00 0.00 179.01 178.85 3bdm h LEU 237 N 0.00 0.38 -0.74 1.64 7.12 -0.24 -2.97 115.31 120.50 3bdm h LEU 237 Ca 0.08 -0.95 0.04 0.00 0.13 0.00 0.00 57.88 57.18 3bdm h LEU 237 Cb 0.55 -0.12 -0.05 0.00 -0.53 0.00 0.00 40.66 40.50 3bdm h LEU 237 CO -0.00 1.35 0.46 0.50 -0.13 0.00 0.00 178.44 180.62 3bdm h LYS 238 N -0.47 0.84 0.47 1.25 3.64 -0.18 -1.89 116.57 120.23 3bdm h LYS 238 Ca -0.14 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.17 3bdm h LYS 238 Cb 1.55 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 3bdm h LYS 238 CO 0.12 0.56 -0.22 0.93 -2.27 0.00 0.00 179.45 178.56 3bdm h GLU 239 N 0.87 -0.60 0.00 1.90 5.08 -1.47 -1.48 114.58 118.87 3bdm h GLU 239 Ca 0.31 0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.70 3bdm h GLU 239 Cb 0.08 0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 3bdm h GLU 239 CO -0.14 -0.37 -0.04 0.87 -1.00 0.00 0.00 179.01 178.34 3bdm h LYS 240 N -0.70 0.00 0.02 2.33 1.57 -1.39 -1.45 116.57 116.94 3bdm h LYS 240 Ca -0.06 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3bdm h LYS 240 Cb 0.52 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.83 3bdm h LYS 240 CO 0.11 0.04 -0.01 0.93 -0.57 0.00 0.00 179.45 179.95 3bdm h GLU 241 N 0.00 -0.02 0.00 3.15 5.08 -1.05 -3.02 114.58 118.72 3bdm h GLU 241 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3bdm h GLU 241 Cb 0.13 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3bdm h GLU 241 CO 0.01 0.64 0.00 0.00 -1.00 0.00 0.00 179.01 178.65 3bdm h ALA 242 N 0.23 1.00 0.00 3.43 0.00 -0.99 -2.40 119.26 120.53 3bdm h ALA 242 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3bdm h ALA 242 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3bdm h ALA 242 CO 0.00 0.00 0.04 0.00 0.00 0.00 0.00 179.25 179.29 3bdm h ALA 243 N 2.12 1.03 0.00 0.00 0.00 -1.13 -3.51 119.26 117.77 3bdm h ALA 243 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3bdm h ALA 243 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3bdm h ALA 243 CO 0.00 -0.03 0.00 0.39 0.00 0.00 0.00 179.25 179.61