#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bm2 s VAL 17 N 0.00 5.29 0.00 1.39 1.01 0.13 -4.09 120.40 124.12 2bm2 s VAL 17 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.03 2bm2 s VAL 17 Cb 0.00 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.80 2bm2 s VAL 17 CO 0.00 0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.89 2bm2 n GLY 18 N 5.07 -1.82 7.00 4.51 0.00 -1.25 -1.74 105.19 116.96 2bm2 n GLY 18 Ca -0.14 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.20 2bm2 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bm2 n GLY 19 N 0.00 0.50 3.82 -0.02 0.00 -1.26 -4.76 105.19 103.47 2bm2 n GLY 19 Ca 0.00 -0.90 -0.04 0.00 0.00 0.00 0.00 46.02 45.08 2bm2 n GLY 19 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2bm2 s GLN 20 N 0.00 1.42 0.20 1.61 -2.07 -0.40 -4.99 119.66 115.43 2bm2 s GLN 20 Ca 0.00 -0.87 -0.30 0.00 -1.82 0.00 0.00 55.36 52.37 2bm2 s GLN 20 Cb 0.00 0.43 -0.08 0.00 -1.09 0.00 0.00 33.01 32.27 2bm2 s GLN 20 CO 0.00 -0.66 1.21 -1.21 -1.32 0.00 0.00 175.29 173.31 2bm2 s GLU 21 N -2.66 4.48 0.45 9.60 2.02 -1.26 -0.88 118.70 130.44 2bm2 s GLU 21 Ca 0.17 1.91 -0.23 0.00 0.02 0.00 0.00 54.97 56.84 2bm2 s GLU 21 Cb -0.03 -3.22 -0.08 0.00 0.10 0.00 0.00 34.13 30.91 2bm2 s GLU 21 CO 0.05 -0.09 1.17 0.00 0.02 0.00 0.00 175.26 176.41 2bm2 s ALA 22 N -0.17 3.02 0.55 5.21 0.00 -0.01 -4.84 121.76 125.51 2bm2 s ALA 22 Ca 0.52 0.95 -0.19 0.00 0.00 0.00 0.00 51.96 53.24 2bm2 s ALA 22 Cb -0.33 -3.38 -0.06 0.00 0.00 0.00 0.00 23.12 19.34 2bm2 s ALA 22 CO 0.38 -0.63 1.10 -2.14 0.00 0.00 0.00 175.76 174.46 2bm2 s PRO 23 N -2.60 3.40 0.66 0.00 0.02 -1.26 -4.86 135.00 130.35 2bm2 s PRO 23 Ca 0.62 1.49 0.31 0.00 0.02 0.00 0.00 61.00 63.44 2bm2 s PRO 23 Cb -0.29 -2.02 1.67 0.00 0.02 0.00 0.00 34.50 33.87 2bm2 s PRO 23 CO 0.36 -0.79 1.95 0.00 -0.33 0.00 0.00 177.00 178.19 2bm2 h ARG 24 N 1.09 0.00 -0.01 5.54 3.08 -2.00 -0.21 114.38 121.88 2bm2 h ARG 24 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2bm2 h ARG 24 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2bm2 h ARG 24 CO 0.57 0.00 -0.20 -1.13 -1.07 0.00 0.00 179.97 178.14 2bm2 n SER 25 N -2.99 0.83 -4.87 7.04 3.41 -1.26 -4.92 113.62 110.85 2bm2 n SER 25 Ca -0.01 -0.77 -0.25 0.00 -0.26 0.00 0.00 58.87 57.57 2bm2 n SER 25 Cb 0.38 0.06 -0.04 0.00 -0.26 0.00 0.00 64.21 64.35 2bm2 n SER 25 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2bm2 s LYS 26 N -2.49 3.16 -1.13 4.33 -0.14 -0.09 -4.75 119.74 118.62 2bm2 s LYS 26 Ca 0.26 -0.78 -0.10 0.00 -1.36 0.00 0.00 55.97 53.99 2bm2 s LYS 26 Cb 0.20 -2.78 -0.03 0.00 -1.68 0.00 0.00 37.83 33.53 2bm2 s LYS 26 CO 0.50 0.48 0.85 0.91 -0.76 0.00 0.00 175.35 177.33 2bm2 n TRP 27 N -0.62 -2.17 0.32 3.18 5.03 -1.26 -4.84 117.44 117.08 2bm2 n TRP 27 Ca -0.08 0.72 0.21 0.00 3.03 0.00 0.00 57.50 61.38 2bm2 n TRP 27 Cb 0.55 -3.98 1.09 0.00 -1.03 0.00 0.00 31.31 27.95 2bm2 n TRP 27 CO 0.00 0.00 0.00 -1.00 -0.03 0.00 0.00 177.69 176.66 2bm2 h PRO 28 N -1.54 0.00 -0.00 -0.99 0.13 -1.85 -2.69 132.00 125.06 2bm2 h PRO 28 Ca -0.63 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 2bm2 h PRO 28 Cb 1.34 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.47 2bm2 h PRO 28 CO 0.48 0.00 -0.29 -2.67 -0.23 0.00 0.00 178.00 175.29 2bm2 n TRP 29 N -3.10 0.00 -2.06 1.56 2.14 -1.13 -3.39 117.44 111.46 2bm2 n TRP 29 Ca -0.02 0.00 -0.41 0.00 2.07 0.00 0.00 57.50 59.14 2bm2 n TRP 29 Cb 0.13 -0.34 -0.02 0.00 -0.81 0.00 0.00 31.31 30.26 2bm2 n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 2bm2 s GLN 30 N -2.98 4.30 0.28 -2.67 2.00 -1.02 -0.41 119.66 119.17 2bm2 s GLN 30 Ca 0.13 2.26 0.02 0.00 -2.00 0.00 0.00 55.36 55.77 2bm2 s GLN 30 Cb 0.18 -3.10 -0.05 0.00 0.80 0.00 0.00 33.01 30.84 2bm2 s GLN 30 CO 0.62 -0.34 0.09 0.14 -0.50 0.00 0.00 175.29 175.31 2bm2 s VAL 31 N -0.38 0.71 -0.04 1.34 -7.23 -0.50 -1.36 120.40 112.94 2bm2 s VAL 31 Ca 0.56 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.76 2bm2 s VAL 31 Cb -0.41 -2.66 0.00 0.00 0.56 0.00 0.00 36.38 33.87 2bm2 s VAL 31 CO 0.46 0.00 -0.14 -0.55 -0.31 0.00 0.00 175.10 174.57 2bm2 s SER 32 N -3.37 1.80 -0.04 4.85 0.15 0.17 -2.85 113.70 114.40 2bm2 s SER 32 Ca 0.37 -0.29 -0.18 0.00 0.70 0.00 0.00 55.95 56.55 2bm2 s SER 32 Cb 0.08 -0.58 -0.05 0.00 -1.71 0.00 0.00 66.02 63.76 2bm2 s SER 32 CO 0.14 0.10 0.48 -0.76 1.20 0.00 0.00 173.24 174.41 2bm2 s LEU 33 N 0.24 4.39 -0.07 3.45 1.43 0.88 -0.47 118.68 128.53 2bm2 s LEU 33 Ca -0.06 0.97 0.04 0.00 -1.03 0.00 0.00 54.13 54.05 2bm2 s LEU 33 Cb -0.12 -2.72 -0.00 0.00 0.03 0.00 0.00 46.19 43.38 2bm2 s LEU 33 CO 0.02 0.15 -0.21 -0.13 0.23 0.00 0.00 176.35 176.41 2bm2 s ARG 34 N -0.24 2.41 -0.01 1.70 1.81 0.58 -0.79 118.95 124.41 2bm2 s ARG 34 Ca 0.26 -0.75 0.01 0.00 -1.72 0.00 0.00 55.73 53.54 2bm2 s ARG 34 Cb -0.17 -1.95 -0.03 0.00 -0.45 0.00 0.00 34.95 32.35 2bm2 s ARG 34 CO 0.13 0.23 -0.01 0.54 -0.68 0.00 0.00 175.30 175.50 2bm2 s VAL 35 N 0.19 4.06 0.05 3.52 0.11 0.42 -0.24 120.40 128.50 2bm2 s VAL 35 Ca -0.11 -0.60 -0.30 0.00 -2.93 0.00 0.00 61.98 58.05 2bm2 s VAL 35 Cb -0.15 -2.79 -0.04 0.00 -1.53 0.00 0.00 36.38 31.87 2bm2 s VAL 35 CO 0.05 0.41 1.00 -2.28 -3.33 0.00 0.00 175.10 170.95 2bm2 s HIS 36 N -1.04 3.69 0.00 1.54 2.46 0.31 -2.21 115.29 120.03 2bm2 s HIS 36 Ca 0.18 1.70 0.00 0.00 0.47 0.00 0.00 55.06 57.41 2bm2 s HIS 36 Cb -0.11 -3.13 0.00 0.00 -0.13 0.00 0.00 32.58 29.21 2bm2 s HIS 36 CO 0.09 -0.07 0.00 0.41 -2.47 0.00 0.00 174.74 172.70 2bm2 n GLY 37 N 2.64 1.98 0.49 1.59 0.00 -1.26 -4.96 105.19 105.68 2bm2 n GLY 37 Ca 0.05 -0.06 0.37 0.00 0.00 0.00 0.00 46.02 46.37 2bm2 n GLY 37 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bm2 h PRO 37 N 0.00 0.10 -3.16 1.61 0.13 -2.04 -3.41 132.00 125.24 2bm2 h PRO 37 Ca 0.00 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.10 2bm2 h PRO 37 Cb 0.00 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.08 2bm2 h PRO 37 CO 0.00 0.07 0.19 1.52 -0.23 0.00 0.00 178.00 179.55 2bm2 s TYR 37 N -5.25 0.16 -1.28 1.56 1.13 -1.26 -5.07 117.35 107.34 2bm2 s TYR 37 Ca -0.07 -0.72 -0.16 0.00 -1.41 0.00 0.00 57.07 54.71 2bm2 s TYR 37 Cb 0.28 0.68 0.10 0.00 -1.10 0.00 0.00 41.96 41.92 2bm2 s TYR 37 CO 0.83 -1.41 1.68 0.91 -2.51 0.00 0.00 175.55 175.04 2bm2 n TRP 38 N -0.51 4.67 -2.36 -3.49 7.02 -1.26 -4.63 117.44 116.88 2bm2 n TRP 38 Ca -0.06 -2.99 -0.41 0.00 -1.02 0.00 0.00 57.50 53.02 2bm2 n TRP 38 Cb 0.60 -2.50 -0.03 0.00 -2.42 0.00 0.00 31.31 26.96 2bm2 n TRP 38 CO 0.00 0.00 0.00 1.41 -2.02 0.00 0.00 177.69 177.08 2bm2 s MET 39 N 3.36 4.49 0.17 -0.99 1.75 -0.94 -4.66 119.30 122.47 2bm2 s MET 39 Ca 0.50 1.89 -0.30 0.00 -1.25 0.00 0.00 55.69 56.53 2bm2 s MET 39 Cb 0.03 -3.23 -0.08 0.00 2.84 0.00 0.00 34.83 34.39 2bm2 s MET 39 CO 0.05 -0.08 1.24 -1.58 -0.65 0.00 0.00 175.02 174.00 2bm2 s HIS 40 N -0.16 3.37 0.00 4.11 2.46 -1.26 -0.44 115.29 123.38 2bm2 s HIS 40 Ca 0.52 1.32 0.00 0.00 0.47 0.00 0.00 55.06 57.38 2bm2 s HIS 40 Cb -0.33 -3.49 0.00 0.00 -0.13 0.00 0.00 32.58 28.63 2bm2 s HIS 40 CO 0.38 -1.47 0.00 1.97 -2.47 0.00 0.00 174.74 173.15 2bm2 n PHE 41 N 2.83 0.00 -3.63 3.88 -1.74 0.03 -4.92 117.46 113.90 2bm2 n PHE 41 Ca 0.06 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.87 2bm2 n PHE 41 Cb 0.44 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.42 2bm2 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2bm2 n GLY 43 N -0.39 2.26 3.39 0.00 0.00 0.78 -0.09 105.19 111.15 2bm2 n GLY 43 Ca -0.09 -2.21 0.03 0.00 0.00 0.00 0.00 46.02 43.74 2bm2 n GLY 43 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bm2 n GLY 44 N 0.59 0.26 2.97 -0.02 0.00 -1.13 -3.40 105.19 104.44 2bm2 n GLY 44 Ca 0.06 -1.01 -0.10 0.00 0.00 0.00 0.00 46.02 44.98 2bm2 n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2bm2 s SER 45 N -3.43 0.22 -0.22 1.61 1.04 -0.52 -1.41 113.70 110.98 2bm2 s SER 45 Ca 0.26 -0.43 -0.23 0.00 0.48 0.00 0.00 55.95 56.03 2bm2 s SER 45 Cb -0.01 0.08 -0.01 0.00 0.10 0.00 0.00 66.02 66.18 2bm2 s SER 45 CO -0.01 -0.25 0.75 -0.22 0.98 0.00 0.00 173.24 174.49 2bm2 s LEU 46 N -1.24 4.11 0.00 2.42 2.96 0.45 0.09 118.68 127.47 2bm2 s LEU 46 Ca -0.13 0.96 0.05 0.00 -0.22 0.00 0.00 54.13 54.78 2bm2 s LEU 46 Cb -0.08 -3.08 0.03 0.00 0.50 0.00 0.00 46.19 43.56 2bm2 s LEU 46 CO -0.01 -0.42 0.62 2.30 -1.32 0.00 0.00 176.35 177.52 2bm2 n ILE 47 N 5.04 0.00 -3.61 6.68 -5.35 -0.28 -1.14 119.36 120.71 2bm2 n ILE 47 Ca 0.03 -0.49 -0.11 0.00 -0.27 0.00 0.00 62.75 61.90 2bm2 n ILE 47 Cb 0.48 1.09 -0.06 0.00 -1.74 0.00 0.00 39.64 39.41 2bm2 n ILE 47 CO 0.00 0.00 0.00 -2.28 -1.76 0.00 0.00 176.55 172.51 2bm2 s HIS 48 N -0.44 -0.49 0.58 4.28 5.04 -1.16 -4.69 115.29 118.42 2bm2 s HIS 48 Ca 0.05 1.07 0.40 0.00 -1.54 0.00 0.00 55.06 55.04 2bm2 s HIS 48 Cb 0.04 0.38 1.43 0.00 0.04 0.00 0.00 32.58 34.47 2bm2 s HIS 48 CO 0.06 -0.31 1.53 -1.35 -2.34 0.00 0.00 174.74 172.33 2bm2 h PRO 49 N 3.66 0.00 -0.07 2.88 0.11 -1.94 0.94 132.00 137.58 2bm2 h PRO 49 Ca -0.25 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.86 2bm2 h PRO 49 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2bm2 h PRO 49 CO 0.19 0.00 0.00 0.94 -0.21 0.00 0.00 178.00 178.92 2bm2 n GLN 50 N -3.72 1.76 -4.14 1.05 7.27 -1.26 -0.27 117.38 118.08 2bm2 n GLN 50 Ca 0.33 -1.32 -0.18 0.00 0.07 0.00 0.00 57.00 55.89 2bm2 n GLN 50 Cb 1.68 -1.07 -0.16 0.00 2.41 0.00 0.00 30.24 33.11 2bm2 n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 2bm2 s TRP 51 N -0.75 0.59 -0.11 3.69 0.52 0.32 -1.05 118.94 122.14 2bm2 s TRP 51 Ca 0.05 -0.13 -0.02 0.00 0.02 0.00 0.00 56.10 56.03 2bm2 s TRP 51 Cb 0.03 -0.50 -0.03 0.00 -1.15 0.00 0.00 33.47 31.82 2bm2 s TRP 51 CO 0.04 -0.11 -0.04 0.14 0.02 0.00 0.00 176.95 177.00 2bm2 s VAL 52 N 0.56 3.92 -0.18 4.03 -7.23 -0.67 -1.12 120.40 119.70 2bm2 s VAL 52 Ca -0.07 -0.37 -0.11 0.00 -1.81 0.00 0.00 61.98 59.62 2bm2 s VAL 52 Cb -0.10 -2.67 -0.05 0.00 0.56 0.00 0.00 36.38 34.12 2bm2 s VAL 52 CO -0.00 0.55 0.20 -0.22 -0.31 0.00 0.00 175.10 175.31 2bm2 s LEU 53 N -0.26 4.23 0.00 1.32 0.20 0.11 -1.89 118.68 122.39 2bm2 s LEU 53 Ca 0.04 0.36 0.02 0.00 0.69 0.00 0.00 54.13 55.24 2bm2 s LEU 53 Cb -0.13 -2.20 -0.01 0.00 -0.43 0.00 0.00 46.19 43.42 2bm2 s LEU 53 CO 0.02 0.16 0.15 1.07 -0.29 0.00 0.00 176.35 177.46 2bm2 n THR 54 N 3.46 0.00 -3.62 3.68 5.66 -0.51 -1.44 114.28 121.50 2bm2 n THR 54 Ca -0.15 -0.97 -0.37 0.00 -3.05 0.00 0.00 64.05 59.51 2bm2 n THR 54 Cb 0.52 0.51 -0.06 0.00 -1.55 0.00 0.00 70.33 69.75 2bm2 n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2bm2 s ALA 55 N -2.44 3.71 0.40 1.79 0.00 -1.26 -1.10 121.76 122.86 2bm2 s ALA 55 Ca 0.16 -0.41 0.09 0.00 0.00 0.00 0.00 51.96 51.79 2bm2 s ALA 55 Cb 0.00 -2.27 0.87 0.00 0.00 0.00 0.00 23.12 21.72 2bm2 s ALA 55 CO 0.11 0.39 2.00 0.00 0.00 0.00 0.00 175.76 178.26 2bm2 h ALA 56 N 5.45 1.79 0.00 0.00 0.00 -1.67 -2.42 119.26 122.41 2bm2 h ALA 56 Ca -0.49 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 2bm2 h ALA 56 Cb 1.20 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 2bm2 h ALA 56 CO 0.65 0.12 -0.06 1.12 0.00 0.00 0.00 179.25 181.09 2bm2 h HIS 57 N 0.58 0.00 -0.17 0.00 2.07 -1.88 0.29 115.15 116.04 2bm2 h HIS 57 Ca 0.24 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.71 2bm2 h HIS 57 Cb 0.22 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.18 2bm2 h HIS 57 CO -0.00 0.06 -0.14 0.00 -3.07 0.00 0.00 177.93 174.78 2bm2 n VAL 59 N -4.25 0.84 -3.42 0.00 0.24 -0.50 -5.03 118.33 106.21 2bm2 n VAL 59 Ca -0.00 -0.88 0.00 0.00 -2.04 0.00 0.00 64.34 61.42 2bm2 n VAL 59 Cb 0.29 0.54 0.00 0.00 -1.47 0.00 0.00 33.84 33.19 2bm2 n VAL 59 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2bm2 n GLY 60 N -0.47 3.15 0.14 7.63 0.00 0.90 -4.53 105.19 112.01 2bm2 n GLY 60 Ca 0.02 -1.32 0.13 0.00 0.00 0.00 0.00 46.02 44.84 2bm2 n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2bm2 h PRO 60 N 0.00 0.00 -6.73 1.61 0.13 -1.81 -3.41 132.00 121.79 2bm2 h PRO 60 Ca 0.00 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.63 2bm2 h PRO 60 Cb 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.12 2bm2 h PRO 60 CO 0.00 0.00 0.39 -0.51 -0.23 0.00 0.00 178.00 177.65 2bm2 s ASP 60 N -4.72 7.51 0.21 1.44 1.11 -1.26 -4.98 116.67 115.97 2bm2 s ASP 60 Ca 0.07 2.02 -0.32 0.00 0.18 0.00 0.00 52.55 54.50 2bm2 s ASP 60 Cb 0.10 -2.61 -0.12 0.00 1.07 0.00 0.00 42.92 41.37 2bm2 s ASP 60 CO 0.53 0.03 1.68 -0.69 1.18 0.00 0.00 175.17 177.90 2bm2 s VAL 60 N -0.96 2.14 0.31 -1.27 1.01 -1.26 -5.00 120.40 115.38 2bm2 s VAL 60 Ca 0.43 0.10 0.07 0.00 0.00 0.00 0.00 61.98 62.59 2bm2 s VAL 60 Cb -0.27 -3.07 -0.03 0.00 0.00 0.00 0.00 36.38 33.01 2bm2 s VAL 60 CO 0.34 0.01 0.29 -0.54 0.00 0.00 0.00 175.10 175.20 2bm2 s LYS 60 N 1.04 2.84 -0.29 2.72 3.01 -1.26 -5.08 119.74 122.71 2bm2 s LYS 60 Ca 0.73 -1.19 -0.29 0.00 -1.01 0.00 0.00 55.97 54.21 2bm2 s LYS 60 Cb -0.48 -2.55 0.01 0.00 -1.01 0.00 0.00 37.83 33.80 2bm2 s LYS 60 CO 0.33 0.17 1.08 0.34 0.51 0.00 0.00 175.35 177.78 2bm2 s ASP 60 N -3.98 6.96 0.34 2.83 -1.08 -1.26 -4.95 116.67 115.53 2bm2 s ASP 60 Ca 0.39 1.16 0.05 0.00 -0.52 0.00 0.00 52.55 53.63 2bm2 s ASP 60 Cb -0.07 -2.54 0.68 0.00 -1.46 0.00 0.00 42.92 39.53 2bm2 s ASP 60 CO 0.27 -0.83 1.93 -0.07 0.52 0.00 0.00 175.17 176.99 2bm2 h LEU 61 N 9.95 0.74 -1.06 -1.34 4.07 -1.97 -2.07 115.31 123.64 2bm2 h LEU 61 Ca -0.20 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.77 2bm2 h LEU 61 Cb 1.06 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 42.66 2bm2 h LEU 61 CO 1.02 0.46 0.00 0.00 -1.08 0.00 0.00 178.44 178.84 2bm2 h ALA 62 N 1.57 1.00 -0.50 1.53 0.00 -1.92 -2.75 119.26 118.19 2bm2 h ALA 62 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 2bm2 h ALA 62 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2bm2 h ALA 62 CO -0.13 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.12 2bm2 n ALA 63 N -1.81 2.46 -2.42 0.00 0.00 -0.78 -4.90 120.51 113.05 2bm2 n ALA 63 Ca 0.01 -0.90 -0.27 0.00 0.00 0.00 0.00 53.44 52.28 2bm2 n ALA 63 Cb 0.18 -0.96 -0.15 0.00 0.00 0.00 0.00 19.45 18.51 2bm2 n ALA 63 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 2bm2 s LEU 64 N -1.03 2.06 0.04 0.00 2.96 -1.04 -0.53 118.68 121.13 2bm2 s LEU 64 Ca 0.34 -0.40 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 2bm2 s LEU 64 Cb 0.18 -1.07 -0.02 0.00 0.50 0.00 0.00 46.19 45.77 2bm2 s LEU 64 CO 0.22 0.25 -0.08 -0.13 -1.32 0.00 0.00 176.35 175.30 2bm2 s ARG 65 N -0.58 0.52 -0.13 1.98 3.00 0.66 -4.49 118.95 119.91 2bm2 s ARG 65 Ca 0.08 -0.70 -0.03 0.00 0.00 0.00 0.00 55.73 55.08 2bm2 s ARG 65 Cb -0.08 -0.31 -0.03 0.00 0.00 0.00 0.00 34.95 34.53 2bm2 s ARG 65 CO -0.00 0.06 -0.04 0.08 0.00 0.00 0.00 175.30 175.40 2bm2 s VAL 66 N -1.24 3.92 -0.10 3.52 1.01 -0.72 -0.31 120.40 126.49 2bm2 s VAL 66 Ca -0.09 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 61.57 2bm2 s VAL 66 Cb -0.09 -2.69 0.00 0.00 0.00 0.00 0.00 36.38 33.60 2bm2 s VAL 66 CO 0.00 0.52 -0.22 -1.58 0.00 0.00 0.00 175.10 173.83 2bm2 s GLN 67 N 0.04 2.79 0.89 2.72 2.00 0.38 -1.48 119.66 127.01 2bm2 s GLN 67 Ca 0.00 -0.79 -0.13 0.00 -2.00 0.00 0.00 55.36 52.44 2bm2 s GLN 67 Cb -0.13 -2.14 0.16 0.00 0.80 0.00 0.00 33.01 31.69 2bm2 s GLN 67 CO 0.03 0.14 1.25 -0.51 -0.50 0.00 0.00 175.29 175.69 2bm2 s LEU 68 N 0.44 2.70 0.16 3.68 1.43 -1.26 0.42 118.68 126.24 2bm2 s LEU 68 Ca -0.17 0.34 -0.27 0.00 -1.03 0.00 0.00 54.13 53.00 2bm2 s LEU 68 Cb -0.17 -2.54 -0.16 0.00 0.03 0.00 0.00 46.19 43.35 2bm2 s LEU 68 CO 0.07 -2.42 0.53 -1.14 0.23 0.00 0.00 176.35 173.63 2bm2 n ARG 69 N -3.55 0.00 -3.73 1.70 0.63 -0.46 -4.73 116.66 106.51 2bm2 n ARG 69 Ca 0.13 0.00 -0.12 0.00 -0.92 0.00 0.00 57.85 56.94 2bm2 n ARG 69 Cb 0.60 -0.97 -0.11 0.00 0.45 0.00 0.00 32.46 32.44 2bm2 n ARG 69 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2bm2 s GLU 70 N -0.81 0.39 0.12 -0.14 2.02 -1.26 -5.05 118.70 113.98 2bm2 s GLU 70 Ca 0.61 0.59 -0.06 0.00 0.02 0.00 0.00 54.97 56.12 2bm2 s GLU 70 Cb -0.88 0.11 -0.10 0.00 0.10 0.00 0.00 34.13 33.35 2bm2 s GLU 70 CO 0.51 -0.09 1.30 0.37 0.02 0.00 0.00 175.26 177.37 2bm2 h GLN 71 N 6.16 0.50 -4.28 1.61 5.75 -1.93 -3.42 115.11 119.50 2bm2 h GLN 71 Ca -0.31 -0.50 -0.53 0.00 -0.15 0.00 0.00 58.65 57.15 2bm2 h GLN 71 Cb 1.18 0.14 -0.37 0.00 1.07 0.00 0.00 27.48 29.50 2bm2 h GLN 71 CO 0.29 1.14 -0.81 -1.01 -2.65 0.00 0.00 178.83 175.80 2bm2 s HIS 72 N -3.37 1.55 0.27 3.99 3.76 -1.26 -1.75 115.29 118.48 2bm2 s HIS 72 Ca -0.07 -0.78 -0.30 0.00 -0.15 0.00 0.00 55.06 53.76 2bm2 s HIS 72 Cb 0.09 -1.27 -0.14 0.00 1.11 0.00 0.00 32.58 32.38 2bm2 s HIS 72 CO 0.88 -0.52 1.26 1.28 -0.85 0.00 0.00 174.74 176.78 2bm2 n LEU 73 N 4.90 2.74 0.00 0.89 4.77 -0.86 -2.61 117.00 126.83 2bm2 n LEU 73 Ca -0.13 1.17 0.00 0.00 -0.03 0.00 0.00 56.01 57.02 2bm2 n LEU 73 Cb 0.50 -1.39 0.00 0.00 -2.33 0.00 0.00 43.42 40.20 2bm2 n LEU 73 CO 0.17 -0.78 0.00 -1.22 -1.33 0.00 0.00 177.39 174.23 2bm2 n TYR 74 N 1.09 0.00 0.10 -1.77 4.01 -1.26 -4.84 117.16 114.49 2bm2 n TYR 74 Ca 0.10 0.00 -0.05 0.00 -0.16 0.00 0.00 57.90 57.79 2bm2 n TYR 74 Cb 0.32 -0.21 0.03 0.00 -0.31 0.00 0.00 39.34 39.17 2bm2 n TYR 74 CO 0.00 0.00 0.00 1.88 -0.46 0.00 0.00 176.86 178.28 2bm2 h TYR 75 N 0.00 0.05 -1.63 -0.72 0.05 -1.87 -3.36 116.97 109.49 2bm2 h TYR 75 Ca 0.00 -0.03 -0.50 0.00 0.05 0.00 0.00 58.73 58.25 2bm2 h TYR 75 Cb 0.00 -0.01 -0.41 0.00 1.01 0.00 0.00 36.73 37.32 2bm2 h TYR 75 CO 0.00 0.82 -0.96 1.04 -1.05 0.00 0.00 178.16 178.01 2bm2 n GLN 79 N -3.61 2.17 -2.17 4.88 1.13 -1.26 -5.10 117.38 113.41 2bm2 n GLN 79 Ca -0.01 -3.96 -0.42 0.00 -1.94 0.00 0.00 57.00 50.67 2bm2 n GLN 79 Cb 0.77 -1.83 -0.03 0.00 0.11 0.00 0.00 30.24 29.26 2bm2 n GLN 79 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2bm2 s ASP 80 N -3.16 6.81 -0.43 1.08 1.11 -1.26 -4.97 116.67 115.87 2bm2 s ASP 80 Ca 0.40 2.23 0.06 0.00 0.18 0.00 0.00 52.55 55.41 2bm2 s ASP 80 Cb 0.38 -2.57 0.20 0.00 1.07 0.00 0.00 42.92 42.00 2bm2 s ASP 80 CO -0.09 -0.72 0.43 0.00 1.18 0.00 0.00 175.17 175.97 2bm2 n GLN 81 N 4.94 0.53 -1.89 8.23 6.02 -1.26 -5.11 117.38 128.84 2bm2 n GLN 81 Ca 0.13 -3.30 -0.41 0.00 -0.01 0.00 0.00 57.00 53.40 2bm2 n GLN 81 Cb 0.43 -1.55 -0.02 0.00 1.02 0.00 0.00 30.24 30.12 2bm2 n GLN 81 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2bm2 s LEU 82 N -0.55 4.36 -0.06 1.08 1.02 -1.26 -4.71 118.68 118.56 2bm2 s LEU 82 Ca 0.34 2.83 0.03 0.00 0.02 0.00 0.00 54.13 57.34 2bm2 s LEU 82 Cb 0.09 -3.63 -0.03 0.00 0.02 0.00 0.00 46.19 42.64 2bm2 s LEU 82 CO -0.16 -0.81 -0.13 -0.76 0.02 0.00 0.00 176.35 174.52 2bm2 s LEU 83 N -0.62 2.80 0.57 1.79 1.43 -0.55 -4.94 118.68 119.17 2bm2 s LEU 83 Ca 0.60 -0.18 -0.12 0.00 -1.03 0.00 0.00 54.13 53.39 2bm2 s LEU 83 Cb -0.45 -1.58 -0.05 0.00 0.03 0.00 0.00 46.19 44.14 2bm2 s LEU 83 CO 0.47 0.33 1.00 -2.16 0.23 0.00 0.00 176.35 176.21 2bm2 s PRO 84 N -0.60 3.71 -0.05 1.29 0.04 -1.26 -1.75 135.00 136.37 2bm2 s PRO 84 Ca 0.09 0.78 0.04 0.00 0.04 0.00 0.00 61.00 61.95 2bm2 s PRO 84 Cb -0.11 -2.12 -0.00 0.00 0.04 0.00 0.00 34.50 32.30 2bm2 s PRO 84 CO 0.01 -0.44 -0.19 0.54 0.04 0.00 0.00 177.00 176.96 2bm2 s VAL 85 N -2.96 1.56 -0.19 -0.36 0.11 -1.26 -1.72 120.40 115.59 2bm2 s VAL 85 Ca 0.56 -0.78 0.21 0.00 -2.93 0.00 0.00 61.98 59.04 2bm2 s VAL 85 Cb -0.11 -1.35 -0.07 0.00 -1.53 0.00 0.00 36.38 33.33 2bm2 s VAL 85 CO 0.46 0.45 0.92 -1.54 -3.33 0.00 0.00 175.10 172.06 2bm2 n SER 86 N 3.21 0.75 -3.81 3.54 3.41 -0.74 -4.76 113.62 115.22 2bm2 n SER 86 Ca -0.18 0.30 -0.12 0.00 -0.26 0.00 0.00 58.87 58.60 2bm2 n SER 86 Cb 0.53 0.55 -0.11 0.00 -0.26 0.00 0.00 64.21 64.92 2bm2 n SER 86 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2bm2 s ARG 87 N -3.27 0.39 -0.25 4.33 0.52 -1.21 -5.02 118.95 114.44 2bm2 s ARG 87 Ca -0.02 0.06 0.02 0.00 -0.52 0.00 0.00 55.73 55.27 2bm2 s ARG 87 Cb 0.10 0.17 0.06 0.00 0.52 0.00 0.00 34.95 35.80 2bm2 s ARG 87 CO 0.81 -0.08 -0.07 0.42 0.02 0.00 0.00 175.30 176.40 2bm2 s ILE 88 N -0.48 1.79 -0.35 1.52 1.01 -1.26 -2.03 121.20 121.40 2bm2 s ILE 88 Ca -0.06 -1.41 -0.10 0.00 0.00 0.00 0.00 60.65 59.08 2bm2 s ILE 88 Cb -0.04 -2.01 0.02 0.00 0.01 0.00 0.00 42.46 40.45 2bm2 s ILE 88 CO 0.01 -0.09 0.17 -0.63 0.00 0.00 0.00 174.94 174.40 2bm2 s ILE 89 N 1.27 4.39 -0.12 2.92 1.01 0.12 -4.97 121.20 125.81 2bm2 s ILE 89 Ca -0.07 -0.80 -0.05 0.00 0.00 0.00 0.00 60.65 59.74 2bm2 s ILE 89 Cb -0.19 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 38.85 2bm2 s ILE 89 CO -0.06 -0.13 0.06 -0.69 0.00 0.00 0.00 174.94 174.12 2bm2 s VAL 90 N 1.54 4.80 0.16 2.92 1.01 -1.26 0.57 120.40 130.14 2bm2 s VAL 90 Ca 0.02 -0.05 -0.31 0.00 0.00 0.00 0.00 61.98 61.63 2bm2 s VAL 90 Cb -0.19 -3.08 -0.11 0.00 0.00 0.00 0.00 36.38 33.00 2bm2 s VAL 90 CO 0.06 0.57 1.75 -2.28 0.00 0.00 0.00 175.10 175.19 2bm2 s HIS 91 N -0.58 2.60 0.60 5.22 2.46 -1.08 -4.86 115.29 119.66 2bm2 s HIS 91 Ca 0.11 0.23 0.36 0.00 0.47 0.00 0.00 55.06 56.22 2bm2 s HIS 91 Cb -0.12 -4.12 2.05 0.00 -0.13 0.00 0.00 32.58 30.25 2bm2 s HIS 91 CO 0.02 -4.42 2.29 -1.00 -2.47 0.00 0.00 174.74 169.17 2bm2 h PRO 92 N 7.58 0.00 0.00 2.88 0.13 -1.93 -1.50 132.00 139.16 2bm2 h PRO 92 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2bm2 h PRO 92 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2bm2 h PRO 92 CO 0.95 0.01 0.00 0.94 -0.23 0.00 0.00 178.00 179.67 2bm2 n GLN 93 N -3.51 0.17 -2.82 0.86 -0.06 -1.26 -4.87 117.38 105.88 2bm2 n GLN 93 Ca -0.03 0.02 -0.41 0.00 -2.00 0.00 0.00 57.00 54.58 2bm2 n GLN 93 Cb 0.09 -1.50 -0.05 0.00 -4.06 0.00 0.00 30.24 24.72 2bm2 n GLN 93 CO 0.00 0.00 0.00 0.12 -0.20 0.00 0.00 177.06 176.98 2bm2 s PHE 94 N -2.83 3.79 0.02 3.69 5.36 -0.57 -4.81 117.98 122.64 2bm2 s PHE 94 Ca 0.19 1.68 0.00 0.00 -0.96 0.00 0.00 56.93 57.84 2bm2 s PHE 94 Cb 0.19 -2.97 0.00 0.00 -0.34 0.00 0.00 43.02 39.90 2bm2 s PHE 94 CO 0.48 0.24 0.00 0.98 -1.46 0.00 0.00 175.22 175.46 2bm2 n TYR 95 N 2.77 -0.18 -4.11 10.12 9.36 -1.26 -4.89 117.16 128.97 2bm2 n TYR 95 Ca 0.00 0.03 -0.08 0.00 3.32 0.00 0.00 57.90 61.17 2bm2 n TYR 95 Cb 0.49 0.47 -0.10 0.00 -0.63 0.00 0.00 39.34 39.57 2bm2 n TYR 95 CO 0.00 0.00 0.00 0.95 0.22 0.00 0.00 176.86 178.03 2bm2 s THR 96 N -2.00 0.16 -0.05 2.97 -4.23 -1.26 -4.47 115.64 106.76 2bm2 s THR 96 Ca 0.00 -1.83 0.31 0.00 -1.18 0.00 0.00 61.69 58.99 2bm2 s THR 96 Cb 0.00 -1.76 0.36 0.00 1.34 0.00 0.00 72.50 72.43 2bm2 s THR 96 CO 0.00 -0.73 1.91 0.00 -0.54 0.00 0.00 174.62 175.26 2bm2 h ALA 97 N 2.99 1.00 0.00 3.99 0.00 -1.94 -2.67 119.26 122.64 2bm2 h ALA 97 Ca -0.34 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.37 2bm2 h ALA 97 Cb 1.17 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 2bm2 h ALA 97 CO 0.62 0.00 -0.91 1.96 0.00 0.00 0.00 179.25 180.92 2bm2 h GLN 98 N 0.00 0.02 0.02 0.00 7.50 -1.96 -3.18 115.11 117.51 2bm2 h GLN 98 Ca 0.00 -0.02 -0.21 0.00 0.50 0.00 0.00 58.65 58.92 2bm2 h GLN 98 Cb 0.49 0.01 -0.01 0.00 0.05 0.00 0.00 27.48 28.01 2bm2 h GLN 98 CO 0.00 0.91 -0.95 0.82 -1.50 0.00 0.00 178.83 178.11 2bm2 h ILE 99 N 0.01 1.56 0.00 2.54 2.04 -1.91 -3.47 117.51 118.27 2bm2 h ILE 99 Ca -0.01 -2.88 0.00 0.00 1.00 0.00 0.00 64.86 62.96 2bm2 h ILE 99 Cb 1.60 2.63 0.00 0.00 -0.74 0.00 0.00 36.82 40.31 2bm2 h ILE 99 CO 0.12 0.83 0.00 0.61 0.00 0.00 0.00 178.15 179.71 2bm2 n GLY 100 N 1.07 -0.41 2.40 5.37 0.00 -1.02 -5.02 105.19 107.58 2bm2 n GLY 100 Ca -0.03 -2.25 -0.19 0.00 0.00 0.00 0.00 46.02 43.55 2bm2 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm2 n ALA 101 N -0.62 -0.48 -1.97 4.61 0.00 -1.26 -4.46 120.51 116.32 2bm2 n ALA 101 Ca 0.00 0.19 -0.40 0.00 0.00 0.00 0.00 53.44 53.22 2bm2 n ALA 101 Cb 0.00 -1.98 -0.02 0.00 0.00 0.00 0.00 19.45 17.45 2bm2 n ALA 101 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2bm2 n ASP 102 N -1.42 3.87 -3.80 0.00 2.03 -1.26 -4.35 116.55 111.61 2bm2 n ASP 102 Ca -0.21 -2.82 -0.12 0.00 0.52 0.00 0.00 54.79 52.16 2bm2 n ASP 102 Cb 0.65 -1.61 -0.10 0.00 -0.72 0.00 0.00 41.12 39.35 2bm2 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2bm2 s ILE 103 N 5.10 0.05 0.13 5.18 2.07 -1.26 -3.60 121.20 128.86 2bm2 s ILE 103 Ca 0.55 -0.37 -0.23 0.00 -1.41 0.00 0.00 60.65 59.19 2bm2 s ILE 103 Cb 0.08 -0.48 0.06 0.00 0.13 0.00 0.00 42.46 42.26 2bm2 s ILE 103 CO 0.04 -0.20 0.57 0.00 -1.91 0.00 0.00 174.94 173.44 2bm2 s ALA 104 N -0.84 -1.50 0.03 1.50 0.00 -0.26 -2.63 121.76 118.06 2bm2 s ALA 104 Ca -0.09 0.50 0.09 0.00 0.00 0.00 0.00 51.96 52.46 2bm2 s ALA 104 Cb -0.05 0.74 -0.03 0.00 0.00 0.00 0.00 23.12 23.79 2bm2 s ALA 104 CO 0.02 -0.69 -0.26 -0.51 0.00 0.00 0.00 175.76 174.32 2bm2 s LEU 105 N -2.55 2.13 -0.24 0.00 1.43 0.19 -1.43 118.68 118.23 2bm2 s LEU 105 Ca -0.00 -0.55 0.02 0.00 -1.03 0.00 0.00 54.13 52.57 2bm2 s LEU 105 Cb -0.00 -1.27 0.05 0.00 0.03 0.00 0.00 46.19 45.00 2bm2 s LEU 105 CO -0.10 0.27 -0.13 -0.76 0.23 0.00 0.00 176.35 175.85 2bm2 s LEU 106 N -1.06 3.04 -0.25 1.79 1.02 -0.80 0.10 118.68 122.53 2bm2 s LEU 106 Ca 0.11 -1.18 -0.19 0.00 0.02 0.00 0.00 54.13 52.90 2bm2 s LEU 106 Cb -0.10 -1.51 -0.03 0.00 0.02 0.00 0.00 46.19 44.57 2bm2 s LEU 106 CO 0.01 -0.14 0.54 -0.70 0.02 0.00 0.00 176.35 176.09 2bm2 s GLU 107 N 1.17 4.09 0.44 1.70 2.12 -0.86 -1.67 118.70 125.69 2bm2 s GLU 107 Ca -0.05 0.39 -0.24 0.00 0.36 0.00 0.00 54.97 55.42 2bm2 s GLU 107 Cb -0.18 -3.64 -0.08 0.00 0.26 0.00 0.00 34.13 30.49 2bm2 s GLU 107 CO -0.07 -0.34 1.26 -0.51 -0.54 0.00 0.00 175.26 175.06 2bm2 s LEU 108 N 2.28 4.09 0.40 2.70 1.02 -0.22 -1.80 118.68 127.16 2bm2 s LEU 108 Ca 0.23 2.55 0.09 0.00 0.02 0.00 0.00 54.13 57.01 2bm2 s LEU 108 Cb -0.16 -4.07 0.88 0.00 0.02 0.00 0.00 46.19 42.86 2bm2 s LEU 108 CO 0.09 -0.98 2.01 -0.33 0.02 0.00 0.00 176.35 177.16 2bm2 h GLU 109 N 2.29 0.55 -5.20 1.70 5.08 -1.63 -3.42 114.58 113.96 2bm2 h GLU 109 Ca -0.50 -0.03 -0.40 0.00 -1.00 0.00 0.00 59.36 57.43 2bm2 h GLU 109 Cb 1.25 -0.12 -0.23 0.00 0.50 0.00 0.00 28.75 30.15 2bm2 h GLU 109 CO 0.61 0.37 -0.78 -2.00 -1.00 0.00 0.00 179.01 176.21 2bm2 s GLU 110 N -5.51 0.81 0.69 2.33 2.56 -1.26 -4.94 118.70 113.38 2bm2 s GLU 110 Ca -0.08 -0.82 -0.14 0.00 0.00 0.00 0.00 54.97 53.92 2bm2 s GLU 110 Cb 0.19 -0.79 0.02 0.00 2.00 0.00 0.00 34.13 35.54 2bm2 s GLU 110 CO 0.75 0.18 1.13 -1.25 -0.56 0.00 0.00 175.26 175.51 2bm2 s PRO 111 N -1.42 2.53 -0.12 4.30 0.04 -1.26 -4.80 135.00 134.27 2bm2 s PRO 111 Ca -0.01 1.46 -0.13 0.00 0.04 0.00 0.00 61.00 62.36 2bm2 s PRO 111 Cb -0.09 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 2bm2 s PRO 111 CO 0.02 -1.47 0.28 0.08 0.04 0.00 0.00 177.00 175.94 2bm2 s VAL 112 N -2.32 5.29 -0.42 -0.36 1.01 0.63 -4.97 120.40 119.27 2bm2 s VAL 112 Ca 0.68 0.53 -0.29 0.00 0.00 0.00 0.00 61.98 62.90 2bm2 s VAL 112 Cb -0.22 -3.60 0.02 0.00 0.00 0.00 0.00 36.38 32.58 2bm2 s VAL 112 CO 0.44 0.48 1.21 -0.54 0.00 0.00 0.00 175.10 176.69 2bm2 s LYS 113 N -0.17 3.77 1.02 2.72 1.02 -1.26 -4.84 119.74 122.00 2bm2 s LYS 113 Ca 0.17 0.81 -0.13 0.00 0.02 0.00 0.00 55.97 56.84 2bm2 s LYS 113 Cb -0.14 -3.90 0.13 0.00 -0.52 0.00 0.00 37.83 33.41 2bm2 s LYS 113 CO 0.06 -1.32 0.65 0.28 -0.92 0.00 0.00 175.35 174.10 2bm2 n VAL 114 N 6.66 0.00 -3.92 3.17 0.31 -1.26 -4.99 118.33 118.31 2bm2 n VAL 114 Ca 0.13 -0.21 -0.08 0.00 -0.01 0.00 0.00 64.34 64.17 2bm2 n VAL 114 Cb 0.48 -0.80 -0.04 0.00 -0.91 0.00 0.00 33.84 32.58 2bm2 n VAL 114 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2bm2 s SER 115 N -2.23 -0.18 0.42 4.52 0.01 0.27 -4.91 113.70 111.60 2bm2 s SER 115 Ca 0.62 -0.75 0.21 0.00 1.31 0.00 0.00 55.95 57.34 2bm2 s SER 115 Cb -0.21 0.65 0.91 0.00 0.21 0.00 0.00 66.02 67.59 2bm2 s SER 115 CO 0.64 -1.23 1.84 -1.28 0.41 0.00 0.00 173.24 173.61 2bm2 h SER 116 N 2.13 0.00 0.33 2.44 0.87 -2.02 -2.92 113.55 114.37 2bm2 h SER 116 Ca -0.23 0.00 -0.31 0.00 -1.23 0.00 0.00 61.79 60.02 2bm2 h SER 116 Cb 1.25 0.00 -0.06 0.00 -0.44 0.00 0.00 62.40 63.16 2bm2 h SER 116 CO 0.30 0.28 -1.93 1.57 -0.53 0.00 0.00 176.83 176.52 2bm2 n HIS 117 N -3.56 0.65 -3.73 2.24 -0.00 -1.26 -4.86 115.22 104.70 2bm2 n HIS 117 Ca -0.01 0.23 -0.27 0.00 -0.00 0.00 0.00 57.72 57.67 2bm2 n HIS 117 Cb 0.42 -1.11 -0.17 0.00 -0.00 0.00 0.00 29.99 29.14 2bm2 n HIS 117 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 2bm2 s VAL 118 N -2.59 0.48 0.27 3.57 1.01 -1.10 -4.35 120.40 117.69 2bm2 s VAL 118 Ca -0.06 -0.49 -0.10 0.00 0.00 0.00 0.00 61.98 61.32 2bm2 s VAL 118 Cb 0.07 -0.98 -0.00 0.00 0.00 0.00 0.00 36.38 35.48 2bm2 s VAL 118 CO 0.83 -0.18 0.48 -1.38 0.00 0.00 0.00 175.10 174.84 2bm2 s HIS 119 N 1.88 0.54 1.17 5.22 -3.43 -1.22 0.96 115.29 120.41 2bm2 s HIS 119 Ca -0.00 -0.89 -0.15 0.00 -0.80 0.00 0.00 55.06 53.22 2bm2 s HIS 119 Cb -0.17 0.13 0.28 0.00 -1.43 0.00 0.00 32.58 31.39 2bm2 s HIS 119 CO -0.08 -1.04 1.04 0.95 -2.00 0.00 0.00 174.74 173.61 2bm2 s THR 120 N -3.71 1.86 -0.00 -5.38 -4.23 -1.26 -2.83 115.64 100.08 2bm2 s THR 120 Ca 0.25 0.00 0.08 0.00 -1.18 0.00 0.00 61.69 60.84 2bm2 s THR 120 Cb -0.00 -2.22 -0.02 0.00 1.34 0.00 0.00 72.50 71.59 2bm2 s THR 120 CO 0.12 0.00 -0.25 0.54 -0.54 0.00 0.00 174.62 174.49 2bm2 s VAL 121 N -2.63 2.19 -0.02 2.29 0.11 -0.29 -4.68 120.40 117.37 2bm2 s VAL 121 Ca 0.68 -1.16 -0.30 0.00 -2.93 0.00 0.00 61.98 58.27 2bm2 s VAL 121 Cb -0.20 -1.80 -0.03 0.00 -1.53 0.00 0.00 36.38 32.82 2bm2 s VAL 121 CO 0.61 0.51 1.00 -0.89 -3.33 0.00 0.00 175.10 173.00 2bm2 s THR 122 N -0.69 4.81 0.29 5.04 2.01 -1.26 -4.65 115.64 121.19 2bm2 s THR 122 Ca 0.11 2.03 -0.25 0.00 0.31 0.00 0.00 61.69 63.88 2bm2 s THR 122 Cb -0.10 -4.30 -0.09 0.00 0.01 0.00 0.00 72.50 68.02 2bm2 s THR 122 CO 0.00 0.12 0.90 -0.76 -0.69 0.00 0.00 174.62 174.19 2bm2 s LEU 123 N 1.25 4.39 0.74 4.42 1.43 -1.26 -1.57 118.68 128.09 2bm2 s LEU 123 Ca 0.52 1.77 -0.11 0.00 -1.03 0.00 0.00 54.13 55.27 2bm2 s LEU 123 Cb -0.21 -3.85 0.04 0.00 0.03 0.00 0.00 46.19 42.20 2bm2 s LEU 123 CO 0.26 -0.01 1.08 -2.16 0.23 0.00 0.00 176.35 175.75 2bm2 s PRO 124 N -1.88 2.52 0.70 1.29 0.04 -1.26 -4.85 135.00 131.56 2bm2 s PRO 124 Ca 0.47 1.13 -0.15 0.00 0.04 0.00 0.00 61.00 62.49 2bm2 s PRO 124 Cb -0.19 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.44 2bm2 s PRO 124 CO 0.24 -1.44 1.14 -1.25 0.04 0.00 0.00 177.00 175.74 2bm2 s PRO 125 N -4.85 2.47 0.00 0.56 0.04 -1.26 -4.86 135.00 127.10 2bm2 s PRO 125 Ca 0.61 1.51 0.00 0.00 0.04 0.00 0.00 61.00 63.16 2bm2 s PRO 125 Cb -0.16 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.48 2bm2 s PRO 125 CO 0.54 -1.53 0.68 0.00 0.04 0.00 0.00 177.00 176.73 2bm2 n ALA 126 N -2.65 1.10 0.56 8.56 0.00 -1.26 -2.06 120.51 124.77 2bm2 n ALA 126 Ca 0.11 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.61 2bm2 n ALA 126 Cb 0.51 -0.87 -0.02 0.00 0.00 0.00 0.00 19.45 19.07 2bm2 n ALA 126 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2bm2 n SER 127 N -1.18 1.16 -4.73 0.00 7.64 -1.26 -5.01 113.62 110.23 2bm2 n SER 127 Ca 0.00 -1.08 -0.41 0.00 1.01 0.00 0.00 58.87 58.39 2bm2 n SER 127 Cb 0.03 0.62 0.01 0.00 -1.01 0.00 0.00 64.21 63.86 2bm2 n SER 127 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2bm2 n GLU 128 N -0.51 2.21 0.00 1.43 -0.58 -0.87 -4.93 120.64 117.39 2bm2 n GLU 128 Ca 0.04 0.78 0.00 0.00 -0.42 0.00 0.00 57.16 57.57 2bm2 n GLU 128 Cb 0.24 -2.51 0.00 0.00 -0.57 0.00 0.00 31.44 28.61 2bm2 n GLU 128 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2bm2 n THR 129 N 0.00 0.00 -2.72 2.62 -2.24 -1.26 -4.95 114.28 105.73 2bm2 n THR 129 Ca 0.05 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.80 2bm2 n THR 129 Cb 0.39 -0.70 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 2bm2 n THR 129 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2bm2 n PHE 130 N -1.71 -2.62 -1.53 4.78 3.72 -1.26 -5.04 117.46 113.80 2bm2 n PHE 130 Ca 0.00 1.02 -0.30 0.00 -0.05 0.00 0.00 57.45 58.12 2bm2 n PHE 130 Cb 0.38 -3.65 0.10 0.00 -0.94 0.00 0.00 39.48 35.37 2bm2 n PHE 130 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2bm2 s PRO 131 N -2.75 1.88 0.54 -1.08 0.02 -1.26 -4.88 135.00 127.47 2bm2 s PRO 131 Ca 0.08 0.58 -0.21 0.00 0.02 0.00 0.00 61.00 61.47 2bm2 s PRO 131 Cb -0.02 -1.90 -0.06 0.00 0.02 0.00 0.00 34.50 32.54 2bm2 s PRO 131 CO 0.62 -1.75 1.15 -2.30 -0.33 0.00 0.00 177.00 174.39 2bm2 n PRO 132 N -3.51 1.35 0.00 5.54 -0.02 -1.25 -3.09 135.00 134.02 2bm2 n PRO 132 Ca 0.07 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2bm2 n PRO 132 Cb 0.57 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 2bm2 n PRO 132 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2bm2 n GLY 133 N 1.02 2.59 3.76 -1.23 0.00 -1.26 -5.01 105.19 105.06 2bm2 n GLY 133 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 2bm2 n GLY 133 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2bm2 s MET 134 N -0.28 4.37 -0.36 1.61 -1.94 -1.18 -4.94 119.30 116.58 2bm2 s MET 134 Ca 0.00 2.17 -0.29 0.00 -1.71 0.00 0.00 55.69 55.86 2bm2 s MET 134 Cb 0.00 -3.10 0.00 0.00 2.01 0.00 0.00 34.83 33.74 2bm2 s MET 134 CO 0.00 -0.19 1.42 -1.25 -0.01 0.00 0.00 175.02 174.99 2bm2 s PRO 135 N -1.39 3.67 0.00 2.03 0.04 -1.26 -4.76 135.00 133.33 2bm2 s PRO 135 Ca 0.51 1.11 0.05 0.00 0.04 0.00 0.00 61.00 62.70 2bm2 s PRO 135 Cb -0.39 -4.00 -0.01 0.00 0.04 0.00 0.00 34.50 30.14 2bm2 s PRO 135 CO 0.49 -1.44 -0.15 0.00 0.04 0.00 0.00 177.00 175.94 2bm2 s TRP 137 N -0.50 1.55 0.05 0.00 0.51 -0.10 -0.57 118.94 119.89 2bm2 s TRP 137 Ca 0.05 -0.34 0.06 0.00 -2.12 0.00 0.00 56.10 53.75 2bm2 s TRP 137 Cb -0.06 -1.02 -0.03 0.00 -0.81 0.00 0.00 33.47 31.54 2bm2 s TRP 137 CO 0.00 -0.07 -0.14 0.54 -0.51 0.00 0.00 176.95 176.78 2bm2 s VAL 138 N -0.26 3.13 0.07 4.03 0.11 -0.45 -0.85 120.40 126.18 2bm2 s VAL 138 Ca 0.03 -1.14 0.01 0.00 -2.93 0.00 0.00 61.98 57.96 2bm2 s VAL 138 Cb -0.08 -2.37 -0.04 0.00 -1.53 0.00 0.00 36.38 32.36 2bm2 s VAL 138 CO 0.00 0.28 -0.06 0.42 -3.33 0.00 0.00 175.10 172.41 2bm2 s THR 139 N -1.03 0.49 -4.93 5.04 -4.23 -1.16 -1.77 115.64 108.05 2bm2 s THR 139 Ca 0.17 -1.66 0.00 0.00 -1.18 0.00 0.00 61.69 59.02 2bm2 s THR 139 Cb -0.11 -1.33 0.00 0.00 1.34 0.00 0.00 72.50 72.41 2bm2 s THR 139 CO 0.08 -0.79 0.00 0.61 -0.54 0.00 0.00 174.62 173.98 2bm2 n GLY 140 N 0.41 -2.66 0.89 3.99 0.00 -0.73 -4.48 105.19 102.60 2bm2 n GLY 140 Ca -0.16 -1.31 0.08 0.00 0.00 0.00 0.00 46.02 44.64 2bm2 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2bm2 n TRP 141 N 0.75 0.92 -1.67 1.61 8.01 -1.26 -1.12 117.44 124.69 2bm2 n TRP 141 Ca 0.00 -0.85 -0.30 0.00 -1.31 0.00 0.00 57.50 55.04 2bm2 n TRP 141 Cb 0.00 -0.30 0.21 0.00 -2.01 0.00 0.00 31.31 29.22 2bm2 n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 2bm2 s GLY 142 N -1.86 1.74 0.66 6.99 0.00 -1.25 -4.72 107.32 108.87 2bm2 s GLY 142 Ca 0.41 -1.20 -0.17 0.00 0.00 0.00 0.00 44.72 43.76 2bm2 s GLY 142 CO 0.09 -0.36 0.37 1.22 0.00 0.00 0.00 173.10 174.43 2bm2 n ASP 143 N -4.14 -1.73 -0.27 1.64 8.00 0.70 -2.78 116.55 117.97 2bm2 n ASP 143 Ca 0.16 0.63 0.11 0.00 0.71 0.00 0.00 54.79 56.40 2bm2 n ASP 143 Cb 0.59 -1.13 0.07 0.00 -0.02 0.00 0.00 41.12 40.63 2bm2 n ASP 143 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2bm2 n VAL 144 N -2.04 0.00 -3.61 2.53 0.24 0.52 -0.17 118.33 115.80 2bm2 n VAL 144 Ca 0.10 -0.14 -0.01 0.00 -2.04 0.00 0.00 64.34 62.25 2bm2 n VAL 144 Cb 0.49 0.91 -0.01 0.00 -1.47 0.00 0.00 33.84 33.76 2bm2 n VAL 144 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2bm2 s ASP 145 N -2.67 -0.05 -0.16 -1.34 3.68 -1.22 -4.33 116.67 110.58 2bm2 s ASP 145 Ca 0.16 -0.02 -0.40 0.00 2.13 0.00 0.00 52.55 54.42 2bm2 s ASP 145 Cb 0.18 0.07 -0.18 0.00 -1.45 0.00 0.00 42.92 41.54 2bm2 s ASP 145 CO 0.65 -0.12 1.48 0.59 0.13 0.00 0.00 175.17 177.91 2bm2 n ASN 146 N -0.20 1.54 -2.12 -0.34 4.13 -1.26 0.72 115.26 117.72 2bm2 n ASN 146 Ca -0.01 1.12 -0.17 0.00 1.68 0.00 0.00 54.58 57.21 2bm2 n ASN 146 Cb 0.59 -1.07 -0.03 0.00 -1.54 0.00 0.00 39.78 37.74 2bm2 n ASN 146 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 2bm2 n ASP 147 N 3.61 -4.75 -4.05 6.41 9.92 -1.26 -4.95 116.55 121.49 2bm2 n ASP 147 Ca 0.24 0.19 -0.32 0.00 -0.53 0.00 0.00 54.79 54.37 2bm2 n ASP 147 Cb 0.10 -4.08 -0.15 0.00 -0.64 0.00 0.00 41.12 36.35 2bm2 n ASP 147 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2bm2 s GLU 149 N -4.52 2.02 0.47 -1.24 0.41 0.22 -5.08 118.70 110.97 2bm2 s GLU 149 Ca 0.00 -1.42 -0.21 0.00 -0.41 0.00 0.00 54.97 52.93 2bm2 s GLU 149 Cb 0.00 -2.92 -0.08 0.00 -1.78 0.00 0.00 34.13 29.35 2bm2 s GLU 149 CO 0.00 -0.65 1.06 0.50 -0.49 0.00 0.00 175.26 175.68 2bm2 s ARG 150 N 1.09 3.85 0.00 1.61 6.06 -1.26 -0.35 118.95 129.95 2bm2 s ARG 150 Ca -0.05 1.45 0.00 0.00 -2.50 0.00 0.00 55.73 54.63 2bm2 s ARG 150 Cb -0.20 -2.22 0.00 0.00 0.06 0.00 0.00 34.95 32.59 2bm2 s ARG 150 CO -0.06 -0.40 0.00 -0.11 -2.50 0.00 0.00 175.30 172.23 2bm2 n LEU 151 N -0.74 0.00 -0.10 -0.88 7.94 -1.26 -4.55 117.00 117.42 2bm2 n LEU 151 Ca 0.08 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.98 2bm2 n LEU 151 Cb 0.51 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.46 2bm2 n LEU 151 CO 0.42 -0.67 0.00 -0.81 -1.11 0.00 0.00 177.39 175.22 2bm2 n PRO 152 N -0.86 0.00 -3.04 1.96 -0.04 -1.26 -5.04 135.00 126.72 2bm2 n PRO 152 Ca 0.00 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.34 2bm2 n PRO 152 Cb 0.00 -0.49 0.06 0.00 -0.04 0.00 0.00 33.50 33.03 2bm2 n PRO 152 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2bm2 n PHE 153 N 0.00 -2.21 -2.26 0.54 3.72 -1.26 -3.47 117.46 112.51 2bm2 n PHE 153 Ca 0.00 0.78 -0.37 0.00 -0.05 0.00 0.00 57.45 57.80 2bm2 n PHE 153 Cb 0.00 -3.93 -0.01 0.00 -0.94 0.00 0.00 39.48 34.60 2bm2 n PHE 153 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 2bm2 s PRO 154 N -4.15 3.81 0.12 -1.08 0.04 -1.26 -2.04 135.00 130.44 2bm2 s PRO 154 Ca 0.38 1.79 -0.31 0.00 0.04 0.00 0.00 61.00 62.90 2bm2 s PRO 154 Cb -0.05 -2.46 -0.09 0.00 0.04 0.00 0.00 34.50 31.94 2bm2 s PRO 154 CO 0.65 -0.51 1.61 -1.17 0.04 0.00 0.00 177.00 177.62 2bm2 s LEU 155 N -2.93 4.37 0.33 -3.56 2.96 -0.72 -4.80 118.68 114.33 2bm2 s LEU 155 Ca 0.62 2.54 0.07 0.00 -0.22 0.00 0.00 54.13 57.15 2bm2 s LEU 155 Cb -0.29 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 42.80 2bm2 s LEU 155 CO 0.35 -0.85 0.36 -0.54 -1.32 0.00 0.00 176.35 174.35 2bm2 s LYS 156 N 1.89 2.91 0.06 1.98 1.02 -0.27 -0.83 119.74 126.50 2bm2 s LYS 156 Ca 0.72 -1.16 -0.08 0.00 0.02 0.00 0.00 55.97 55.47 2bm2 s LYS 156 Cb -0.42 -2.62 -0.00 0.00 -0.52 0.00 0.00 37.83 34.26 2bm2 s LYS 156 CO 0.32 0.11 0.15 1.14 -0.92 0.00 0.00 175.35 176.15 2bm2 s GLN 157 N -4.05 0.71 -0.25 1.68 -2.07 -0.06 -1.77 119.66 113.84 2bm2 s GLN 157 Ca 0.42 -0.81 -0.18 0.00 -1.82 0.00 0.00 55.36 52.98 2bm2 s GLN 157 Cb -0.07 0.28 0.07 0.00 -1.09 0.00 0.00 33.01 32.20 2bm2 s GLN 157 CO 0.28 -0.20 0.63 0.54 -1.32 0.00 0.00 175.29 175.23 2bm2 s VAL 158 N -3.08 -0.00 -0.15 3.63 0.11 -0.73 -1.28 120.40 118.90 2bm2 s VAL 158 Ca -0.01 0.01 -0.28 0.00 -2.93 0.00 0.00 61.98 58.78 2bm2 s VAL 158 Cb 0.01 -0.91 -0.01 0.00 -1.53 0.00 0.00 36.38 33.95 2bm2 s VAL 158 CO -0.07 0.01 0.94 -0.75 -3.33 0.00 0.00 175.10 171.90 2bm2 s LYS 159 N 1.10 4.35 0.04 1.54 2.20 -1.26 -1.35 119.74 126.37 2bm2 s LYS 159 Ca -0.06 1.23 0.08 0.00 -0.36 0.00 0.00 55.97 56.86 2bm2 s LYS 159 Cb -0.05 -3.57 -0.03 0.00 -1.51 0.00 0.00 37.83 32.67 2bm2 s LYS 159 CO -0.11 -0.36 -0.22 0.14 -0.36 0.00 0.00 175.35 174.44 2bm2 s VAL 160 N 2.22 1.77 0.12 4.02 -7.23 0.26 -4.92 120.40 116.64 2bm2 s VAL 160 Ca 0.44 -1.24 -0.28 0.00 -1.81 0.00 0.00 61.98 59.08 2bm2 s VAL 160 Cb -0.17 -1.53 -0.07 0.00 0.56 0.00 0.00 36.38 35.17 2bm2 s VAL 160 CO 0.14 0.24 0.87 -2.16 -0.31 0.00 0.00 175.10 173.88 2bm2 s PRO 161 N -1.19 4.64 0.02 4.82 0.04 -1.26 -4.31 135.00 137.75 2bm2 s PRO 161 Ca 0.08 1.29 -0.24 0.00 0.04 0.00 0.00 61.00 62.18 2bm2 s PRO 161 Cb -0.09 -3.34 -0.05 0.00 0.04 0.00 0.00 34.50 31.06 2bm2 s PRO 161 CO 0.02 0.34 0.73 0.96 0.04 0.00 0.00 177.00 179.09 2bm2 s ILE 162 N -0.38 4.81 -0.05 0.56 -0.00 -1.26 -0.51 121.20 124.37 2bm2 s ILE 162 Ca 0.42 1.55 0.05 0.00 -0.00 0.00 0.00 60.65 62.67 2bm2 s ILE 162 Cb -0.23 -4.08 -0.02 0.00 -0.00 0.00 0.00 42.46 38.13 2bm2 s ILE 162 CO 0.28 0.35 -0.19 -0.32 -0.00 0.00 0.00 174.94 175.05 2bm2 s MET 163 N 0.09 2.47 0.51 0.37 1.75 -1.00 -3.90 119.30 119.60 2bm2 s MET 163 Ca 0.38 -0.79 -0.22 0.00 -1.25 0.00 0.00 55.69 53.81 2bm2 s MET 163 Cb -0.20 -2.27 -0.07 0.00 2.84 0.00 0.00 34.83 35.13 2bm2 s MET 163 CO 0.21 0.54 1.11 0.39 -0.65 0.00 0.00 175.02 176.62 2bm2 n GLU 164 N 2.54 1.37 0.23 4.11 1.02 -1.26 -4.31 120.64 124.33 2bm2 n GLU 164 Ca -0.17 0.50 -0.16 0.00 -0.02 0.00 0.00 57.16 57.32 2bm2 n GLU 164 Cb 0.52 -2.26 -0.08 0.00 -0.02 0.00 0.00 31.44 29.60 2bm2 n GLU 164 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 2bm2 h ASN 165 N 1.24 -0.89 -0.32 1.62 4.21 -1.95 -1.00 115.58 118.50 2bm2 h ASN 165 Ca -0.48 0.07 0.09 0.00 1.21 0.00 0.00 56.30 57.19 2bm2 h ASN 165 Cb 1.33 0.29 -0.01 0.00 -1.12 0.00 0.00 38.32 38.81 2bm2 h ASN 165 CO 0.55 -0.48 0.23 1.12 -1.29 0.00 0.00 177.43 177.56 2bm2 h HIS 166 N -0.72 0.02 -0.01 1.19 2.07 -1.92 0.48 115.15 116.26 2bm2 h HIS 166 Ca -0.03 0.00 -0.15 0.00 -2.85 0.00 0.00 60.37 57.35 2bm2 h HIS 166 Cb 0.64 -0.01 0.01 0.00 2.57 0.00 0.00 27.41 30.62 2bm2 h HIS 166 CO -0.18 0.01 -0.57 0.82 -3.07 0.00 0.00 177.93 174.95 2bm2 h ILE 167 N 0.02 1.43 -0.64 6.12 2.04 -1.86 -2.61 117.51 122.01 2bm2 h ILE 167 Ca 0.15 -2.06 -0.02 0.00 1.00 0.00 0.00 64.86 63.93 2bm2 h ILE 167 Cb 0.59 2.59 -0.03 0.00 -0.74 0.00 0.00 36.82 39.23 2bm2 h ILE 167 CO -0.00 0.60 0.30 0.00 0.00 0.00 0.00 178.15 179.04 2bm2 h ASP 169 N 0.88 -0.39 -0.60 0.00 3.58 -0.14 -0.33 116.42 119.42 2bm2 h ASP 169 Ca 0.22 0.06 0.06 0.00 0.42 0.00 0.00 57.03 57.79 2bm2 h ASP 169 Cb 0.13 0.17 -0.04 0.00 1.72 0.00 0.00 39.33 41.31 2bm2 h ASP 169 CO -0.03 -0.18 0.40 0.00 -2.88 0.00 0.00 179.24 176.55 2bm2 h ALA 170 N 0.77 1.82 -0.32 -0.78 0.00 -1.11 -0.73 119.26 118.91 2bm2 h ALA 170 Ca 0.06 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.81 2bm2 h ALA 170 Cb 0.28 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2bm2 h ALA 170 CO -0.15 0.08 -0.34 0.87 0.00 0.00 0.00 179.25 179.71 2bm2 h LYS 171 N 0.57 0.72 0.00 0.00 1.57 -0.26 -2.54 116.57 116.63 2bm2 h LYS 171 Ca 0.26 -0.34 -0.06 0.00 -1.87 0.00 0.00 60.65 58.64 2bm2 h LYS 171 Cb 0.29 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 2bm2 h LYS 171 CO -0.08 0.95 -0.29 1.88 -0.57 0.00 0.00 179.45 181.34 2bm2 h TYR 172 N 0.60 0.00 0.00 -1.35 -1.99 0.40 -0.65 116.97 113.98 2bm2 h TYR 172 Ca 0.06 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.79 2bm2 h TYR 172 Cb 0.86 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.59 2bm2 h TYR 172 CO 0.04 0.29 0.00 0.72 -0.00 0.00 0.00 178.16 179.22 2bm2 n HIS 173 N -3.97 0.00 -2.21 4.88 8.25 -0.88 -4.62 115.22 116.67 2bm2 n HIS 173 Ca -0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 2bm2 n HIS 173 Cb 0.36 -0.45 -0.03 0.00 1.12 0.00 0.00 29.99 31.00 2bm2 n HIS 173 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2bm2 s LEU 173 N -2.89 4.30 0.00 2.41 2.01 -0.25 -2.36 118.68 121.90 2bm2 s LEU 173 Ca 0.12 2.09 0.00 0.00 0.01 0.00 0.00 54.13 56.35 2bm2 s LEU 173 Cb 0.13 -3.55 0.00 0.00 0.01 0.00 0.00 46.19 42.78 2bm2 s LEU 173 CO 0.35 -0.76 0.00 0.61 1.01 0.00 0.00 176.35 177.56 2bm2 n GLY 173 N 3.72 0.50 3.72 -3.19 0.00 -1.26 -5.03 105.19 103.65 2bm2 n GLY 173 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 2bm2 n GLY 173 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm2 s ALA 173 N -2.09 3.48 -0.29 4.61 0.00 -0.99 -5.02 121.76 121.45 2bm2 s ALA 173 Ca 0.00 -1.87 0.22 0.00 0.00 0.00 0.00 51.96 50.31 2bm2 s ALA 173 Cb 0.00 -0.67 0.11 0.00 0.00 0.00 0.00 23.12 22.56 2bm2 s ALA 173 CO 0.00 0.02 1.24 1.88 0.00 0.00 0.00 175.76 178.89 2bm2 h TYR 173 N 1.56 0.00 -2.53 0.00 0.05 -1.96 -3.48 116.97 110.60 2bm2 h TYR 173 Ca -0.43 0.00 -0.60 0.00 0.05 0.00 0.00 58.73 57.74 2bm2 h TYR 173 Cb 1.25 0.00 0.11 0.00 1.01 0.00 0.00 36.73 39.10 2bm2 h TYR 173 CO 0.63 0.06 0.22 2.41 -1.05 0.00 0.00 178.16 180.43 2bm2 n THR 173 N -2.86 1.83 0.00 -2.88 -1.04 -1.26 -5.18 114.28 102.90 2bm2 n THR 173 Ca 0.01 -0.46 0.00 0.00 -2.04 0.00 0.00 64.05 61.56 2bm2 n THR 173 Cb 0.57 -1.08 0.00 0.00 -1.82 0.00 0.00 70.33 68.00 2bm2 n THR 173 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2bm2 n GLY 173 N 1.30 -1.87 0.00 3.41 0.00 -1.26 -4.96 105.19 101.81 2bm2 n GLY 173 Ca 0.10 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 45.04 2bm2 n GLY 173 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bm2 n ASP 173 N 0.00 0.00 -4.44 1.61 10.43 -1.26 -4.70 116.55 118.19 2bm2 n ASP 173 Ca 0.00 0.00 -0.37 0.00 2.57 0.00 0.00 54.79 56.99 2bm2 n ASP 173 Cb 0.00 0.00 -0.12 0.00 1.84 0.00 0.00 41.12 42.84 2bm2 n ASP 173 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2bm2 s VAL 173 N 0.00 4.35 0.11 2.53 0.11 -1.26 -5.06 120.40 121.17 2bm2 s VAL 173 Ca 0.00 -0.23 -0.31 0.00 -2.93 0.00 0.00 61.98 58.51 2bm2 s VAL 173 Cb 0.00 -3.07 -0.08 0.00 -1.53 0.00 0.00 36.38 31.70 2bm2 s VAL 173 CO 0.00 0.28 1.40 -0.13 -3.33 0.00 0.00 175.10 173.32 2bm2 s ARG 174 N 1.61 4.31 -0.26 1.54 0.52 -1.26 -4.94 118.95 120.47 2bm2 s ARG 174 Ca 0.06 2.08 -0.14 0.00 -0.52 0.00 0.00 55.73 57.20 2bm2 s ARG 174 Cb -0.15 -3.27 -0.11 0.00 0.52 0.00 0.00 34.95 31.93 2bm2 s ARG 174 CO 0.04 -0.46 -0.35 -0.89 0.02 0.00 0.00 175.30 173.66 2bm2 n ILE 175 N 4.01 1.50 -3.02 1.52 5.41 -1.26 -4.81 119.36 122.70 2bm2 n ILE 175 Ca 0.12 -0.30 -0.43 0.00 1.00 0.00 0.00 62.75 63.14 2bm2 n ILE 175 Cb 0.42 -1.95 -0.06 0.00 -0.71 0.00 0.00 39.64 37.35 2bm2 n ILE 175 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2bm2 s VAL 176 N -2.56 4.72 0.80 1.39 1.01 -1.26 -5.00 120.40 119.50 2bm2 s VAL 176 Ca -0.37 0.25 -0.10 0.00 0.00 0.00 0.00 61.98 61.76 2bm2 s VAL 176 Cb 0.13 -4.29 0.10 0.00 0.00 0.00 0.00 36.38 32.32 2bm2 s VAL 176 CO 0.47 -0.70 1.15 -0.13 0.00 0.00 0.00 175.10 175.89 2bm2 s ARG 177 N 3.10 1.75 0.38 2.72 1.81 -1.26 -4.83 118.95 122.63 2bm2 s ARG 177 Ca 0.26 -0.18 0.06 0.00 -1.72 0.00 0.00 55.73 54.15 2bm2 s ARG 177 Cb -0.13 -2.02 0.76 0.00 -0.45 0.00 0.00 34.95 33.11 2bm2 s ARG 177 CO 0.21 -1.64 1.99 -0.44 -0.68 0.00 0.00 175.30 174.74 2bm2 h ASP 178 N -1.00 0.49 -0.16 0.23 3.32 -2.00 -1.74 116.42 115.56 2bm2 h ASP 178 Ca -0.45 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2bm2 h ASP 178 Cb 1.30 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2bm2 h ASP 178 CO 0.57 0.42 0.00 -0.90 -1.72 0.00 0.00 179.24 177.61 2bm2 n ASP 179 N -4.41 2.07 -4.56 6.45 3.85 -1.26 -4.87 116.55 113.84 2bm2 n ASP 179 Ca 0.03 -2.21 -0.26 0.00 -0.71 0.00 0.00 54.79 51.64 2bm2 n ASP 179 Cb 0.12 -0.48 -0.11 0.00 -1.35 0.00 0.00 41.12 39.30 2bm2 n ASP 179 CO 0.00 0.00 0.00 -0.04 -1.01 0.00 0.00 177.20 176.15 2bm2 s MET 180 N -1.51 1.84 -0.01 0.11 -1.94 -0.65 -1.78 119.30 115.34 2bm2 s MET 180 Ca 0.14 -2.00 -0.10 0.00 -1.71 0.00 0.00 55.69 52.02 2bm2 s MET 180 Cb 0.10 -1.49 0.01 0.00 2.01 0.00 0.00 34.83 35.47 2bm2 s MET 180 CO 0.05 -0.01 0.21 -1.17 -0.01 0.00 0.00 175.02 174.09 2bm2 s LEU 181 N -3.62 1.25 0.12 -0.03 0.20 0.11 -4.60 118.68 112.11 2bm2 s LEU 181 Ca 0.34 -0.02 0.10 0.00 0.69 0.00 0.00 54.13 55.24 2bm2 s LEU 181 Cb 0.07 0.90 -0.04 0.00 -0.43 0.00 0.00 46.19 46.70 2bm2 s LEU 181 CO 0.17 -0.36 -0.24 0.00 -0.29 0.00 0.00 176.35 175.62 2bm2 s ALA 183 N -1.08 -1.94 0.00 0.00 0.00 -0.73 -2.37 121.76 115.64 2bm2 s ALA 183 Ca 0.15 1.67 0.00 0.00 0.00 0.00 0.00 51.96 53.79 2bm2 s ALA 183 Cb -0.10 -0.93 0.00 0.00 0.00 0.00 0.00 23.12 22.09 2bm2 s ALA 183 CO 0.07 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.96 2bm2 n GLY 184 N 1.25 2.60 0.00 0.00 0.00 0.33 -1.65 105.19 107.72 2bm2 n GLY 184 Ca -0.11 -2.01 0.00 0.00 0.00 0.00 0.00 46.02 43.90 2bm2 n GLY 184 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2bm2 n ASN 185 N 0.00 0.08 0.00 1.61 0.23 -0.21 -4.65 115.26 112.33 2bm2 n ASN 185 Ca 0.00 -0.64 0.09 0.00 -0.53 0.00 0.00 54.58 53.49 2bm2 n ASN 185 Cb 0.00 0.00 0.48 0.00 -2.08 0.00 0.00 39.78 38.18 2bm2 n ASN 185 CO 0.00 0.00 0.00 0.35 -0.93 0.00 0.00 177.26 176.68 2bm2 n THR 186 N 0.00 0.23 0.00 5.53 -2.24 -1.26 -2.98 114.28 113.56 2bm2 n THR 186 Ca 0.00 0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2bm2 n THR 186 Cb 0.00 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 67.45 2bm2 n THR 186 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2bm2 n ARG 187 N -1.13 2.31 -3.87 -0.78 1.74 -1.26 -4.79 116.66 108.88 2bm2 n ARG 187 Ca 0.11 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.91 2bm2 n ARG 187 Cb 0.09 -0.80 -0.17 0.00 -1.02 0.00 0.00 32.46 30.56 2bm2 n ARG 187 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2bm2 s ARG 188 N -1.55 1.31 0.31 5.56 0.52 -1.16 -3.84 118.95 120.10 2bm2 s ARG 188 Ca 0.00 -0.44 -0.17 0.00 -0.52 0.00 0.00 55.73 54.60 2bm2 s ARG 188 Cb 0.00 -1.90 0.03 0.00 0.52 0.00 0.00 34.95 33.59 2bm2 s ARG 188 CO 0.00 -0.43 0.70 0.34 0.02 0.00 0.00 175.30 175.93 2bm2 s ASP 189 N 1.68 -0.08 0.44 0.23 3.68 -0.71 -1.04 116.67 120.86 2bm2 s ASP 189 Ca 0.01 -0.87 0.01 0.00 2.13 0.00 0.00 52.55 53.82 2bm2 s ASP 189 Cb -0.15 0.75 -0.01 0.00 -1.45 0.00 0.00 42.92 42.06 2bm2 s ASP 189 CO -0.08 -1.43 0.65 -0.55 0.13 0.00 0.00 175.17 173.90 2bm2 s SER 190 N -3.00 5.88 0.17 -0.34 0.15 -1.26 0.19 113.70 115.49 2bm2 s SER 190 Ca 0.15 0.27 -0.24 0.00 0.70 0.00 0.00 55.95 56.84 2bm2 s SER 190 Cb -0.05 -1.56 0.06 0.00 -1.71 0.00 0.00 66.02 62.76 2bm2 s SER 190 CO 0.09 -0.65 0.79 0.00 1.20 0.00 0.00 173.24 174.67 2bm2 n GLN 192 N -0.41 0.23 0.00 0.00 10.64 -1.26 -0.77 117.38 125.81 2bm2 n GLN 192 Ca -0.08 0.08 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2bm2 n GLN 192 Cb 0.61 -1.40 0.00 0.00 -0.86 0.00 0.00 30.24 28.59 2bm2 n GLN 192 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2bm2 n GLY 193 N 1.78 3.43 0.11 2.61 0.00 -1.26 -0.22 105.19 111.65 2bm2 n GLY 193 Ca 0.18 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.32 2bm2 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2bm2 h ASP 194 N 0.00 0.00 -1.42 1.61 3.32 -1.28 -3.33 116.42 115.32 2bm2 h ASP 194 Ca 0.00 -0.02 -0.68 0.00 0.02 0.00 0.00 57.03 56.35 2bm2 h ASP 194 Cb 0.00 0.00 0.09 0.00 0.22 0.00 0.00 39.33 39.64 2bm2 h ASP 194 CO 0.00 0.01 -0.12 -1.20 -1.72 0.00 0.00 179.24 176.21 2bm2 n SER 195 N -2.65 -0.00 0.00 6.45 7.64 -1.26 -1.34 113.62 122.46 2bm2 n SER 195 Ca 0.00 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.03 2bm2 n SER 195 Cb 0.54 -1.05 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 2bm2 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2bm2 n GLY 196 N 1.80 3.22 2.69 0.23 0.00 -0.47 -0.16 105.19 112.51 2bm2 n GLY 196 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 2bm2 n GLY 196 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bm2 n GLY 197 N -1.99 -2.11 3.94 -0.02 0.00 -0.45 -3.37 105.19 101.20 2bm2 n GLY 197 Ca 0.00 -1.58 -0.26 0.00 0.00 0.00 0.00 46.02 44.18 2bm2 n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2bm2 s PRO 198 N -4.97 3.45 -0.21 1.61 0.04 -1.26 -1.36 135.00 132.30 2bm2 s PRO 198 Ca 0.54 -0.57 0.01 0.00 0.04 0.00 0.00 61.00 61.01 2bm2 s PRO 198 Cb -0.03 -2.95 0.03 0.00 0.04 0.00 0.00 34.50 31.58 2bm2 s PRO 198 CO 0.40 0.51 -0.15 -1.17 0.04 0.00 0.00 177.00 176.62 2bm2 s LEU 199 N -3.24 2.64 0.04 -3.56 2.96 -1.02 -3.01 118.68 113.49 2bm2 s LEU 199 Ca 0.35 -0.86 0.08 0.00 -0.22 0.00 0.00 54.13 53.49 2bm2 s LEU 199 Cb -0.11 -1.53 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 2bm2 s LEU 199 CO 0.29 -0.07 -0.24 0.68 -1.32 0.00 0.00 176.35 175.69 2bm2 s VAL 200 N 1.26 1.97 0.09 1.68 -7.23 -0.03 -1.77 120.40 116.37 2bm2 s VAL 200 Ca 0.01 -1.30 0.08 0.00 -1.81 0.00 0.00 61.98 58.97 2bm2 s VAL 200 Cb -0.15 -1.69 -0.03 0.00 0.56 0.00 0.00 36.38 35.07 2bm2 s VAL 200 CO -0.09 0.33 -0.21 0.00 -0.31 0.00 0.00 175.10 174.82 2bm2 s LYS 202 N -1.75 3.28 -0.22 0.00 2.20 -0.91 0.05 119.74 122.40 2bm2 s LYS 202 Ca 0.07 -0.39 -0.00 0.00 -0.36 0.00 0.00 55.97 55.29 2bm2 s LYS 202 Cb -0.10 -3.98 0.02 0.00 -1.51 0.00 0.00 37.83 32.26 2bm2 s LYS 202 CO 0.04 -1.12 -0.13 0.08 -0.36 0.00 0.00 175.35 173.86 2bm2 s VAL 203 N 3.00 2.48 -1.21 4.02 1.01 0.43 -4.65 120.40 125.49 2bm2 s VAL 203 Ca 0.24 -1.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.12 2bm2 s VAL 203 Cb -0.14 -2.18 -0.01 0.00 0.00 0.00 0.00 36.38 34.04 2bm2 s VAL 203 CO 0.19 0.35 0.75 0.59 0.00 0.00 0.00 175.10 176.97 2bm2 n ASN 204 N 4.63 -3.66 -1.59 3.32 3.02 -1.26 -1.67 115.26 118.05 2bm2 n ASN 204 Ca -0.18 -0.90 -0.18 0.00 -0.03 0.00 0.00 54.58 53.29 2bm2 n ASN 204 Cb 0.48 -3.87 -0.06 0.00 -0.61 0.00 0.00 39.78 35.73 2bm2 n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bm2 n GLY 205 N -1.60 1.08 3.34 7.41 0.00 -1.26 -4.98 105.19 109.18 2bm2 n GLY 205 Ca -0.18 -0.15 -0.11 0.00 0.00 0.00 0.00 46.02 45.58 2bm2 n GLY 205 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2bm2 s THR 206 N -2.74 -0.01 0.05 2.61 -1.32 -0.67 -5.14 115.64 108.41 2bm2 s THR 206 Ca 0.00 0.05 -0.31 0.00 -1.21 0.00 0.00 61.69 60.23 2bm2 s THR 206 Cb 0.00 -0.67 -0.07 0.00 -1.51 0.00 0.00 72.50 70.25 2bm2 s THR 206 CO 0.00 0.02 1.56 0.26 -2.21 0.00 0.00 174.62 174.25 2bm2 s TRP 207 N 1.07 2.60 -0.06 9.09 0.52 -1.26 -0.43 118.94 130.47 2bm2 s TRP 207 Ca -0.07 0.51 0.05 0.00 0.02 0.00 0.00 56.10 56.62 2bm2 s TRP 207 Cb -0.06 -3.86 -0.01 0.00 -1.15 0.00 0.00 33.47 28.39 2bm2 s TRP 207 CO -0.09 -3.35 -0.23 -0.51 0.02 0.00 0.00 176.95 172.79 2bm2 s LEU 208 N 2.48 2.02 -0.69 2.99 1.43 0.11 -4.19 118.68 122.84 2bm2 s LEU 208 Ca 0.70 -0.47 -0.26 0.00 -1.03 0.00 0.00 54.13 53.06 2bm2 s LEU 208 Cb -0.37 -1.27 0.04 0.00 0.03 0.00 0.00 46.19 44.62 2bm2 s LEU 208 CO 0.30 0.21 1.19 -1.58 0.23 0.00 0.00 176.35 176.70 2bm2 s GLN 209 N -0.03 3.25 0.10 1.70 0.74 -0.61 -1.10 119.66 123.71 2bm2 s GLN 209 Ca -0.06 -0.24 -0.13 0.00 0.05 0.00 0.00 55.36 54.98 2bm2 s GLN 209 Cb -0.14 -4.15 -0.17 0.00 1.10 0.00 0.00 33.01 29.65 2bm2 s GLN 209 CO 0.04 -1.97 1.28 0.00 -0.55 0.00 0.00 175.29 174.09 2bm2 h ALA 210 N 9.82 0.27 -2.93 1.58 0.00 -1.70 -3.37 119.26 122.93 2bm2 h ALA 210 Ca -0.27 -0.62 -0.29 0.00 0.00 0.00 0.00 54.91 53.72 2bm2 h ALA 210 Cb 1.06 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 18.77 2bm2 h ALA 210 CO 1.24 0.68 -0.20 0.20 0.00 0.00 0.00 179.25 181.17 2bm2 s GLY 211 N -4.16 1.55 -0.11 0.00 0.00 -1.15 -0.93 107.32 102.51 2bm2 s GLY 211 Ca -0.10 -1.55 0.02 0.00 0.00 0.00 0.00 44.72 43.09 2bm2 s GLY 211 CO 0.91 -1.02 -0.18 0.14 0.00 0.00 0.00 173.10 172.95 2bm2 s VAL 212 N -3.04 1.70 -0.07 1.40 1.01 -0.13 -2.44 120.40 118.82 2bm2 s VAL 212 Ca 0.31 -0.78 -0.35 0.00 0.00 0.00 0.00 61.98 61.17 2bm2 s VAL 212 Cb -0.00 -1.53 -0.12 0.00 0.00 0.00 0.00 36.38 34.73 2bm2 s VAL 212 CO 0.21 0.48 1.84 0.52 0.00 0.00 0.00 175.10 178.15 2bm2 n VAL 213 N 4.05 0.50 0.01 2.92 0.31 -0.46 -0.33 118.33 125.32 2bm2 n VAL 213 Ca -0.20 -0.09 -0.00 0.00 -0.01 0.00 0.00 64.34 64.04 2bm2 n VAL 213 Cb 0.52 -1.78 -0.00 0.00 -0.91 0.00 0.00 33.84 31.66 2bm2 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2bm2 n SER 214 N 6.18 0.44 -0.73 4.52 2.88 -0.87 -1.37 113.62 124.67 2bm2 n SER 214 Ca 0.22 0.06 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 2bm2 n SER 214 Cb 0.28 -0.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.57 2bm2 n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 2bm2 n TRP 215 N -2.90 -0.67 0.00 0.66 4.27 -0.96 -4.94 117.44 112.91 2bm2 n TRP 215 Ca -0.00 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.61 2bm2 n TRP 215 Cb 0.02 0.00 0.00 0.00 -1.36 0.00 0.00 31.31 29.97 2bm2 n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 2bm2 n GLY 216 N 0.00 1.25 3.37 -1.67 0.00 -1.26 -0.66 105.19 106.21 2bm2 n GLY 216 Ca 0.00 -1.24 -0.45 0.00 0.00 0.00 0.00 46.02 44.33 2bm2 n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bm2 s GLU 217 N -1.97 3.23 2.67 1.61 2.02 -1.26 -4.93 118.70 120.07 2bm2 s GLU 217 Ca 0.00 -1.66 0.00 0.00 0.02 0.00 0.00 54.97 53.33 2bm2 s GLU 217 Cb 0.00 -4.40 0.00 0.00 0.10 0.00 0.00 34.13 29.83 2bm2 s GLU 217 CO 0.00 -1.50 0.00 0.41 0.02 0.00 0.00 175.26 174.19 2bm2 n GLY 219 N 5.04 -0.27 2.88 -1.39 0.00 -1.26 -4.62 105.19 105.56 2bm2 n GLY 219 Ca -0.01 -1.05 -0.19 0.00 0.00 0.00 0.00 46.02 44.77 2bm2 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bm2 n ALA 221 N 4.08 -0.97 -2.59 0.00 0.00 -1.26 -4.66 120.51 115.10 2bm2 n ALA 221 Ca -0.25 0.19 -0.30 0.00 0.00 0.00 0.00 53.44 53.08 2bm2 n ALA 221 Cb 0.51 -3.17 -0.04 0.00 0.00 0.00 0.00 19.45 16.75 2bm2 n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2bm2 s GLN 221 N -5.72 3.64 0.19 0.00 -1.52 -1.26 -4.31 119.66 110.68 2bm2 s GLN 221 Ca 0.29 -0.03 -0.33 0.00 -1.95 0.00 0.00 55.36 53.34 2bm2 s GLN 221 Cb -0.14 -2.75 -0.14 0.00 -0.22 0.00 0.00 33.01 29.76 2bm2 s GLN 221 CO 0.36 0.35 1.39 -2.30 -0.25 0.00 0.00 175.29 174.85 2bm2 n PRO 222 N -0.38 1.78 -2.31 2.91 -0.02 -1.26 -1.95 135.00 133.77 2bm2 n PRO 222 Ca -0.02 0.64 -0.18 0.00 -2.02 0.00 0.00 63.50 61.91 2bm2 n PRO 222 Cb 0.53 -2.29 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 2bm2 n PRO 222 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2bm2 n ASN 223 N 2.49 -5.28 -3.19 2.55 5.03 -1.26 -4.92 115.26 110.68 2bm2 n ASN 223 Ca 0.14 0.09 -0.21 0.00 0.87 0.00 0.00 54.58 55.48 2bm2 n ASN 223 Cb 0.28 -4.45 -0.05 0.00 -1.02 0.00 0.00 39.78 34.54 2bm2 n ASN 223 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2bm2 n ARG 224 N -2.87 1.01 -0.90 3.52 5.12 -0.82 -4.30 116.66 117.42 2bm2 n ARG 224 Ca -0.21 -3.42 -0.33 0.00 -1.93 0.00 0.00 57.85 51.95 2bm2 n ARG 224 Cb 0.66 -1.54 0.13 0.00 -1.16 0.00 0.00 32.46 30.55 2bm2 n ARG 224 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2bm2 n PRO 225 N 0.77 -0.15 -2.30 5.56 -0.02 -1.26 -4.42 135.00 133.18 2bm2 n PRO 225 Ca 0.24 0.02 -0.37 0.00 -2.02 0.00 0.00 63.50 61.37 2bm2 n PRO 225 Cb 0.58 -2.16 -0.01 0.00 -0.02 0.00 0.00 33.50 31.89 2bm2 n PRO 225 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2bm2 s GLY 226 N -2.16 2.76 -0.11 -1.23 0.00 -0.66 -4.73 107.32 101.20 2bm2 s GLY 226 Ca 0.65 0.89 -0.02 0.00 0.00 0.00 0.00 44.72 46.24 2bm2 s GLY 226 CO 0.59 1.33 -0.02 -0.42 0.00 0.00 0.00 173.10 174.59 2bm2 s ILE 227 N -1.58 4.10 0.09 0.90 -1.09 0.16 -1.78 121.20 122.00 2bm2 s ILE 227 Ca 0.63 -0.31 0.08 0.00 -2.23 0.00 0.00 60.65 58.82 2bm2 s ILE 227 Cb -0.27 -2.74 -0.03 0.00 -1.58 0.00 0.00 42.46 37.84 2bm2 s ILE 227 CO 0.33 0.57 -0.20 -0.31 -1.23 0.00 0.00 174.94 174.09 2bm2 s TYR 228 N -0.47 1.75 -0.11 3.97 1.51 0.28 -2.04 117.35 122.24 2bm2 s TYR 228 Ca 0.08 -0.41 -0.30 0.00 -1.01 0.00 0.00 57.07 55.43 2bm2 s TYR 228 Cb -0.12 -0.98 -0.02 0.00 -0.11 0.00 0.00 41.96 40.73 2bm2 s TYR 228 CO 0.02 0.17 1.22 0.99 -1.11 0.00 0.00 175.55 176.85 2bm2 s THR 229 N -1.09 4.28 -0.31 -0.71 2.01 0.55 0.09 115.64 120.46 2bm2 s THR 229 Ca 0.06 1.58 -0.29 0.00 0.31 0.00 0.00 61.69 63.36 2bm2 s THR 229 Cb -0.10 -4.02 -0.02 0.00 0.01 0.00 0.00 72.50 68.38 2bm2 s THR 229 CO 0.04 -0.07 1.74 -0.60 -0.69 0.00 0.00 174.62 175.04 2bm2 s ARG 230 N 2.80 3.45 0.20 4.92 3.52 -0.74 -0.96 118.95 132.14 2bm2 s ARG 230 Ca 0.55 1.45 -0.11 0.00 -0.13 0.00 0.00 55.73 57.49 2bm2 s ARG 230 Cb -0.23 -4.15 0.21 0.00 -1.56 0.00 0.00 34.95 29.22 2bm2 s ARG 230 CO 0.18 -1.71 1.77 0.28 -0.81 0.00 0.00 175.30 175.01 2bm2 h VAL 231 N 6.65 0.87 -1.00 7.11 2.07 -1.31 -2.62 116.25 128.02 2bm2 h VAL 231 Ca -0.33 -0.16 0.22 0.00 0.82 0.00 0.00 66.70 67.25 2bm2 h VAL 231 Cb 1.16 0.36 -0.10 0.00 -1.52 0.00 0.00 31.29 31.19 2bm2 h VAL 231 CO 1.03 0.09 0.62 0.71 0.02 0.00 0.00 177.57 180.03 2bm2 h THR 232 N 0.47 0.62 0.00 2.57 1.35 -1.88 0.17 112.91 116.21 2bm2 h THR 232 Ca 0.27 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.92 2bm2 h THR 232 Cb 0.25 -0.02 0.00 0.00 -1.73 0.00 0.00 68.15 66.65 2bm2 h THR 232 CO -0.23 0.11 0.00 0.00 -0.25 0.00 0.00 175.52 175.15 2bm2 n TYR 233 N -4.73 0.00 -1.11 4.73 4.19 -0.98 -3.22 117.16 116.03 2bm2 n TYR 233 Ca 0.24 0.00 0.02 0.00 3.31 0.00 0.00 57.90 61.47 2bm2 n TYR 233 Cb 0.70 -0.31 0.03 0.00 0.49 0.00 0.00 39.34 40.25 2bm2 n TYR 233 CO 0.00 0.00 0.00 0.66 0.91 0.00 0.00 176.86 178.43 2bm2 n TYR 234 N -1.31 0.00 -0.23 2.98 4.01 0.59 -4.81 117.16 118.38 2bm2 n TYR 234 Ca 0.05 -0.33 -0.01 0.00 -0.16 0.00 0.00 57.90 57.45 2bm2 n TYR 234 Cb 0.10 -0.06 0.10 0.00 -0.31 0.00 0.00 39.34 39.17 2bm2 n TYR 234 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 2bm2 h LEU 235 N 0.00 0.55 -0.47 7.72 3.38 -1.50 0.19 115.31 125.18 2bm2 h LEU 235 Ca 0.00 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.08 2bm2 h LEU 235 Cb 1.02 -0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.62 2bm2 h LEU 235 CO 0.00 0.36 0.09 0.44 0.09 0.00 0.00 178.44 179.41 2bm2 h ASP 236 N 0.69 -0.02 -0.03 -0.43 3.45 -1.87 0.49 116.42 118.70 2bm2 h ASP 236 Ca 0.30 0.09 -0.01 0.00 0.43 0.00 0.00 57.03 57.84 2bm2 h ASP 236 Cb 0.19 0.12 -0.00 0.00 -0.56 0.00 0.00 39.33 39.08 2bm2 h ASP 236 CO -0.18 0.02 -0.01 -0.25 -1.57 0.00 0.00 179.24 177.25 2bm2 h TRP 237 N 0.22 0.07 -0.22 4.55 7.01 -1.73 -2.40 115.95 123.44 2bm2 h TRP 237 Ca 0.24 -0.01 0.06 0.00 2.11 0.00 0.00 58.89 61.28 2bm2 h TRP 237 Cb 0.31 -0.02 -0.06 0.00 -2.10 0.00 0.00 29.16 27.30 2bm2 h TRP 237 CO -0.23 0.41 -0.16 0.82 -2.79 0.00 0.00 178.44 176.49 2bm2 h ILE 238 N -0.29 0.55 0.00 2.65 2.04 -0.11 -1.64 117.51 120.71 2bm2 h ILE 238 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.87 2bm2 h ILE 238 Cb 0.39 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 2bm2 h ILE 238 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 178.15 178.60 2bm2 h HIS 239 N -0.15 0.00 -0.07 1.37 3.86 0.02 -0.64 115.15 119.54 2bm2 h HIS 239 Ca 0.13 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.30 2bm2 h HIS 239 Cb 0.34 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.81 2bm2 h HIS 239 CO -0.32 0.00 -0.12 0.45 0.86 0.00 0.00 177.93 178.81 2bm2 h HIS 240 N 0.00 0.10 0.00 2.45 3.86 -0.76 -3.36 115.15 117.44 2bm2 h HIS 240 Ca 0.00 -0.01 -0.30 0.00 -1.16 0.00 0.00 60.37 58.90 2bm2 h HIS 240 Cb 0.11 -0.03 -0.05 0.00 1.06 0.00 0.00 27.41 28.50 2bm2 h HIS 240 CO 0.00 0.22 -2.09 0.66 0.86 0.00 0.00 177.93 177.58 2bm2 n TYR 241 N -4.35 0.00 -3.70 2.45 4.01 -0.33 -4.99 117.16 110.25 2bm2 n TYR 241 Ca -0.02 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.37 2bm2 n TYR 241 Cb 0.22 -0.72 -0.08 0.00 -0.31 0.00 0.00 39.34 38.45 2bm2 n TYR 241 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 2bm2 s VAL 242 N -2.37 5.39 0.33 -0.72 -7.23 -0.68 -5.05 120.40 110.06 2bm2 s VAL 242 Ca -0.26 0.21 -0.28 0.00 -1.81 0.00 0.00 61.98 59.84 2bm2 s VAL 242 Cb 0.08 -3.49 -0.13 0.00 0.56 0.00 0.00 36.38 33.41 2bm2 s VAL 242 CO 0.41 0.42 1.18 -2.65 -0.31 0.00 0.00 175.10 174.14 2bm2 n PRO 243 N 3.69 1.83 0.00 4.82 -0.02 -1.26 -4.49 135.00 139.57 2bm2 n PRO 243 Ca -0.16 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 2bm2 n PRO 243 Cb 0.52 -2.16 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 2bm2 n PRO 243 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84