#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xmn s VAL 17 N 0.00 4.84 -1.41 1.39 1.01 0.24 -4.26 120.40 122.21 1xmn s VAL 17 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 61.98 61.93 1xmn s VAL 17 Cb 0.00 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1xmn s VAL 17 CO 0.00 0.49 0.41 -0.62 0.00 0.00 0.00 175.10 175.38 1xmn n GLU 18 N 3.25 -3.62 0.00 2.72 -0.58 -1.26 -2.61 120.64 118.55 1xmn n GLU 18 Ca -0.17 0.82 0.00 0.00 -0.42 0.00 0.00 57.16 57.39 1xmn n GLU 18 Cb 0.53 -5.41 0.00 0.00 -0.57 0.00 0.00 31.44 25.98 1xmn n GLU 18 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xmn n GLY 19 N -1.33 3.38 3.38 0.62 0.00 -1.26 -4.74 105.19 105.24 1xmn n GLY 19 Ca -0.13 -2.02 -0.10 0.00 0.00 0.00 0.00 46.02 43.78 1xmn n GLY 19 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xmn s SER 20 N -0.48 -0.00 0.23 1.61 1.04 -0.32 -4.90 113.70 110.88 1xmn s SER 20 Ca 0.00 -0.85 -0.31 0.00 0.48 0.00 0.00 55.95 55.26 1xmn s SER 20 Cb 0.00 0.47 -0.12 0.00 0.10 0.00 0.00 66.02 66.47 1xmn s SER 20 CO 0.00 -0.94 1.66 0.47 0.98 0.00 0.00 173.24 175.41 1xmn n ASP 21 N -0.25 3.83 -4.80 7.02 9.92 -1.26 -0.58 116.55 130.42 1xmn n ASP 21 Ca -0.07 1.10 -0.32 0.00 -0.53 0.00 0.00 54.79 54.97 1xmn n ASP 21 Cb 0.63 -1.56 0.02 0.00 -0.64 0.00 0.00 41.12 39.57 1xmn n ASP 21 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1xmn s ALA 22 N 0.70 2.72 0.47 2.24 0.00 0.40 -4.81 121.76 123.48 1xmn s ALA 22 Ca 0.71 0.34 -0.08 0.00 0.00 0.00 0.00 51.96 52.93 1xmn s ALA 22 Cb -0.52 -3.22 -0.05 0.00 0.00 0.00 0.00 23.12 19.33 1xmn s ALA 22 CO 0.39 -0.91 0.81 -1.21 0.00 0.00 0.00 175.76 174.84 1xmn s GLU 23 N -4.27 3.63 0.19 0.00 2.02 -1.26 -4.92 118.70 114.09 1xmn s GLU 23 Ca 0.63 0.35 -0.32 0.00 0.02 0.00 0.00 54.97 55.65 1xmn s GLU 23 Cb -0.16 -2.34 -0.12 0.00 0.10 0.00 0.00 34.13 31.61 1xmn s GLU 23 CO 0.41 -0.19 1.74 0.42 0.02 0.00 0.00 175.26 177.65 1xmn s ILE 24 N -2.67 2.14 0.00 -1.63 -1.09 -1.26 -1.79 121.20 114.90 1xmn s ILE 24 Ca 0.50 0.04 0.00 0.00 -2.23 0.00 0.00 60.65 58.95 1xmn s ILE 24 Cb -0.10 -3.03 0.00 0.00 -1.58 0.00 0.00 42.46 37.75 1xmn s ILE 24 CO 0.41 0.00 0.00 0.61 -1.23 0.00 0.00 174.94 174.74 1xmn n GLY 25 N 4.02 0.40 0.23 6.18 0.00 -1.26 -4.89 105.19 109.87 1xmn n GLY 25 Ca 0.16 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.21 1xmn n GLY 25 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1xmn h MET 26 N 0.97 0.16 -2.04 1.61 -1.53 -1.73 -3.31 114.93 109.06 1xmn h MET 26 Ca 0.00 -0.04 -0.55 0.00 -3.44 0.00 0.00 59.70 55.67 1xmn h MET 26 Cb 0.27 -0.02 -0.40 0.00 -0.55 0.00 0.00 31.60 30.91 1xmn h MET 26 CO 0.00 0.35 -1.04 0.45 0.14 0.00 0.00 176.91 176.82 1xmn n SER 27 N -4.25 1.01 0.08 1.39 2.88 -1.26 -4.96 113.62 108.51 1xmn n SER 27 Ca -0.01 -2.91 0.06 0.00 -1.33 0.00 0.00 58.87 54.68 1xmn n SER 27 Cb 0.29 -0.64 0.30 0.00 -0.75 0.00 0.00 64.21 63.42 1xmn n SER 27 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1xmn n PRO 28 N 1.02 0.07 -0.08 -1.46 -0.04 -1.25 -1.23 135.00 132.03 1xmn n PRO 28 Ca 0.24 0.56 0.12 0.00 -0.04 0.00 0.00 63.50 64.38 1xmn n PRO 28 Cb 0.53 -1.73 0.27 0.00 -0.04 0.00 0.00 33.50 32.53 1xmn n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1xmn n TRP 29 N -1.88 0.21 -2.06 0.54 2.14 -1.00 -1.64 117.44 113.74 1xmn n TRP 29 Ca -0.01 -0.10 -0.41 0.00 2.07 0.00 0.00 57.50 59.05 1xmn n TRP 29 Cb 0.02 0.00 -0.02 0.00 -0.81 0.00 0.00 31.31 30.50 1xmn n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1xmn s GLN 30 N -1.79 4.30 0.02 -2.67 2.00 -0.36 -0.30 119.66 120.86 1xmn s GLN 30 Ca 0.34 2.24 0.03 0.00 -2.00 0.00 0.00 55.36 55.98 1xmn s GLN 30 Cb 0.21 -3.12 -0.02 0.00 0.80 0.00 0.00 33.01 30.87 1xmn s GLN 30 CO 0.30 -0.37 -0.10 0.08 -0.50 0.00 0.00 175.29 174.71 1xmn s VAL 31 N -0.06 0.75 -0.13 1.34 1.01 -0.29 -4.01 120.40 119.02 1xmn s VAL 31 Ca 0.58 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.76 1xmn s VAL 31 Cb -0.41 -0.70 -0.03 0.00 0.00 0.00 0.00 36.38 35.24 1xmn s VAL 31 CO 0.43 -0.05 -0.05 -0.04 0.00 0.00 0.00 175.10 175.39 1xmn s MET 32 N -0.93 3.39 -0.30 2.72 1.00 -0.44 -0.99 119.30 123.76 1xmn s MET 32 Ca -0.01 -0.53 -0.09 0.00 0.00 0.00 0.00 55.69 55.06 1xmn s MET 32 Cb -0.07 -2.81 -0.01 0.00 0.00 0.00 0.00 34.83 31.94 1xmn s MET 32 CO 0.00 0.38 0.14 -1.17 0.00 0.00 0.00 175.02 174.37 1xmn s LEU 33 N -0.01 3.99 0.05 -0.03 0.20 -0.69 -1.29 118.68 120.91 1xmn s LEU 33 Ca 0.01 -0.46 0.05 0.00 0.69 0.00 0.00 54.13 54.42 1xmn s LEU 33 Cb -0.13 -1.99 -0.04 0.00 -0.43 0.00 0.00 46.19 43.60 1xmn s LEU 33 CO 0.03 -0.16 -0.08 -0.36 -0.29 0.00 0.00 176.35 175.48 1xmn s PHE 34 N 1.62 2.82 -0.14 5.38 0.40 0.59 -0.63 117.98 128.01 1xmn s PHE 34 Ca 0.05 -0.10 -0.15 0.00 -0.60 0.00 0.00 56.93 56.13 1xmn s PHE 34 Cb -0.17 -1.52 -0.05 0.00 0.51 0.00 0.00 43.02 41.80 1xmn s PHE 34 CO 0.06 0.39 0.36 0.50 0.70 0.00 0.00 175.22 177.24 1xmn s ARG 35 N -1.81 4.26 0.04 0.44 3.52 0.56 -1.71 118.95 124.26 1xmn s ARG 35 Ca 0.19 0.23 -0.29 0.00 -0.13 0.00 0.00 55.73 55.74 1xmn s ARG 35 Cb -0.11 -3.42 -0.17 0.00 -1.56 0.00 0.00 34.95 29.69 1xmn s ARG 35 CO 0.11 0.23 1.44 0.87 -0.81 0.00 0.00 175.30 177.15 1xmn h LYS 36 N 6.59 -0.69 -3.08 5.12 1.57 -1.37 -2.91 116.57 121.80 1xmn h LYS 36 Ca -0.42 0.05 -0.26 0.00 -1.87 0.00 0.00 60.65 58.15 1xmn h LYS 36 Cb 1.17 0.16 -0.34 0.00 0.08 0.00 0.00 32.23 33.30 1xmn h LYS 36 CO 0.75 -0.41 -0.59 0.45 -0.57 0.00 0.00 179.45 179.08 1xmn s SER 36 N -4.65 0.37 0.48 0.86 0.15 -1.26 -2.94 113.70 106.70 1xmn s SER 36 Ca -0.16 0.39 -0.21 0.00 0.70 0.00 0.00 55.95 56.68 1xmn s SER 36 Cb 0.03 0.35 -0.08 0.00 -1.71 0.00 0.00 66.02 64.60 1xmn s SER 36 CO 0.57 -0.21 1.05 -2.16 1.20 0.00 0.00 173.24 173.69 1xmn s PRO 37 N 1.94 3.81 -0.06 5.44 0.04 -1.26 -5.07 135.00 139.85 1xmn s PRO 37 Ca -0.01 1.40 -0.38 0.00 0.04 0.00 0.00 61.00 62.05 1xmn s PRO 37 Cb -0.12 -2.14 -0.16 0.00 0.04 0.00 0.00 34.50 32.13 1xmn s PRO 37 CO -0.07 -0.43 1.54 0.94 0.04 0.00 0.00 177.00 179.03 1xmn n GLN 38 N -0.89 1.29 -3.64 4.56 7.27 -1.15 -4.73 117.38 120.08 1xmn n GLN 38 Ca 0.09 0.47 -0.04 0.00 0.07 0.00 0.00 57.00 57.59 1xmn n GLN 38 Cb 0.52 -2.15 -0.07 0.00 2.41 0.00 0.00 30.24 30.96 1xmn n GLN 38 CO 0.00 0.00 0.00 -2.00 0.07 0.00 0.00 177.06 175.13 1xmn s GLU 39 N 1.88 0.36 -0.47 3.69 2.12 -1.10 -4.98 118.70 120.20 1xmn s GLU 39 Ca 0.90 0.54 -0.28 0.00 0.36 0.00 0.00 54.97 56.49 1xmn s GLU 39 Cb -0.96 0.12 0.03 0.00 0.26 0.00 0.00 34.13 33.58 1xmn s GLU 39 CO 0.54 -0.06 1.11 -1.17 -0.54 0.00 0.00 175.26 175.13 1xmn s LEU 40 N 0.86 3.70 -0.13 2.70 2.96 -1.26 -0.32 118.68 127.19 1xmn s LEU 40 Ca -0.04 0.42 -0.16 0.00 -0.22 0.00 0.00 54.13 54.13 1xmn s LEU 40 Cb -0.04 -3.49 -0.14 0.00 0.50 0.00 0.00 46.19 43.01 1xmn s LEU 40 CO -0.12 -1.22 0.40 -0.07 -1.32 0.00 0.00 176.35 174.02 1xmn h LEU 41 N 11.11 0.00 0.00 -0.68 3.38 -1.22 -3.49 115.31 124.41 1xmn h LEU 41 Ca -0.23 -0.54 -0.07 0.00 0.09 0.00 0.00 57.88 57.13 1xmn h LEU 41 Cb 1.06 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1xmn h LEU 41 CO 1.11 0.81 0.02 0.00 0.09 0.00 0.00 178.44 180.47 1xmn s GLY 43 N -1.92 1.97 0.07 0.00 0.00 0.12 -1.71 107.32 105.85 1xmn s GLY 43 Ca 0.10 -1.81 -0.26 0.00 0.00 0.00 0.00 44.72 42.75 1xmn s GLY 43 CO 0.07 -1.80 1.16 0.00 0.00 0.00 0.00 173.10 172.54 1xmn s ALA 44 N -2.73 -2.02 0.01 3.20 0.00 -0.16 -3.87 121.76 116.20 1xmn s ALA 44 Ca 0.51 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.59 1xmn s ALA 44 Cb -0.04 0.67 -0.01 0.00 0.00 0.00 0.00 23.12 23.74 1xmn s ALA 44 CO 0.32 -1.08 -0.03 -1.54 0.00 0.00 0.00 175.76 173.43 1xmn s SER 45 N -3.33 0.30 -0.24 0.00 1.04 -0.19 -1.14 113.70 110.13 1xmn s SER 45 Ca 0.20 -0.31 -0.21 0.00 0.48 0.00 0.00 55.95 56.12 1xmn s SER 45 Cb 0.00 0.04 -0.02 0.00 0.10 0.00 0.00 66.02 66.14 1xmn s SER 45 CO 0.01 -0.15 0.64 -0.22 0.98 0.00 0.00 173.24 174.50 1xmn s LEU 46 N -0.88 4.09 0.00 2.42 2.96 0.59 -0.68 118.68 127.18 1xmn s LEU 46 Ca -0.08 0.77 0.10 0.00 -0.22 0.00 0.00 54.13 54.69 1xmn s LEU 46 Cb -0.06 -2.89 -0.04 0.00 0.50 0.00 0.00 46.19 43.70 1xmn s LEU 46 CO -0.00 -0.35 0.54 2.30 -1.32 0.00 0.00 176.35 177.52 1xmn n ILE 47 N 5.06 0.00 -3.70 6.68 -5.35 -0.81 -1.73 119.36 119.52 1xmn n ILE 47 Ca -0.00 -0.35 -0.01 0.00 -0.27 0.00 0.00 62.75 62.11 1xmn n ILE 47 Cb 0.49 1.07 -0.01 0.00 -1.74 0.00 0.00 39.64 39.46 1xmn n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1xmn s SER 48 N -1.55 -0.11 0.00 7.28 1.04 -1.20 -4.73 113.70 114.44 1xmn s SER 48 Ca 0.06 -0.28 0.08 0.00 0.48 0.00 0.00 55.95 56.29 1xmn s SER 48 Cb 0.08 0.33 0.34 0.00 0.10 0.00 0.00 66.02 66.86 1xmn s SER 48 CO 0.30 -0.61 1.25 -0.90 0.98 0.00 0.00 173.24 174.27 1xmn n ASP 49 N -0.51 0.01 0.00 7.02 5.75 -1.26 -2.94 116.55 124.62 1xmn n ASP 49 Ca -0.07 0.50 0.00 0.00 -0.01 0.00 0.00 54.79 55.21 1xmn n ASP 49 Cb 0.62 -0.50 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 1xmn n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1xmn n ARG 50 N -1.51 3.47 -5.09 0.11 5.12 -1.26 -1.23 116.66 116.27 1xmn n ARG 50 Ca 0.02 -0.09 -0.28 0.00 -1.93 0.00 0.00 57.85 55.57 1xmn n ARG 50 Cb 0.09 -0.47 -0.16 0.00 -1.16 0.00 0.00 32.46 30.76 1xmn n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1xmn s TRP 51 N -0.52 2.02 -0.06 -1.55 0.52 -1.15 -0.40 118.94 117.81 1xmn s TRP 51 Ca 0.00 -0.45 0.04 0.00 0.02 0.00 0.00 56.10 55.71 1xmn s TRP 51 Cb 0.00 -1.32 -0.00 0.00 -1.15 0.00 0.00 33.47 31.00 1xmn s TRP 51 CO 0.00 -0.09 -0.18 0.08 0.02 0.00 0.00 176.95 176.78 1xmn s VAL 52 N -0.37 1.52 -0.06 4.03 1.01 -0.27 -1.91 120.40 124.35 1xmn s VAL 52 Ca 0.04 -0.75 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 1xmn s VAL 52 Cb -0.10 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.93 1xmn s VAL 52 CO 0.00 0.44 0.09 -0.22 0.00 0.00 0.00 175.10 175.41 1xmn s LEU 53 N 0.17 4.00 0.00 3.92 2.96 0.15 -0.63 118.68 129.25 1xmn s LEU 53 Ca -0.08 0.26 -0.06 0.00 -0.22 0.00 0.00 54.13 54.03 1xmn s LEU 53 Cb -0.13 -2.14 0.02 0.00 0.50 0.00 0.00 46.19 44.44 1xmn s LEU 53 CO 0.03 0.34 0.36 1.07 -1.32 0.00 0.00 176.35 176.83 1xmn n THR 54 N 1.62 0.00 -3.36 3.68 5.66 -0.71 -1.02 114.28 120.14 1xmn n THR 54 Ca -0.16 -0.60 -0.38 0.00 -3.05 0.00 0.00 64.05 59.86 1xmn n THR 54 Cb 0.54 0.51 -0.06 0.00 -1.55 0.00 0.00 70.33 69.77 1xmn n THR 54 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1xmn s ALA 55 N -1.70 3.59 0.43 1.79 0.00 -1.26 -1.73 121.76 122.88 1xmn s ALA 55 Ca 0.10 -0.13 0.15 0.00 0.00 0.00 0.00 51.96 52.08 1xmn s ALA 55 Cb -0.02 -2.56 1.05 0.00 0.00 0.00 0.00 23.12 21.60 1xmn s ALA 55 CO 0.07 0.29 1.94 0.00 0.00 0.00 0.00 175.76 178.06 1xmn h ALA 56 N 5.37 2.09 0.00 0.00 0.00 -1.70 -2.68 119.26 122.34 1xmn h ALA 56 Ca -0.47 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.37 1xmn h ALA 56 Cb 1.20 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.92 1xmn h ALA 56 CO 0.67 -0.27 -0.28 1.12 0.00 0.00 0.00 179.25 180.49 1xmn h HIS 57 N 0.41 0.00 -0.09 0.00 2.07 -1.89 0.57 115.15 116.21 1xmn h HIS 57 Ca 0.34 0.00 0.03 0.00 -2.85 0.00 0.00 60.37 57.89 1xmn h HIS 57 Cb 0.76 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.73 1xmn h HIS 57 CO -0.00 0.28 0.10 0.00 -3.07 0.00 0.00 177.93 175.23 1xmn n LEU 59 N -3.92 1.71 -3.67 0.00 4.77 -0.19 -4.90 117.00 110.80 1xmn n LEU 59 Ca -0.01 -0.06 -0.24 0.00 -0.03 0.00 0.00 56.01 55.68 1xmn n LEU 59 Cb 0.20 -0.22 -0.17 0.00 -2.33 0.00 0.00 43.42 40.90 1xmn n LEU 59 CO 0.28 0.61 -0.35 -0.22 -1.33 0.00 0.00 177.39 176.39 1xmn s LEU 60 N -5.63 0.41 0.17 2.23 2.96 0.02 -1.38 118.68 117.46 1xmn s LEU 60 Ca -0.17 -0.33 -0.19 0.00 -0.22 0.00 0.00 54.13 53.23 1xmn s LEU 60 Cb 0.05 -0.28 0.04 0.00 0.50 0.00 0.00 46.19 46.51 1xmn s LEU 60 CO 0.49 -0.29 0.52 -0.47 -1.32 0.00 0.00 176.35 175.29 1xmn s TYR 60 N 2.09 -0.25 0.00 5.38 5.04 -0.20 -4.16 117.35 125.26 1xmn s TYR 60 Ca 0.03 -0.06 0.00 0.00 -2.44 0.00 0.00 57.07 54.60 1xmn s TYR 60 Cb -0.14 0.42 0.00 0.00 0.35 0.00 0.00 41.96 42.59 1xmn s TYR 60 CO -0.06 -0.86 0.00 -2.30 -1.34 0.00 0.00 175.55 170.98 1xmn n PRO 60 N -0.33 0.00 -0.19 4.97 -0.02 -1.26 -1.87 135.00 136.30 1xmn n PRO 60 Ca -0.13 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.42 1xmn n PRO 60 Cb 0.63 0.00 0.15 0.00 -0.02 0.00 0.00 33.50 34.26 1xmn n PRO 60 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1xmn n TRP 60 N 0.00 0.38 -3.50 6.00 8.01 -1.26 -4.97 117.44 122.11 1xmn n TRP 60 Ca 0.00 -0.75 -0.25 0.00 -1.31 0.00 0.00 57.50 55.19 1xmn n TRP 60 Cb 0.00 -0.15 0.04 0.00 -2.01 0.00 0.00 31.31 29.19 1xmn n TRP 60 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1xmn n ASP 60 N -0.53 -5.55 -4.55 -0.99 -0.08 -1.12 -4.97 116.55 98.75 1xmn n ASP 60 Ca 0.13 -0.52 -0.35 0.00 -1.51 0.00 0.00 54.79 52.55 1xmn n ASP 60 Cb 0.59 -4.44 -0.11 0.00 2.34 0.00 0.00 41.12 39.50 1xmn n ASP 60 CO 0.00 0.00 0.00 -0.54 0.12 0.00 0.00 177.20 176.78 1xmn s LYS 60 N -6.20 3.82 -0.49 -0.67 1.02 -0.78 -5.00 119.74 111.44 1xmn s LYS 60 Ca 0.51 -0.42 0.06 0.00 0.02 0.00 0.00 55.97 56.14 1xmn s LYS 60 Cb -0.24 -3.20 0.22 0.00 -0.52 0.00 0.00 37.83 34.09 1xmn s LYS 60 CO 0.63 0.11 0.84 -1.71 -0.92 0.00 0.00 175.35 174.30 1xmn n ASN 60 N 4.01 -3.05 -4.78 2.83 2.85 -1.24 -1.03 115.26 114.85 1xmn n ASN 60 Ca -0.16 -3.09 -0.36 0.00 -0.11 0.00 0.00 54.58 50.86 1xmn n ASN 60 Cb 0.52 1.76 -0.04 0.00 1.24 0.00 0.00 39.78 43.26 1xmn n ASN 60 CO 0.00 0.00 0.00 -0.36 -2.11 0.00 0.00 177.26 174.79 1xmn s PHE 60 N 0.75 3.27 0.28 1.20 0.08 -0.48 -5.03 117.98 118.06 1xmn s PHE 60 Ca 0.31 1.64 0.08 0.00 0.12 0.00 0.00 56.93 59.09 1xmn s PHE 60 Cb 0.14 -3.12 -0.04 0.00 -0.57 0.00 0.00 43.02 39.43 1xmn s PHE 60 CO -0.17 -0.61 0.10 -0.08 -0.10 0.00 0.00 175.22 174.36 1xmn s THR 60 N -1.67 3.64 0.26 0.64 -1.32 -1.26 -4.92 115.64 111.02 1xmn s THR 60 Ca 0.58 -1.69 -0.03 0.00 -1.21 0.00 0.00 61.69 59.34 1xmn s THR 60 Cb -0.22 -3.05 0.30 0.00 -1.51 0.00 0.00 72.50 68.02 1xmn s THR 60 CO 0.27 -0.31 1.63 -0.33 -2.21 0.00 0.00 174.62 173.67 1xmn h GLU 61 N 1.66 0.13 0.00 7.08 3.07 -1.93 -0.69 114.58 123.90 1xmn h GLU 61 Ca -0.45 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.40 1xmn h GLU 61 Cb 1.25 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.13 1xmn h GLU 61 CO 0.61 0.08 0.00 0.09 -1.40 0.00 0.00 179.01 178.39 1xmn n ASN 62 N -5.32 0.27 0.07 1.42 5.03 -1.26 -2.66 115.26 112.81 1xmn n ASN 62 Ca 0.17 0.57 0.13 0.00 0.87 0.00 0.00 54.58 56.31 1xmn n ASN 62 Cb 0.56 -0.63 0.33 0.00 -1.02 0.00 0.00 39.78 39.03 1xmn n ASN 62 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1xmn n ASP 63 N -1.80 0.65 -4.50 6.41 8.00 -0.26 -4.93 116.55 120.12 1xmn n ASP 63 Ca 0.03 0.33 -0.24 0.00 0.71 0.00 0.00 54.79 55.62 1xmn n ASP 63 Cb 0.19 -0.32 -0.11 0.00 -0.02 0.00 0.00 41.12 40.86 1xmn n ASP 63 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1xmn s LEU 64 N -4.11 2.53 0.02 0.64 1.43 -1.09 -0.97 118.68 117.13 1xmn s LEU 64 Ca 0.09 -1.29 -0.15 0.00 -1.03 0.00 0.00 54.13 51.75 1xmn s LEU 64 Cb 0.14 -0.68 0.02 0.00 0.03 0.00 0.00 46.19 45.71 1xmn s LEU 64 CO 0.64 -0.43 0.33 -0.76 0.23 0.00 0.00 176.35 176.37 1xmn s LEU 65 N -3.54 0.77 0.15 1.79 1.43 -0.70 -4.50 118.68 114.08 1xmn s LEU 65 Ca 0.33 -0.04 0.10 0.00 -1.03 0.00 0.00 54.13 53.48 1xmn s LEU 65 Cb 0.07 1.40 -0.04 0.00 0.03 0.00 0.00 46.19 47.64 1xmn s LEU 65 CO 0.15 -0.56 -0.18 0.68 0.23 0.00 0.00 176.35 176.67 1xmn s VAL 66 N -2.07 2.77 -0.10 -1.59 -7.23 -0.99 -0.30 120.40 110.89 1xmn s VAL 66 Ca -0.08 -1.67 0.02 0.00 -1.81 0.00 0.00 61.98 58.44 1xmn s VAL 66 Cb -0.02 -2.30 0.01 0.00 0.56 0.00 0.00 36.38 34.63 1xmn s VAL 66 CO -0.00 0.01 -0.15 -0.13 -0.31 0.00 0.00 175.10 174.52 1xmn s ARG 67 N -2.39 2.15 0.12 4.82 0.52 -0.41 -1.86 118.95 121.90 1xmn s ARG 67 Ca 0.20 -0.54 0.11 0.00 -0.52 0.00 0.00 55.73 54.97 1xmn s ARG 67 Cb -0.10 -1.81 -0.04 0.00 0.52 0.00 0.00 34.95 33.52 1xmn s ARG 67 CO 0.11 -0.04 -0.27 0.42 0.02 0.00 0.00 175.30 175.54 1xmn s ILE 68 N 0.91 2.26 0.00 1.52 1.01 0.61 -1.32 121.20 126.19 1xmn s ILE 68 Ca -0.08 -1.73 0.00 0.00 0.00 0.00 0.00 60.65 58.83 1xmn s ILE 68 Cb -0.15 -1.99 0.00 0.00 0.01 0.00 0.00 42.46 40.32 1xmn s ILE 68 CO -0.00 0.11 0.00 0.61 0.00 0.00 0.00 174.94 175.66 1xmn n GLY 69 N 0.97 0.59 3.87 6.18 0.00 -1.26 -0.49 105.19 115.05 1xmn n GLY 69 Ca -0.18 -0.24 -0.31 0.00 0.00 0.00 0.00 46.02 45.29 1xmn n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xmn s LYS 70 N -0.61 3.81 0.07 1.61 1.02 -1.26 -4.25 119.74 120.13 1xmn s LYS 70 Ca 0.00 0.45 0.00 0.00 0.02 0.00 0.00 55.97 56.44 1xmn s LYS 70 Cb 0.00 -2.44 0.00 0.00 -0.52 0.00 0.00 37.83 34.87 1xmn s LYS 70 CO 0.00 0.05 0.00 1.58 -0.92 0.00 0.00 175.35 176.06 1xmn n HIS 71 N -1.00 -0.23 -3.27 3.18 -0.00 -1.26 -4.92 115.22 107.71 1xmn n HIS 71 Ca 0.02 0.04 -0.45 0.00 -0.00 0.00 0.00 57.72 57.33 1xmn n HIS 71 Cb 0.54 0.09 -0.06 0.00 -0.00 0.00 0.00 29.99 30.56 1xmn n HIS 71 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1xmn s SER 72 N -5.44 6.18 0.40 0.26 0.15 -1.26 -0.77 113.70 113.22 1xmn s SER 72 Ca 0.00 -1.51 0.09 0.00 0.70 0.00 0.00 55.95 55.23 1xmn s SER 72 Cb 0.00 -2.23 0.30 0.00 -1.71 0.00 0.00 66.02 62.38 1xmn s SER 72 CO 0.00 -0.86 0.74 -1.14 1.20 0.00 0.00 173.24 173.17 1xmn n ARG 73 N 5.56 0.01 0.00 5.44 0.00 0.28 -2.98 116.66 124.97 1xmn n ARG 73 Ca -0.12 0.63 0.00 0.00 -0.00 0.00 0.00 57.85 58.36 1xmn n ARG 73 Cb 0.42 -1.63 0.00 0.00 0.00 0.00 0.00 32.46 31.25 1xmn n ARG 73 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 1xmn n THR 74 N -2.17 0.00 -2.45 5.15 5.66 -1.26 -5.01 114.28 114.21 1xmn n THR 74 Ca 0.08 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.69 1xmn n THR 74 Cb 0.82 -0.70 -0.03 0.00 -1.55 0.00 0.00 70.33 68.86 1xmn n THR 74 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 1xmn s ARG 75 N -1.82 3.23 0.04 1.09 0.52 -1.16 -5.00 118.95 115.86 1xmn s ARG 75 Ca 0.00 -0.55 -0.02 0.00 -0.52 0.00 0.00 55.73 54.64 1xmn s ARG 75 Cb 0.00 -4.82 -0.01 0.00 0.52 0.00 0.00 34.95 30.63 1xmn s ARG 75 CO 0.00 -2.38 -0.00 0.98 0.02 0.00 0.00 175.30 173.92 1xmn n TYR 76 N 10.04 -0.23 -3.59 -0.53 9.36 -1.26 -4.79 117.16 126.15 1xmn n TYR 76 Ca 0.22 0.05 -0.29 0.00 3.32 0.00 0.00 57.90 61.20 1xmn n TYR 76 Cb 0.50 -0.16 -0.13 0.00 -0.63 0.00 0.00 39.34 38.91 1xmn n TYR 76 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 1xmn s GLU 77 N -0.09 0.69 0.48 2.98 2.02 -1.26 -5.05 118.70 118.46 1xmn s GLU 77 Ca 0.06 -1.28 -0.24 0.00 0.02 0.00 0.00 54.97 53.53 1xmn s GLU 77 Cb -0.05 -1.66 -0.07 0.00 0.10 0.00 0.00 34.13 32.44 1xmn s GLU 77 CO 0.06 -1.11 1.36 2.89 0.02 0.00 0.00 175.26 178.47 1xmn n ARG 77 N 4.33 1.96 -1.30 1.61 -4.01 -1.26 -2.36 116.66 115.62 1xmn n ARG 77 Ca 0.05 0.70 -0.12 0.00 -1.04 0.00 0.00 57.85 57.44 1xmn n ARG 77 Cb 0.38 -2.54 -0.05 0.00 -3.04 0.00 0.00 32.46 27.21 1xmn n ARG 77 CO 0.00 0.00 0.00 0.09 -3.04 0.00 0.00 177.63 174.68 1xmn n ASN 78 N -0.37 -4.81 0.03 2.89 4.13 -1.26 -4.69 115.26 111.18 1xmn n ASN 78 Ca 0.07 0.30 0.00 0.00 1.68 0.00 0.00 54.58 56.64 1xmn n ASN 78 Cb 0.42 -3.84 0.00 0.00 -1.54 0.00 0.00 39.78 34.82 1xmn n ASN 78 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 1xmn n ILE 79 N -2.02 0.29 -1.81 2.41 5.41 -1.17 -5.09 119.36 117.38 1xmn n ILE 79 Ca -0.12 0.09 -0.34 0.00 1.00 0.00 0.00 62.75 63.38 1xmn n ILE 79 Cb 0.53 -0.85 0.05 0.00 -0.71 0.00 0.00 39.64 38.66 1xmn n ILE 79 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 1xmn s GLU 80 N -1.35 2.79 0.06 0.38 -1.05 -1.00 -4.78 118.70 113.75 1xmn s GLU 80 Ca 0.00 1.54 0.01 0.00 -0.15 0.00 0.00 54.97 56.36 1xmn s GLU 80 Cb 0.00 -1.94 -0.03 0.00 -0.44 0.00 0.00 34.13 31.72 1xmn s GLU 80 CO 0.00 -1.28 -0.05 0.15 0.95 0.00 0.00 175.26 175.03 1xmn s LYS 81 N -3.85 0.61 0.16 -4.83 -0.14 0.35 -4.98 119.74 107.06 1xmn s LYS 81 Ca 0.70 -1.05 0.10 0.00 -1.36 0.00 0.00 55.97 54.36 1xmn s LYS 81 Cb -0.24 -0.03 -0.04 0.00 -1.68 0.00 0.00 37.83 35.84 1xmn s LYS 81 CO 0.39 -0.04 -0.23 0.96 -0.76 0.00 0.00 175.35 175.67 1xmn s ILE 82 N -2.89 2.10 0.03 2.17 -4.36 -1.26 -0.28 121.20 116.70 1xmn s ILE 82 Ca 0.01 -1.87 -0.04 0.00 -0.26 0.00 0.00 60.65 58.48 1xmn s ILE 82 Cb 0.00 -1.94 -0.01 0.00 1.25 0.00 0.00 42.46 41.76 1xmn s ILE 82 CO -0.05 -0.12 0.07 -0.44 0.24 0.00 0.00 174.94 174.64 1xmn s SER 83 N -2.43 0.19 0.16 4.36 0.01 -0.78 -4.99 113.70 110.22 1xmn s SER 83 Ca 0.16 -0.51 0.01 0.00 1.31 0.00 0.00 55.95 56.92 1xmn s SER 83 Cb -0.08 0.19 -0.04 0.00 0.21 0.00 0.00 66.02 66.30 1xmn s SER 83 CO 0.07 -0.45 0.31 -0.04 0.41 0.00 0.00 173.24 173.55 1xmn s MET 84 N -2.25 3.47 -0.22 12.44 -1.94 -1.26 -2.35 119.30 127.18 1xmn s MET 84 Ca -0.08 -0.50 -0.16 0.00 -1.71 0.00 0.00 55.69 53.25 1xmn s MET 84 Cb -0.03 -2.93 -0.04 0.00 2.01 0.00 0.00 34.83 33.84 1xmn s MET 84 CO -0.03 0.49 0.40 -0.51 -0.01 0.00 0.00 175.02 175.36 1xmn s LEU 85 N -3.18 4.12 -0.08 -0.03 2.01 -1.26 -1.02 118.68 119.23 1xmn s LEU 85 Ca 0.36 0.46 -0.26 0.00 0.01 0.00 0.00 54.13 54.70 1xmn s LEU 85 Cb -0.11 -2.50 -0.26 0.00 0.01 0.00 0.00 46.19 43.33 1xmn s LEU 85 CO 0.29 -0.12 0.91 -0.08 1.01 0.00 0.00 176.35 178.36 1xmn h GLU 86 N 7.62 0.14 -2.54 1.70 4.57 -0.28 -3.44 114.58 122.35 1xmn h GLU 86 Ca -0.34 -0.19 -0.09 0.00 -1.18 0.00 0.00 59.36 57.56 1xmn h GLU 86 Cb 1.16 0.06 -0.21 0.00 -0.16 0.00 0.00 28.75 29.61 1xmn h GLU 86 CO 0.70 1.01 -0.08 0.21 -1.18 0.00 0.00 179.01 179.67 1xmn s LYS 87 N -2.67 0.77 -0.10 1.92 2.47 -1.15 -4.97 119.74 116.01 1xmn s LYS 87 Ca -0.16 0.24 -0.02 0.00 -1.56 0.00 0.00 55.97 54.47 1xmn s LYS 87 Cb -0.01 0.36 -0.03 0.00 -1.46 0.00 0.00 37.83 36.69 1xmn s LYS 87 CO 0.74 -0.19 -0.03 0.42 0.16 0.00 0.00 175.35 176.45 1xmn s ILE 88 N -0.76 4.04 -0.24 5.43 1.01 -1.26 -1.32 121.20 128.10 1xmn s ILE 88 Ca -0.08 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.23 1xmn s ILE 88 Cb -0.03 -2.70 0.07 0.00 0.01 0.00 0.00 42.46 39.80 1xmn s ILE 88 CO 0.05 0.58 -0.02 -0.31 0.00 0.00 0.00 174.94 175.23 1xmn s TYR 89 N -0.55 2.17 -0.12 3.97 1.51 0.54 -5.00 117.35 119.86 1xmn s TYR 89 Ca 0.09 -1.66 -0.07 0.00 -1.01 0.00 0.00 57.07 54.42 1xmn s TYR 89 Cb -0.12 -1.56 -0.04 0.00 -0.11 0.00 0.00 41.96 40.13 1xmn s TYR 89 CO 0.02 -0.76 0.13 0.42 -1.11 0.00 0.00 175.55 174.25 1xmn s ILE 90 N 1.47 5.41 0.16 2.71 1.01 -1.26 -0.20 121.20 130.51 1xmn s ILE 90 Ca -0.03 0.17 -0.34 0.00 0.00 0.00 0.00 60.65 60.46 1xmn s ILE 90 Cb -0.18 -3.36 -0.14 0.00 0.01 0.00 0.00 42.46 38.79 1xmn s ILE 90 CO -0.08 0.61 1.58 1.57 0.00 0.00 0.00 174.94 178.61 1xmn n HIS 91 N 2.07 2.28 0.33 3.97 -0.00 -1.03 -4.83 115.22 118.01 1xmn n HIS 91 Ca -0.20 0.27 0.21 0.00 -0.00 0.00 0.00 57.72 58.00 1xmn n HIS 91 Cb 0.55 -2.54 1.13 0.00 -0.00 0.00 0.00 29.99 29.12 1xmn n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1xmn h PRO 92 N 5.89 0.00 -0.30 1.57 0.13 -1.95 -1.98 132.00 135.36 1xmn h PRO 92 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1xmn h PRO 92 Cb 1.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.38 1xmn h PRO 92 CO 0.89 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.20 1xmn n ARG 93 N -3.12 2.93 -1.68 0.86 1.74 -1.26 -5.00 116.66 111.12 1xmn n ARG 93 Ca -0.03 -2.54 -0.44 0.00 -0.77 0.00 0.00 57.85 54.07 1xmn n ARG 93 Cb 0.13 -1.63 -0.04 0.00 -1.02 0.00 0.00 32.46 29.90 1xmn n ARG 93 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 1xmn n TYR 94 N -0.11 2.50 -3.39 -1.55 9.36 -0.75 -4.79 117.16 118.44 1xmn n TYR 94 Ca 0.18 -0.05 -0.44 0.00 3.32 0.00 0.00 57.90 60.90 1xmn n TYR 94 Cb 0.72 -2.69 -0.02 0.00 -0.63 0.00 0.00 39.34 36.73 1xmn n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1xmn s ASN 95 N 2.69 6.92 0.37 2.98 3.84 -0.23 -4.83 114.94 126.69 1xmn s ASN 95 Ca 0.84 -3.31 0.20 0.00 0.21 0.00 0.00 52.86 50.80 1xmn s ASN 95 Cb -0.56 -2.16 0.29 0.00 -0.55 0.00 0.00 41.25 38.26 1xmn s ASN 95 CO 0.40 -0.36 1.56 4.11 -2.79 0.00 0.00 177.10 180.02 1xmn h TRP 96 N 6.94 0.00 0.00 0.43 5.08 -1.91 0.19 115.95 126.69 1xmn h TRP 96 Ca 0.15 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 60.06 1xmn h TRP 96 Cb 0.92 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.07 1xmn h TRP 96 CO 0.84 0.24 -0.27 0.00 -1.28 0.00 0.00 178.44 177.97 1xmn h ARG 97 N 0.00 0.00 0.00 0.12 3.08 -2.00 -3.43 114.38 112.14 1xmn h ARG 97 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1xmn h ARG 97 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1xmn h ARG 97 CO 0.03 0.27 0.00 -1.91 -1.07 0.00 0.00 179.97 177.29 1xmn n GLU 97 N -3.95 0.00 -0.11 0.04 2.13 -1.24 -5.01 120.64 112.49 1xmn n GLU 97 Ca -0.02 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.82 1xmn n GLU 97 Cb 0.34 -0.17 0.02 0.00 0.27 0.00 0.00 31.44 31.91 1xmn n GLU 97 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 1xmn n ASN 98 N -2.97 0.92 -1.74 4.31 0.23 -1.23 -4.95 115.26 109.82 1xmn n ASN 98 Ca 0.00 -1.80 -0.16 0.00 -0.53 0.00 0.00 54.58 52.09 1xmn n ASN 98 Cb 0.00 -0.11 -0.01 0.00 -2.08 0.00 0.00 39.78 37.58 1xmn n ASN 98 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 1xmn n LEU 99 N -0.36 -1.67 -4.73 -4.53 4.32 0.68 -4.93 117.00 105.78 1xmn n LEU 99 Ca 0.02 0.01 -0.42 0.00 -0.02 0.00 0.00 56.01 55.61 1xmn n LEU 99 Cb 0.49 -2.32 -0.03 0.00 -1.62 0.00 0.00 43.42 39.95 1xmn n LEU 99 CO 0.00 -0.21 1.29 -0.62 -1.22 0.00 0.00 177.39 176.63 1xmn s ASP 100 N -2.33 6.46 -0.98 -1.43 2.15 -1.21 -2.32 116.67 117.00 1xmn s ASP 100 Ca 0.00 2.79 -0.00 0.00 0.43 0.00 0.00 52.55 55.77 1xmn s ASP 100 Cb 0.00 -2.61 -0.00 0.00 -0.30 0.00 0.00 42.92 40.01 1xmn s ASP 100 CO 0.00 -0.90 0.82 0.54 -0.17 0.00 0.00 175.17 175.46 1xmn n ARG 101 N 3.58 -5.29 -2.50 4.34 1.74 -1.26 -1.06 116.66 116.20 1xmn n ARG 101 Ca 0.13 0.70 -0.42 0.00 -0.77 0.00 0.00 57.85 57.49 1xmn n ARG 101 Cb 0.37 -5.26 -0.00 0.00 -1.02 0.00 0.00 32.46 26.55 1xmn n ARG 101 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1xmn n ASP 102 N -2.75 4.75 -3.79 0.55 2.03 -0.98 -4.39 116.55 111.97 1xmn n ASP 102 Ca -0.23 -2.90 -0.13 0.00 0.52 0.00 0.00 54.79 52.05 1xmn n ASP 102 Cb 0.64 -1.74 -0.10 0.00 -0.72 0.00 0.00 41.12 39.20 1xmn n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1xmn s ILE 103 N 4.66 0.04 -0.02 5.18 2.07 -1.26 -3.78 121.20 128.08 1xmn s ILE 103 Ca 0.55 -0.34 -0.24 0.00 -1.41 0.00 0.00 60.65 59.21 1xmn s ILE 103 Cb 0.04 -0.50 0.05 0.00 0.13 0.00 0.00 42.46 42.18 1xmn s ILE 103 CO 0.08 -0.19 0.51 0.00 -1.91 0.00 0.00 174.94 173.43 1xmn s ALA 104 N -0.79 -1.33 0.04 1.50 0.00 -0.70 -2.47 121.76 118.01 1xmn s ALA 104 Ca -0.09 0.83 0.07 0.00 0.00 0.00 0.00 51.96 52.77 1xmn s ALA 104 Cb -0.04 0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.13 1xmn s ALA 104 CO 0.02 -0.35 -0.17 -0.51 0.00 0.00 0.00 175.76 174.76 1xmn s LEU 105 N -1.36 2.67 -0.14 0.00 1.43 0.72 -1.73 118.68 120.28 1xmn s LEU 105 Ca -0.11 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 52.59 1xmn s LEU 105 Cb -0.02 -1.55 0.02 0.00 0.03 0.00 0.00 46.19 44.67 1xmn s LEU 105 CO 0.06 0.26 -0.12 -0.04 0.23 0.00 0.00 176.35 176.74 1xmn s MET 106 N -1.45 2.01 -0.25 1.70 -1.94 0.20 -0.34 119.30 119.24 1xmn s MET 106 Ca 0.15 -0.44 -0.20 0.00 -1.71 0.00 0.00 55.69 53.48 1xmn s MET 106 Cb -0.11 -1.91 -0.02 0.00 2.01 0.00 0.00 34.83 34.80 1xmn s MET 106 CO 0.06 -0.25 0.62 0.21 -0.01 0.00 0.00 175.02 175.65 1xmn s LYS 107 N 1.57 4.12 0.37 2.03 2.20 -0.43 -1.11 119.74 128.48 1xmn s LYS 107 Ca 0.05 0.55 -0.26 0.00 -0.36 0.00 0.00 55.97 55.95 1xmn s LYS 107 Cb -0.13 -3.64 -0.09 0.00 -1.51 0.00 0.00 37.83 32.47 1xmn s LYS 107 CO -0.10 -0.38 1.11 -0.51 -0.36 0.00 0.00 175.35 175.11 1xmn s LEU 108 N 2.40 4.28 0.22 5.43 1.43 0.47 0.42 118.68 133.32 1xmn s LEU 108 Ca 0.26 2.23 -0.09 0.00 -1.03 0.00 0.00 54.13 55.50 1xmn s LEU 108 Cb -0.16 -3.97 0.18 0.00 0.03 0.00 0.00 46.19 42.27 1xmn s LEU 108 CO 0.09 -0.47 1.85 0.50 0.23 0.00 0.00 176.35 178.55 1xmn h LYS 109 N 2.92 1.12 -5.44 1.70 3.64 -1.37 -3.42 116.57 115.72 1xmn h LYS 109 Ca -0.48 -0.11 -0.45 0.00 -1.27 0.00 0.00 60.65 58.33 1xmn h LYS 109 Cb 1.22 -0.23 -0.23 0.00 -0.41 0.00 0.00 32.23 32.58 1xmn h LYS 109 CO 0.64 0.81 -0.79 0.15 -2.27 0.00 0.00 179.45 177.98 1xmn s LYS 110 N -5.92 0.94 0.30 1.90 1.02 -1.26 -4.98 119.74 111.75 1xmn s LYS 110 Ca -0.13 -0.86 -0.29 0.00 0.02 0.00 0.00 55.97 54.71 1xmn s LYS 110 Cb 0.16 -0.98 -0.10 0.00 -0.52 0.00 0.00 37.83 36.39 1xmn s LYS 110 CO 0.81 0.23 1.34 -1.25 -0.92 0.00 0.00 175.35 175.56 1xmn s PRO 111 N -1.40 4.33 0.22 -1.68 0.04 -1.26 -4.88 135.00 130.37 1xmn s PRO 111 Ca 0.01 2.23 -0.13 0.00 0.04 0.00 0.00 61.00 63.16 1xmn s PRO 111 Cb -0.09 -3.09 -0.07 0.00 0.04 0.00 0.00 34.50 31.29 1xmn s PRO 111 CO 0.02 -0.25 0.59 0.54 0.04 0.00 0.00 177.00 177.93 1xmn s VAL 112 N -0.78 4.84 -0.03 -0.36 0.11 -0.36 -5.03 120.40 118.79 1xmn s VAL 112 Ca 0.52 0.72 -0.18 0.00 -2.93 0.00 0.00 61.98 60.11 1xmn s VAL 112 Cb -0.40 -3.67 -0.05 0.00 -1.53 0.00 0.00 36.38 30.73 1xmn s VAL 112 CO 0.50 0.03 0.50 0.00 -3.33 0.00 0.00 175.10 172.80 1xmn s ALA 113 N -1.71 3.56 0.54 1.54 0.00 -1.26 -4.77 121.76 119.66 1xmn s ALA 113 Ca 0.45 -0.12 -0.17 0.00 0.00 0.00 0.00 51.96 52.12 1xmn s ALA 113 Cb -0.13 -2.59 -0.06 0.00 0.00 0.00 0.00 23.12 20.34 1xmn s ALA 113 CO 0.20 0.23 1.03 -0.06 0.00 0.00 0.00 175.76 177.16 1xmn s PHE 114 N -0.30 3.12 0.00 0.00 0.08 -1.26 -4.87 117.98 114.74 1xmn s PHE 114 Ca 0.27 1.53 0.00 0.00 0.12 0.00 0.00 56.93 58.84 1xmn s PHE 114 Cb -0.17 -2.96 0.00 0.00 -0.57 0.00 0.00 43.02 39.32 1xmn s PHE 114 CO 0.14 -0.79 0.00 -1.13 -0.10 0.00 0.00 175.22 173.34 1xmn n SER 115 N -1.55 0.00 0.15 1.36 3.41 -0.14 -4.94 113.62 111.91 1xmn n SER 115 Ca 0.08 -0.57 0.13 0.00 -0.26 0.00 0.00 58.87 58.25 1xmn n SER 115 Cb 0.53 0.00 0.47 0.00 -0.26 0.00 0.00 64.21 64.96 1xmn n SER 115 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1xmn h ASP 116 N 0.00 0.00 -0.00 4.04 3.32 -1.99 -3.18 116.42 118.61 1xmn h ASP 116 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1xmn h ASP 116 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1xmn h ASP 116 CO 0.00 0.00 -0.35 -1.22 -1.72 0.00 0.00 179.24 175.95 1xmn n TYR 117 N -2.42 0.00 -3.91 4.55 4.01 -1.26 -4.78 117.16 113.34 1xmn n TYR 117 Ca 0.03 0.00 -0.28 0.00 -0.16 0.00 0.00 57.90 57.49 1xmn n TYR 117 Cb 0.32 0.00 -0.16 0.00 -0.31 0.00 0.00 39.34 39.18 1xmn n TYR 117 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1xmn s ILE 118 N -1.69 1.19 -0.27 -0.72 1.01 -1.20 -4.34 121.20 115.18 1xmn s ILE 118 Ca 0.03 -0.61 -0.23 0.00 0.00 0.00 0.00 60.65 59.85 1xmn s ILE 118 Cb 0.06 -1.30 0.07 0.00 0.01 0.00 0.00 42.46 41.30 1xmn s ILE 118 CO 0.31 0.21 0.71 -2.28 0.00 0.00 0.00 174.94 173.89 1xmn s HIS 119 N 1.61 -0.84 0.49 3.97 2.46 -0.65 -0.97 115.29 121.35 1xmn s HIS 119 Ca 0.02 1.96 -0.21 0.00 0.47 0.00 0.00 55.06 57.30 1xmn s HIS 119 Cb -0.15 0.35 -0.08 0.00 -0.13 0.00 0.00 32.58 32.57 1xmn s HIS 119 CO -0.08 -0.41 1.07 -1.25 -2.47 0.00 0.00 174.74 171.60 1xmn s PRO 120 N 0.65 3.72 0.36 2.88 0.04 -1.26 -2.39 135.00 139.00 1xmn s PRO 120 Ca -0.02 1.47 0.01 0.00 0.04 0.00 0.00 61.00 62.50 1xmn s PRO 120 Cb -0.05 -2.14 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 1xmn s PRO 120 CO -0.04 -0.52 0.55 0.54 0.04 0.00 0.00 177.00 177.58 1xmn s VAL 121 N -1.86 4.88 0.26 -0.36 0.11 -0.70 -4.93 120.40 117.80 1xmn s VAL 121 Ca 0.67 -0.53 -0.09 0.00 -2.93 0.00 0.00 61.98 59.10 1xmn s VAL 121 Cb -0.20 -3.78 -0.07 0.00 -1.53 0.00 0.00 36.38 30.81 1xmn s VAL 121 CO 0.24 -0.49 0.58 0.00 -3.33 0.00 0.00 175.10 172.10 1xmn s LEU 123 N -3.04 4.39 0.45 0.00 1.43 -1.26 -0.87 118.68 119.79 1xmn s LEU 123 Ca 0.48 0.60 -0.25 0.00 -1.03 0.00 0.00 54.13 53.93 1xmn s LEU 123 Cb -0.11 -2.25 -0.08 0.00 0.03 0.00 0.00 46.19 43.78 1xmn s LEU 123 CO 0.23 0.34 1.36 -2.16 0.23 0.00 0.00 176.35 176.34 1xmn s PRO 124 N -0.79 3.68 0.43 1.29 0.04 -1.26 -4.93 135.00 133.46 1xmn s PRO 124 Ca 0.17 2.26 0.08 0.00 0.04 0.00 0.00 61.00 63.55 1xmn s PRO 124 Cb -0.13 -2.60 -0.00 0.00 0.04 0.00 0.00 34.50 31.81 1xmn s PRO 124 CO 0.06 -0.76 0.49 0.16 0.04 0.00 0.00 177.00 176.99 1xmn s ASP 125 N -0.72 5.36 0.22 6.66 1.47 -1.26 -4.87 116.67 123.52 1xmn s ASP 125 Ca 0.62 -0.59 -0.16 0.00 1.18 0.00 0.00 52.55 53.60 1xmn s ASP 125 Cb -0.40 -0.57 0.23 0.00 -0.34 0.00 0.00 42.92 41.83 1xmn s ASP 125 CO 0.51 -0.74 1.58 -0.09 0.68 0.00 0.00 175.17 177.11 1xmn h ARG 126 N 0.79 -0.07 -0.63 2.11 2.43 -1.98 -1.68 114.38 115.36 1xmn h ARG 126 Ca -0.40 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 58.69 1xmn h ARG 126 Cb 1.27 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.82 1xmn h ARG 126 CO 0.50 -0.05 0.08 0.93 -1.51 0.00 0.00 179.97 179.93 1xmn h GLU 127 N -0.07 1.05 -0.65 0.20 5.08 -2.03 -2.19 114.58 115.97 1xmn h GLU 127 Ca 0.31 -0.29 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1xmn h GLU 127 Cb 0.57 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.70 1xmn h GLU 127 CO -0.79 0.99 0.00 2.41 -1.00 0.00 0.00 179.01 180.62 1xmn n THR 128 N -4.25 0.03 0.00 1.13 -1.04 -0.63 -0.83 114.28 108.69 1xmn n THR 128 Ca 0.03 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.04 1xmn n THR 128 Cb 0.30 -0.20 0.00 0.00 -1.82 0.00 0.00 70.33 68.61 1xmn n THR 128 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xmn n ALA 129 N 0.61 0.00 0.10 2.41 0.00 -0.82 -0.39 120.51 122.41 1xmn n ALA 129 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 1xmn n ALA 129 Cb 0.03 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.51 1xmn n ALA 129 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1xmn h SER 129 N 0.00 0.04 0.00 0.00 4.64 -1.26 -3.38 113.55 113.60 1xmn h SER 129 Ca 0.00 -0.03 -0.35 0.00 -0.47 0.00 0.00 61.79 60.93 1xmn h SER 129 Cb 0.00 -0.01 -0.07 0.00 -0.31 0.00 0.00 62.40 62.01 1xmn h SER 129 CO 0.00 0.83 -2.33 0.18 -0.87 0.00 0.00 176.83 174.64 1xmn n LEU 129 N -3.61 0.04 -4.30 5.97 4.77 0.47 -4.76 117.00 115.59 1xmn n LEU 129 Ca -0.01 -0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.54 1xmn n LEU 129 Cb 0.77 0.46 -0.00 0.00 -2.33 0.00 0.00 43.42 42.32 1xmn n LEU 129 CO 0.45 0.48 2.21 0.18 -1.33 0.00 0.00 177.39 179.38 1xmn n LEU 130 N -2.72 5.55 -4.00 2.23 4.77 -1.26 -4.84 117.00 116.73 1xmn n LEU 130 Ca -0.32 -3.98 -0.14 0.00 -0.03 0.00 0.00 56.01 51.54 1xmn n LEU 130 Cb 1.13 -1.72 -0.13 0.00 -2.33 0.00 0.00 43.42 40.37 1xmn n LEU 130 CO 0.41 0.45 -0.40 -1.10 -1.33 0.00 0.00 177.39 175.42 1xmn s GLN 131 N 3.91 0.43 0.33 3.23 -0.21 -1.26 -4.94 119.66 121.16 1xmn s GLN 131 Ca 0.52 -0.46 -0.29 0.00 0.02 0.00 0.00 55.36 55.14 1xmn s GLN 131 Cb 0.07 -0.29 -0.12 0.00 1.00 0.00 0.00 33.01 33.67 1xmn s GLN 131 CO 0.03 0.07 1.51 0.00 -2.12 0.00 0.00 175.29 174.77 1xmn n ALA 132 N 2.19 2.25 0.00 6.09 0.00 -1.26 -2.04 120.51 127.74 1xmn n ALA 132 Ca -0.18 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1xmn n ALA 132 Cb 0.56 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.60 1xmn n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xmn n GLY 133 N 1.31 3.10 3.72 0.00 0.00 0.06 -4.94 105.19 108.44 1xmn n GLY 133 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 1xmn n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xmn s TYR 134 N -2.67 3.40 0.10 1.61 1.51 -0.86 -4.61 117.35 115.83 1xmn s TYR 134 Ca 0.00 1.25 -0.15 0.00 -1.01 0.00 0.00 57.07 57.17 1xmn s TYR 134 Cb 0.00 -3.48 -0.06 0.00 -0.11 0.00 0.00 41.96 38.31 1xmn s TYR 134 CO 0.00 -1.49 0.51 0.15 -1.11 0.00 0.00 175.55 173.61 1xmn s LYS 135 N 0.80 3.97 0.46 -0.62 1.02 -1.26 -0.45 119.74 123.66 1xmn s LYS 135 Ca 0.59 0.47 0.03 0.00 0.02 0.00 0.00 55.97 57.08 1xmn s LYS 135 Cb -0.32 -3.04 -0.04 0.00 -0.52 0.00 0.00 37.83 33.91 1xmn s LYS 135 CO 0.31 0.56 0.02 0.20 -0.92 0.00 0.00 175.35 175.51 1xmn s GLY 136 N -1.51 2.77 -0.08 -3.33 0.00 0.72 -4.85 107.32 101.04 1xmn s GLY 136 Ca 0.33 -1.19 0.04 0.00 0.00 0.00 0.00 44.72 43.90 1xmn s GLY 136 CO 0.18 -2.12 -0.20 -1.60 0.00 0.00 0.00 173.10 169.36 1xmn s ARG 137 N -3.81 2.48 -0.05 2.90 3.52 0.97 -0.76 118.95 124.21 1xmn s ARG 137 Ca 0.19 -0.71 0.05 0.00 -0.13 0.00 0.00 55.73 55.12 1xmn s ARG 137 Cb 0.05 -1.95 -0.02 0.00 -1.56 0.00 0.00 34.95 31.47 1xmn s ARG 137 CO 0.10 0.15 -0.18 0.08 -0.81 0.00 0.00 175.30 174.64 1xmn s VAL 138 N 0.37 2.69 0.06 7.11 1.01 0.15 -0.87 120.40 130.92 1xmn s VAL 138 Ca -0.15 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.01 1xmn s VAL 138 Cb -0.16 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1xmn s VAL 138 CO 0.06 0.58 -0.12 0.42 0.00 0.00 0.00 175.10 176.04 1xmn s THR 139 N -0.60 0.95 0.00 3.92 -4.23 -1.23 -1.64 115.64 112.82 1xmn s THR 139 Ca 0.09 -1.18 0.00 0.00 -1.18 0.00 0.00 61.69 59.42 1xmn s THR 139 Cb -0.11 -0.93 0.00 0.00 1.34 0.00 0.00 72.50 72.80 1xmn s THR 139 CO 0.01 -0.22 0.00 0.61 -0.54 0.00 0.00 174.62 174.47 1xmn n GLY 140 N 1.45 1.06 1.08 3.99 0.00 -0.86 -4.51 105.19 107.40 1xmn n GLY 140 Ca -0.21 -0.90 0.08 0.00 0.00 0.00 0.00 46.02 44.99 1xmn n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1xmn n TRP 141 N -0.38 1.11 -0.93 1.61 8.01 -1.26 -2.05 117.44 123.55 1xmn n TRP 141 Ca 0.00 -0.79 -0.19 0.00 -1.31 0.00 0.00 57.50 55.21 1xmn n TRP 141 Cb 0.00 -0.31 0.15 0.00 -2.01 0.00 0.00 31.31 29.15 1xmn n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1xmn n GLY 142 N -0.08 -2.50 3.64 6.99 0.00 -1.26 -4.33 105.19 107.66 1xmn n GLY 142 Ca 0.22 -1.50 -0.43 0.00 0.00 0.00 0.00 46.02 44.30 1xmn n GLY 142 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xmn n ASN 143 N -4.10 1.99 -0.00 1.61 5.03 -0.53 -3.41 115.26 115.85 1xmn n ASN 143 Ca 0.10 1.19 0.14 0.00 0.87 0.00 0.00 54.58 56.87 1xmn n ASN 143 Cb 0.37 -1.38 0.63 0.00 -1.02 0.00 0.00 39.78 38.37 1xmn n ASN 143 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1xmn n LEU 144 N 0.97 0.01 -3.55 3.41 4.77 -0.92 -1.27 117.00 120.41 1xmn n LEU 144 Ca 0.07 0.48 -0.08 0.00 -0.03 0.00 0.00 56.01 56.45 1xmn n LEU 144 Cb 0.34 -0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 1xmn n LEU 144 CO 0.61 0.00 0.78 -1.59 -1.33 0.00 0.00 177.39 175.86 1xmn s LYS 145 N -2.97 0.64 0.01 3.23 0.00 -1.26 -4.30 119.74 115.09 1xmn s LYS 145 Ca 0.15 -0.11 -0.36 0.00 0.00 0.00 0.00 55.97 55.65 1xmn s LYS 145 Cb 0.19 0.30 -0.15 0.00 0.00 0.00 0.00 37.83 38.17 1xmn s LYS 145 CO 0.53 -0.25 1.57 -1.91 0.00 0.00 0.00 175.35 175.28 1xmn n GLU 146 N 0.13 1.60 -4.55 1.78 2.13 -1.26 -4.94 120.64 115.53 1xmn n GLU 146 Ca -0.07 0.58 -0.21 0.00 0.66 0.00 0.00 57.16 58.11 1xmn n GLU 146 Cb 0.60 -2.30 -0.15 0.00 0.27 0.00 0.00 31.44 29.85 1xmn n GLU 146 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1xmn s THR 147 N 1.72 0.98 -0.03 6.31 2.01 -1.26 -5.01 115.64 120.37 1xmn s THR 147 Ca 0.87 -0.51 0.04 0.00 0.31 0.00 0.00 61.69 62.40 1xmn s THR 147 Cb -0.85 -0.83 0.06 0.00 0.01 0.00 0.00 72.50 70.88 1xmn s THR 147 CO 0.48 0.29 0.94 0.79 -0.69 0.00 0.00 174.62 176.43 1xmn n TRP 147 N 2.96 0.00 0.00 4.92 7.02 -1.26 -5.13 117.44 125.94 1xmn n TRP 147 Ca -0.16 -0.26 0.00 0.00 -1.02 0.00 0.00 57.50 56.07 1xmn n TRP 147 Cb 0.55 -0.06 0.00 0.00 -2.42 0.00 0.00 31.31 29.38 1xmn n TRP 147 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1xmn n THR 147 N -0.35 0.00 -0.65 -0.99 -2.24 -1.26 -5.36 114.28 103.42 1xmn n THR 147 Ca 0.03 0.27 0.00 0.00 -2.27 0.00 0.00 64.05 62.08 1xmn n THR 147 Cb 0.61 -1.24 0.00 0.00 -2.10 0.00 0.00 70.33 67.60 1xmn n THR 147 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xmn n GLY 150 N 2.39 5.39 3.85 3.38 0.00 -1.26 -5.35 105.19 113.59 1xmn n GLY 150 Ca 0.00 -1.32 -0.36 0.00 0.00 0.00 0.00 46.02 44.33 1xmn n GLY 150 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xmn s GLN 151 N 4.03 3.37 0.40 1.61 -1.52 -1.26 -2.17 119.66 124.11 1xmn s GLN 151 Ca 0.00 -0.20 -0.26 0.00 -1.95 0.00 0.00 55.36 52.96 1xmn s GLN 151 Cb 0.00 -3.12 -0.09 0.00 -0.22 0.00 0.00 33.01 29.59 1xmn s GLN 151 CO 0.00 0.76 1.27 -2.14 -0.25 0.00 0.00 175.29 174.92 1xmn s PRO 152 N -1.11 3.99 -0.07 2.91 0.02 -1.26 -4.97 135.00 134.51 1xmn s PRO 152 Ca 0.16 2.08 -0.21 0.00 0.02 0.00 0.00 61.00 63.05 1xmn s PRO 152 Cb -0.12 -2.74 -0.30 0.00 0.02 0.00 0.00 34.50 31.36 1xmn s PRO 152 CO 0.05 -0.45 0.79 0.77 -0.33 0.00 0.00 177.00 177.84 1xmn h SER 153 N 2.68 0.41 -2.94 2.53 0.02 -1.96 -3.43 113.55 110.86 1xmn h SER 153 Ca -0.49 -0.92 -0.63 0.00 -0.84 0.00 0.00 61.79 58.90 1xmn h SER 153 Cb 1.24 -0.13 -0.16 0.00 0.14 0.00 0.00 62.40 63.49 1xmn h SER 153 CO 0.63 1.43 -0.76 0.68 -1.14 0.00 0.00 176.83 177.66 1xmn s VAL 154 N -2.43 2.77 0.18 2.27 -7.23 -1.26 0.99 120.40 115.69 1xmn s VAL 154 Ca -0.16 -1.92 -0.33 0.00 -1.81 0.00 0.00 61.98 57.76 1xmn s VAL 154 Cb 0.02 -2.37 -0.15 0.00 0.56 0.00 0.00 36.38 34.43 1xmn s VAL 154 CO 0.80 -0.16 1.24 -0.11 -0.31 0.00 0.00 175.10 176.56 1xmn n LEU 155 N -0.00 1.91 -4.85 1.32 7.94 0.05 -4.81 117.00 118.56 1xmn n LEU 155 Ca -0.11 1.14 -0.29 0.00 -1.11 0.00 0.00 56.01 55.64 1xmn n LEU 155 Cb 0.56 -1.26 -0.05 0.00 0.53 0.00 0.00 43.42 43.20 1xmn n LEU 155 CO 0.33 -1.08 -0.20 -1.10 -1.11 0.00 0.00 177.39 174.23 1xmn s GLN 156 N -0.29 3.14 0.01 1.96 -1.52 -0.87 -0.45 119.66 121.65 1xmn s GLN 156 Ca 0.73 -0.62 0.01 0.00 -1.95 0.00 0.00 55.36 53.52 1xmn s GLN 156 Cb -0.81 -2.85 -0.01 0.00 -0.22 0.00 0.00 33.01 29.12 1xmn s GLN 156 CO 0.51 0.56 -0.03 0.08 -0.25 0.00 0.00 175.29 176.16 1xmn s VAL 157 N -1.53 0.22 -0.16 1.09 1.01 0.25 -2.02 120.40 119.26 1xmn s VAL 157 Ca 0.32 -0.53 -0.14 0.00 0.00 0.00 0.00 61.98 61.62 1xmn s VAL 157 Cb -0.12 -0.27 0.04 0.00 0.00 0.00 0.00 36.38 36.04 1xmn s VAL 157 CO 0.25 -0.21 0.43 0.54 0.00 0.00 0.00 175.10 176.11 1xmn s VAL 158 N -0.74 -0.00 -0.18 2.92 0.11 -0.65 -1.17 120.40 120.68 1xmn s VAL 158 Ca -0.07 0.01 -0.09 0.00 -2.93 0.00 0.00 61.98 58.91 1xmn s VAL 158 Cb -0.05 -0.60 -0.05 0.00 -1.53 0.00 0.00 36.38 34.15 1xmn s VAL 158 CO -0.00 0.00 0.10 0.20 -3.33 0.00 0.00 175.10 172.07 1xmn s ASN 159 N 0.31 6.00 0.01 3.54 0.01 -1.26 -0.68 114.94 122.87 1xmn s ASN 159 Ca -0.01 0.20 0.00 0.00 -0.71 0.00 0.00 52.86 52.35 1xmn s ASN 159 Cb -0.03 -2.03 -0.01 0.00 0.41 0.00 0.00 41.25 39.60 1xmn s ASN 159 CO -0.00 0.21 -0.02 -0.76 -1.51 0.00 0.00 177.10 175.02 1xmn s LEU 160 N 0.17 2.06 0.26 0.60 1.43 0.06 -4.93 118.68 118.33 1xmn s LEU 160 Ca 0.07 -0.14 -0.23 0.00 -1.03 0.00 0.00 54.13 52.81 1xmn s LEU 160 Cb -0.12 -0.04 -0.09 0.00 0.03 0.00 0.00 46.19 45.97 1xmn s LEU 160 CO -0.01 -0.05 0.83 -2.16 0.23 0.00 0.00 176.35 175.19 1xmn s PRO 161 N -0.37 4.43 0.37 1.29 0.04 -1.26 -0.20 135.00 139.30 1xmn s PRO 161 Ca -0.03 1.10 -0.27 0.00 0.04 0.00 0.00 61.00 61.84 1xmn s PRO 161 Cb -0.03 -2.87 -0.09 0.00 0.04 0.00 0.00 34.50 31.55 1xmn s PRO 161 CO -0.00 0.36 1.20 0.42 0.04 0.00 0.00 177.00 179.02 1xmn s ILE 162 N -1.54 3.05 0.02 0.56 1.01 0.40 -0.81 121.20 123.90 1xmn s ILE 162 Ca 0.46 0.95 0.04 0.00 0.00 0.00 0.00 60.65 62.10 1xmn s ILE 162 Cb -0.18 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 1xmn s ILE 162 CO 0.23 0.15 -0.06 -0.69 0.00 0.00 0.00 174.94 174.56 1xmn s VAL 163 N -1.30 3.68 0.31 2.92 1.01 -0.57 -0.76 120.40 125.68 1xmn s VAL 163 Ca 0.53 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 61.38 1xmn s VAL 163 Cb -0.34 -2.63 -0.13 0.00 0.00 0.00 0.00 36.38 33.28 1xmn s VAL 163 CO 0.43 0.33 1.20 -0.62 0.00 0.00 0.00 175.10 176.44 1xmn n GLU 164 N 1.34 1.82 -0.32 2.72 4.71 -1.26 -4.62 120.64 125.03 1xmn n GLU 164 Ca -0.15 0.64 0.03 0.00 -0.01 0.00 0.00 57.16 57.67 1xmn n GLU 164 Cb 0.52 -2.16 0.17 0.00 -1.01 0.00 0.00 31.44 28.97 1xmn n GLU 164 CO 0.00 0.00 0.00 -0.09 0.09 0.00 0.00 177.13 177.13 1xmn h ARG 165 N 2.57 0.92 -0.84 3.49 2.43 -1.98 -1.08 114.38 119.90 1xmn h ARG 165 Ca -0.44 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 58.70 1xmn h ARG 165 Cb 1.30 -0.21 -0.05 0.00 -0.42 0.00 0.00 29.97 30.60 1xmn h ARG 165 CO 0.64 0.61 0.55 -1.35 -1.51 0.00 0.00 179.97 178.91 1xmn h PRO 166 N 0.95 1.05 -0.24 0.20 0.11 -1.99 0.13 132.00 132.20 1xmn h PRO 166 Ca 0.41 -0.06 -0.18 0.00 0.11 0.00 0.00 66.00 66.28 1xmn h PRO 166 Cb 0.27 -0.24 -0.00 0.00 0.11 0.00 0.00 31.00 31.15 1xmn h PRO 166 CO -0.21 0.69 -0.55 0.28 -0.21 0.00 0.00 178.00 178.00 1xmn h VAL 167 N 1.08 1.29 -0.24 3.15 2.07 -1.70 -1.49 116.25 120.41 1xmn h VAL 167 Ca 0.32 -1.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.06 1xmn h VAL 167 Cb -0.04 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1xmn h VAL 167 CO -0.08 0.56 0.11 0.00 0.02 0.00 0.00 177.57 178.18 1xmn h LYS 169 N 0.26 -0.08 0.00 0.00 3.64 -0.69 -2.70 116.57 117.00 1xmn h LYS 169 Ca 0.08 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 1xmn h LYS 169 Cb 0.14 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1xmn h LYS 169 CO -0.01 -0.05 0.00 -0.25 -2.27 0.00 0.00 179.45 176.87 1xmn n ASP 170 N -5.15 0.00 -0.05 4.20 10.43 -0.57 -3.13 116.55 122.29 1xmn n ASP 170 Ca -0.07 0.24 0.13 0.00 2.57 0.00 0.00 54.79 57.66 1xmn n ASP 170 Cb 0.08 -0.38 0.41 0.00 1.84 0.00 0.00 41.12 43.07 1xmn n ASP 170 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 1xmn n SER 171 N -1.38 0.44 -3.80 -2.24 3.41 -0.90 -4.92 113.62 104.23 1xmn n SER 171 Ca 0.07 -0.21 -0.11 0.00 -0.26 0.00 0.00 58.87 58.36 1xmn n SER 171 Cb 0.17 0.01 -0.08 0.00 -0.26 0.00 0.00 64.21 64.05 1xmn n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1xmn s THR 172 N -2.85 0.10 -0.77 6.66 -1.32 -1.18 -4.83 115.64 111.44 1xmn s THR 172 Ca 0.16 -0.82 0.25 0.00 -1.21 0.00 0.00 61.69 60.07 1xmn s THR 172 Cb 0.18 -0.97 0.09 0.00 -1.51 0.00 0.00 72.50 70.29 1xmn s THR 172 CO 0.60 -0.45 1.46 0.54 -2.21 0.00 0.00 174.62 174.56 1xmn n ARG 173 N 0.54 0.19 -2.34 7.08 1.74 -1.26 -4.86 116.66 117.75 1xmn n ARG 173 Ca -0.18 0.07 -0.40 0.00 -0.77 0.00 0.00 57.85 56.57 1xmn n ARG 173 Cb 0.60 -1.64 -0.03 0.00 -1.02 0.00 0.00 32.46 30.36 1xmn n ARG 173 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1xmn s ILE 174 N -3.10 3.21 -0.35 0.55 1.01 -1.26 -4.95 121.20 116.31 1xmn s ILE 174 Ca 0.09 1.19 -0.29 0.00 0.00 0.00 0.00 60.65 61.64 1xmn s ILE 174 Cb 0.15 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.87 1xmn s ILE 174 CO 0.68 0.26 1.45 -0.60 0.00 0.00 0.00 174.94 176.73 1xmn s ARG 175 N -1.67 3.66 0.48 2.79 3.52 -1.26 -5.00 118.95 121.47 1xmn s ARG 175 Ca 0.47 1.16 -0.03 0.00 -0.13 0.00 0.00 55.73 57.20 1xmn s ARG 175 Cb -0.34 -4.01 -0.02 0.00 -1.56 0.00 0.00 34.95 29.02 1xmn s ARG 175 CO 0.44 -1.45 0.76 0.96 -0.81 0.00 0.00 175.30 175.20 1xmn s ILE 176 N 5.28 4.43 0.31 4.11 -4.36 -1.26 -4.81 121.20 124.90 1xmn s ILE 176 Ca 0.63 -0.09 0.03 0.00 -0.26 0.00 0.00 60.65 60.96 1xmn s ILE 176 Cb -0.17 -3.68 -0.04 0.00 1.25 0.00 0.00 42.46 39.82 1xmn s ILE 176 CO 0.30 -0.61 0.14 0.42 0.24 0.00 0.00 174.94 175.43 1xmn s THR 177 N -2.71 0.47 -0.89 8.37 -4.23 -1.26 -5.02 115.64 110.37 1xmn s THR 177 Ca 0.48 -2.00 0.17 0.00 -1.18 0.00 0.00 61.69 59.16 1xmn s THR 177 Cb -0.10 -2.54 0.15 0.00 1.34 0.00 0.00 72.50 71.35 1xmn s THR 177 CO 0.42 0.00 1.54 0.47 -0.54 0.00 0.00 174.62 176.51 1xmn n ASP 178 N -0.87 0.15 -0.34 3.99 9.92 -1.26 -2.43 116.55 125.71 1xmn n ASP 178 Ca -0.00 0.54 0.04 0.00 -0.53 0.00 0.00 54.79 54.83 1xmn n ASP 178 Cb 0.65 -0.57 0.11 0.00 -0.64 0.00 0.00 41.12 40.68 1xmn n ASP 178 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1xmn n ASN 179 N -1.66 0.99 -4.01 -2.24 3.02 -1.26 -4.83 115.26 105.26 1xmn n ASN 179 Ca 0.03 -1.96 -0.08 0.00 -0.03 0.00 0.00 54.58 52.54 1xmn n ASN 179 Cb 0.19 -0.12 -0.09 0.00 -0.61 0.00 0.00 39.78 39.16 1xmn n ASN 179 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xmn s MET 180 N -1.76 0.84 0.09 3.52 0.23 -1.02 -0.44 119.30 120.75 1xmn s MET 180 Ca 0.14 -1.18 -0.09 0.00 -1.03 0.00 0.00 55.69 53.53 1xmn s MET 180 Cb 0.07 0.28 0.00 0.00 -1.53 0.00 0.00 34.83 33.66 1xmn s MET 180 CO 0.10 -0.24 0.20 -0.59 -2.03 0.00 0.00 175.02 172.46 1xmn s PHE 181 N -3.94 0.12 0.27 3.16 -0.12 -0.24 -4.80 117.98 112.43 1xmn s PHE 181 Ca 0.12 -0.53 0.11 0.00 -0.05 0.00 0.00 56.93 56.58 1xmn s PHE 181 Cb 0.06 -0.03 -0.05 0.00 -0.63 0.00 0.00 43.02 42.37 1xmn s PHE 181 CO -0.06 -0.55 -0.19 0.00 -0.05 0.00 0.00 175.22 174.37 1xmn s ALA 183 N -2.55 -0.87 0.00 0.00 0.00 -0.63 -1.52 121.76 116.20 1xmn s ALA 183 Ca 0.29 0.26 0.00 0.00 0.00 0.00 0.00 51.96 52.51 1xmn s ALA 183 Cb -0.05 0.23 0.00 0.00 0.00 0.00 0.00 23.12 23.31 1xmn s ALA 183 CO 0.14 -0.37 0.00 0.41 0.00 0.00 0.00 175.76 175.93 1xmn n GLY 184 N 0.79 2.90 3.81 0.00 0.00 0.01 -2.31 105.19 110.41 1xmn n GLY 184 Ca -0.20 -1.47 -0.37 0.00 0.00 0.00 0.00 46.02 43.99 1xmn n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xmn s TYR 184 N -2.00 3.70 0.56 1.61 2.02 -1.26 -4.49 117.35 117.48 1xmn s TYR 184 Ca 0.00 1.35 -0.15 0.00 -0.37 0.00 0.00 57.07 57.90 1xmn s TYR 184 Cb 0.00 -2.58 -0.06 0.00 -0.40 0.00 0.00 41.96 38.92 1xmn s TYR 184 CO 0.00 0.41 1.01 0.15 -1.57 0.00 0.00 175.55 175.55 1xmn s LYS 185 N -1.75 3.71 0.27 -0.62 1.02 -1.26 -4.81 119.74 116.29 1xmn s LYS 185 Ca 0.39 0.96 -0.03 0.00 0.02 0.00 0.00 55.97 57.31 1xmn s LYS 185 Cb -0.18 -2.10 0.56 0.00 -0.52 0.00 0.00 37.83 35.60 1xmn s LYS 185 CO 0.21 -0.48 1.62 -1.35 -0.92 0.00 0.00 175.35 174.44 1xmn h PRO 186 N 0.49 0.10 0.00 -1.68 0.11 -1.96 -1.39 132.00 127.68 1xmn h PRO 186 Ca -0.46 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 65.60 1xmn h PRO 186 Cb 1.19 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 1xmn h PRO 186 CO 0.61 0.07 -0.23 0.38 -0.21 0.00 0.00 178.00 178.62 1xmn h ASP 186 N 0.10 0.00 0.28 -2.05 3.04 -1.97 -3.21 116.42 112.61 1xmn h ASP 186 Ca 0.48 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.27 1xmn h ASP 186 Cb 0.91 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.20 1xmn h ASP 186 CO -0.73 0.23 0.00 -0.33 -2.04 0.00 0.00 179.24 176.37 1xmn h GLU 186 N 0.00 0.00 0.00 4.15 5.08 -1.62 -3.46 114.58 118.73 1xmn h GLU 186 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1xmn h GLU 186 Cb 0.78 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.03 1xmn h GLU 186 CO 0.03 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.45 1xmn n GLY 186 N -0.80 1.70 3.73 -3.84 0.00 -1.22 -4.97 105.19 99.80 1xmn n GLY 186 Ca -0.01 -0.11 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 1xmn n GLY 186 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xmn s LYS 186 N 0.00 2.34 0.36 1.61 1.02 -1.26 -5.05 119.74 118.77 1xmn s LYS 186 Ca 0.00 1.69 0.02 0.00 0.02 0.00 0.00 55.97 57.70 1xmn s LYS 186 Cb 0.00 -1.87 -0.01 0.00 -0.52 0.00 0.00 37.83 35.44 1xmn s LYS 186 CO 0.00 -1.66 0.07 0.54 -0.92 0.00 0.00 175.35 173.38 1xmn n ARG 187 N -2.55 0.79 0.00 1.68 1.74 -1.26 -4.67 116.66 112.38 1xmn n ARG 187 Ca 0.13 -2.87 0.00 0.00 -0.77 0.00 0.00 57.85 54.34 1xmn n ARG 187 Cb 0.50 1.25 0.00 0.00 -1.02 0.00 0.00 32.46 33.19 1xmn n ARG 187 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xmn n GLY 188 N -0.08 4.48 3.61 -0.13 0.00 -1.26 -4.91 105.19 106.90 1xmn n GLY 188 Ca -0.09 -1.27 -0.00 0.00 0.00 0.00 0.00 46.02 44.66 1xmn n GLY 188 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xmn s ASP 189 N 0.00 -0.06 0.71 1.61 2.15 -1.07 -4.60 116.67 115.40 1xmn s ASP 189 Ca 0.00 -0.06 -0.04 0.00 0.43 0.00 0.00 52.55 52.89 1xmn s ASP 189 Cb 0.00 0.11 0.10 0.00 -0.30 0.00 0.00 42.92 42.83 1xmn s ASP 189 CO 0.00 -0.20 0.99 0.00 -0.17 0.00 0.00 175.17 175.79 1xmn s ALA 190 N -2.31 3.43 0.34 3.66 0.00 -1.26 -0.59 121.76 125.04 1xmn s ALA 190 Ca 0.13 -1.37 -0.06 0.00 0.00 0.00 0.00 51.96 50.66 1xmn s ALA 190 Cb 0.03 -2.27 0.01 0.00 0.00 0.00 0.00 23.12 20.89 1xmn s ALA 190 CO -0.04 -1.38 0.53 0.00 0.00 0.00 0.00 175.76 174.87 1xmn n GLU 192 N -0.54 1.74 0.00 0.00 4.71 -1.26 -1.14 120.64 124.15 1xmn n GLU 192 Ca -0.01 0.61 0.00 0.00 -0.01 0.00 0.00 57.16 57.75 1xmn n GLU 192 Cb 0.61 -2.15 0.00 0.00 -1.01 0.00 0.00 31.44 28.89 1xmn n GLU 192 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1xmn n GLY 193 N 1.55 3.32 0.12 0.62 0.00 -1.26 -1.45 105.19 108.08 1xmn n GLY 193 Ca 0.10 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.24 1xmn n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1xmn h ASP 194 N 0.01 0.00 -2.78 1.61 3.32 -1.46 -3.35 116.42 113.78 1xmn h ASP 194 Ca 0.00 -0.07 -0.59 0.00 0.02 0.00 0.00 57.03 56.39 1xmn h ASP 194 Cb 0.00 0.00 0.14 0.00 0.22 0.00 0.00 39.33 39.69 1xmn h ASP 194 CO 0.00 0.03 -0.12 -1.20 -1.72 0.00 0.00 179.24 176.23 1xmn n SER 195 N -2.46 0.13 0.00 6.45 7.64 -1.26 -1.65 113.62 122.46 1xmn n SER 195 Ca 0.04 0.94 0.00 0.00 1.01 0.00 0.00 58.87 60.86 1xmn n SER 195 Cb 0.47 -1.24 0.00 0.00 -1.01 0.00 0.00 64.21 62.44 1xmn n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xmn n GLY 196 N 1.50 3.17 3.77 0.23 0.00 -0.22 0.12 105.19 113.75 1xmn n GLY 196 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 1xmn n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xmn s GLY 197 N -1.90 1.99 0.32 -0.02 0.00 -0.66 -2.83 107.32 104.22 1xmn s GLY 197 Ca 0.00 0.46 -0.10 0.00 0.00 0.00 0.00 44.72 45.09 1xmn s GLY 197 CO 0.00 0.82 0.66 2.56 0.00 0.00 0.00 173.10 177.14 1xmn s PRO 198 N -4.37 3.79 -0.32 2.90 0.04 -1.26 -0.73 135.00 135.04 1xmn s PRO 198 Ca 0.65 0.34 -0.03 0.00 0.04 0.00 0.00 61.00 62.00 1xmn s PRO 198 Cb -0.20 -2.52 0.05 0.00 0.04 0.00 0.00 34.50 31.88 1xmn s PRO 198 CO 0.47 0.14 0.04 0.12 0.04 0.00 0.00 177.00 177.81 1xmn s PHE 199 N -2.11 3.28 0.21 0.56 2.19 -0.38 -3.57 117.98 118.16 1xmn s PHE 199 Ca 0.49 -1.79 0.09 0.00 0.33 0.00 0.00 56.93 56.06 1xmn s PHE 199 Cb -0.11 -2.23 -0.04 0.00 -1.31 0.00 0.00 43.02 39.33 1xmn s PHE 199 CO 0.26 -0.79 -0.07 0.14 1.83 0.00 0.00 175.22 176.59 1xmn s VAL 200 N 1.29 3.24 0.01 3.12 -7.23 -0.05 -0.92 120.40 119.86 1xmn s VAL 200 Ca -0.03 -1.78 0.01 0.00 -1.81 0.00 0.00 61.98 58.36 1xmn s VAL 200 Cb -0.20 -2.65 -0.01 0.00 0.56 0.00 0.00 36.38 34.08 1xmn s VAL 200 CO -0.00 -0.21 -0.03 -0.04 -0.31 0.00 0.00 175.10 174.51 1xmn s MET 201 N -3.14 0.22 -0.30 4.82 -1.94 -0.09 -0.02 119.30 118.86 1xmn s MET 201 Ca 0.27 -0.27 -0.12 0.00 -1.71 0.00 0.00 55.69 53.86 1xmn s MET 201 Cb -0.08 -0.09 -0.04 0.00 2.01 0.00 0.00 34.83 36.63 1xmn s MET 201 CO 0.17 0.02 0.25 0.21 -0.01 0.00 0.00 175.02 175.65 1xmn s LYS 202 N -0.55 3.84 0.00 2.03 2.20 -1.26 -0.50 119.74 125.50 1xmn s LYS 202 Ca -0.04 -0.33 -0.30 0.00 -0.36 0.00 0.00 55.97 54.94 1xmn s LYS 202 Cb -0.04 -3.70 -0.07 0.00 -1.51 0.00 0.00 37.83 32.51 1xmn s LYS 202 CO -0.00 -0.28 1.63 0.45 -0.36 0.00 0.00 175.35 176.78 1xmn s SER 203 N 1.73 6.66 0.00 1.43 0.15 -0.25 -4.86 113.70 118.56 1xmn s SER 203 Ca 0.09 2.32 0.17 0.00 0.70 0.00 0.00 55.95 59.23 1xmn s SER 203 Cb -0.16 -2.55 0.99 0.00 -1.71 0.00 0.00 66.02 62.59 1xmn s SER 203 CO 0.11 -0.89 1.57 -0.81 1.20 0.00 0.00 173.24 174.43 1xmn n PRO 204 N 6.34 0.91 -0.12 5.44 -0.04 -1.26 -1.32 135.00 144.95 1xmn n PRO 204 Ca 0.16 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.44 1xmn n PRO 204 Cb 0.42 -1.29 -0.12 0.00 -0.04 0.00 0.00 33.50 32.47 1xmn n PRO 204 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1xmn n PHE 204 N -0.79 0.11 -0.72 0.54 3.72 -1.26 -4.71 117.46 114.35 1xmn n PHE 204 Ca 0.12 0.02 0.01 0.00 -0.05 0.00 0.00 57.45 57.56 1xmn n PHE 204 Cb 0.06 -1.01 0.01 0.00 -0.94 0.00 0.00 39.48 37.59 1xmn n PHE 204 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1xmn n ASN 204 N -3.26 0.97 -0.54 4.37 2.04 -1.22 -5.02 115.26 112.60 1xmn n ASN 204 Ca -0.44 -1.66 -0.07 0.00 -0.44 0.00 0.00 54.58 51.97 1xmn n ASN 204 Cb 1.00 -0.06 -0.03 0.00 -2.53 0.00 0.00 39.78 38.17 1xmn n ASN 204 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 1xmn n ASN 205 N -0.32 -5.50 -4.93 0.53 5.15 -0.44 -4.99 115.26 104.77 1xmn n ASN 205 Ca 0.01 0.17 -0.27 0.00 -0.60 0.00 0.00 54.58 53.90 1xmn n ASN 205 Cb 0.44 -3.62 -0.03 0.00 -0.53 0.00 0.00 39.78 36.04 1xmn n ASN 205 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 1xmn s ARG 206 N -2.45 3.48 -0.07 1.20 0.52 -1.26 -4.82 118.95 115.56 1xmn s ARG 206 Ca 0.00 -0.45 -0.16 0.00 -0.52 0.00 0.00 55.73 54.60 1xmn s ARG 206 Cb 0.00 -2.90 -0.05 0.00 0.52 0.00 0.00 34.95 32.52 1xmn s ARG 206 CO 0.00 0.46 0.42 -1.58 0.02 0.00 0.00 175.30 174.62 1xmn s TRP 207 N -1.80 3.61 -0.06 -0.53 0.52 -1.26 -1.09 118.94 118.32 1xmn s TRP 207 Ca 0.37 0.90 0.05 0.00 0.02 0.00 0.00 56.10 57.44 1xmn s TRP 207 Cb -0.11 -2.41 -0.01 0.00 -1.15 0.00 0.00 33.47 29.79 1xmn s TRP 207 CO 0.29 0.39 -0.22 0.71 0.02 0.00 0.00 176.95 178.14 1xmn s TYR 208 N -0.18 2.19 -0.53 -1.98 2.02 0.34 -2.27 117.35 116.95 1xmn s TYR 208 Ca 0.24 -0.70 -0.24 0.00 -0.37 0.00 0.00 57.07 56.01 1xmn s TYR 208 Cb -0.16 -1.46 0.04 0.00 -0.40 0.00 0.00 41.96 39.99 1xmn s TYR 208 CO 0.11 -0.24 0.89 -1.14 -1.57 0.00 0.00 175.55 173.60 1xmn s GLN 209 N 0.01 3.33 0.08 -0.62 0.74 -0.05 -0.91 119.66 122.24 1xmn s GLN 209 Ca -0.07 -0.30 0.18 0.00 0.05 0.00 0.00 55.36 55.23 1xmn s GLN 209 Cb -0.14 -4.04 -0.12 0.00 1.10 0.00 0.00 33.01 29.81 1xmn s GLN 209 CO 0.04 -1.40 0.83 -1.33 -0.55 0.00 0.00 175.29 172.88 1xmn n MET 210 N 7.22 0.62 -4.14 1.67 2.81 -0.10 -4.27 117.12 120.93 1xmn n MET 210 Ca 0.01 0.18 -0.12 0.00 -1.81 0.00 0.00 57.70 55.95 1xmn n MET 210 Cb 0.47 -1.79 -0.08 0.00 -0.71 0.00 0.00 33.22 31.11 1xmn n MET 210 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1xmn s GLY 211 N -4.71 1.28 -0.08 3.03 0.00 -0.79 -2.17 107.32 103.88 1xmn s GLY 211 Ca -0.03 -1.49 0.01 0.00 0.00 0.00 0.00 44.72 43.21 1xmn s GLY 211 CO 0.81 -1.16 -0.11 -0.42 0.00 0.00 0.00 173.10 172.23 1xmn s ILE 212 N -3.94 1.07 -0.01 0.90 1.01 -1.00 -1.25 121.20 117.97 1xmn s ILE 212 Ca 0.34 -0.41 -0.34 0.00 0.00 0.00 0.00 60.65 60.24 1xmn s ILE 212 Cb 0.04 -1.01 -0.12 0.00 0.01 0.00 0.00 42.46 41.37 1xmn s ILE 212 CO 0.14 0.35 1.79 0.52 0.00 0.00 0.00 174.94 177.73 1xmn n VAL 213 N 4.13 0.40 0.02 2.92 0.31 0.09 -0.84 118.33 125.37 1xmn n VAL 213 Ca -0.20 -0.07 -0.01 0.00 -0.01 0.00 0.00 64.34 64.04 1xmn n VAL 213 Cb 0.51 -1.76 -0.00 0.00 -0.91 0.00 0.00 33.84 31.68 1xmn n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1xmn n SER 214 N 5.65 0.81 -3.06 4.52 2.88 -0.82 -1.05 113.62 122.55 1xmn n SER 214 Ca 0.21 0.11 -0.07 0.00 -1.33 0.00 0.00 58.87 57.78 1xmn n SER 214 Cb 0.29 -0.26 0.02 0.00 -0.75 0.00 0.00 64.21 63.52 1xmn n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1xmn s TRP 215 N -2.05 0.10 0.01 0.66 1.48 -1.05 -4.93 118.94 113.16 1xmn s TRP 215 Ca -0.02 -0.70 -0.10 0.00 -1.06 0.00 0.00 56.10 54.22 1xmn s TRP 215 Cb 0.01 0.80 0.03 0.00 -1.16 0.00 0.00 33.47 33.15 1xmn s TRP 215 CO 0.03 -1.39 0.47 0.41 -4.06 0.00 0.00 176.95 172.42 1xmn n GLY 216 N -0.58 0.58 2.76 3.67 0.00 -1.26 -0.60 105.19 109.77 1xmn n GLY 216 Ca -0.07 -0.93 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 1xmn n GLY 216 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xmn s GLU 217 N -2.01 0.81 1.79 1.61 2.02 -1.26 -5.03 118.70 116.63 1xmn s GLU 217 Ca 0.11 -0.90 0.00 0.00 0.02 0.00 0.00 54.97 54.20 1xmn s GLU 217 Cb -0.00 -2.11 0.00 0.00 0.10 0.00 0.00 34.13 32.12 1xmn s GLU 217 CO 0.00 -0.85 0.00 0.41 0.02 0.00 0.00 175.26 174.84 1xmn n GLY 219 N 4.87 -1.36 2.94 -1.39 0.00 -1.26 -4.79 105.19 104.20 1xmn n GLY 219 Ca -0.05 -1.27 -0.14 0.00 0.00 0.00 0.00 46.02 44.56 1xmn n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xmn n ASP 221 N 4.70 -6.10 -4.75 0.00 2.03 -1.26 -4.39 116.55 106.77 1xmn n ASP 221 Ca -0.17 -0.36 -0.39 0.00 0.52 0.00 0.00 54.79 54.39 1xmn n ASP 221 Cb 0.51 -4.85 -0.06 0.00 -0.72 0.00 0.00 41.12 36.01 1xmn n ASP 221 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1xmn s ARG 221 N -5.88 4.34 0.27 -0.67 0.52 -1.26 -4.93 118.95 111.34 1xmn s ARG 221 Ca 0.39 0.73 -0.30 0.00 -0.52 0.00 0.00 55.73 56.03 1xmn s ARG 221 Cb -0.17 -3.36 -0.13 0.00 0.52 0.00 0.00 34.95 31.81 1xmn s ARG 221 CO 0.48 0.31 1.48 -0.25 0.02 0.00 0.00 175.30 177.35 1xmn n ASP 222 N 2.94 3.25 0.00 0.23 8.00 -1.26 -1.09 116.55 128.62 1xmn n ASP 222 Ca -0.06 1.15 0.00 0.00 0.71 0.00 0.00 54.79 56.59 1xmn n ASP 222 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 41.12 40.11 1xmn n ASP 222 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xmn n GLY 223 N 2.07 3.24 3.88 0.44 0.00 -1.26 -5.03 105.19 108.53 1xmn n GLY 223 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 1xmn n GLY 223 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xmn s LYS 224 N -0.67 3.10 0.01 1.61 -0.14 -0.25 -4.82 119.74 118.57 1xmn s LYS 224 Ca 0.00 -0.96 -0.01 0.00 -1.36 0.00 0.00 55.97 53.64 1xmn s LYS 224 Cb 0.00 -2.67 -0.01 0.00 -1.68 0.00 0.00 37.83 33.47 1xmn s LYS 224 CO 0.00 0.40 0.01 0.71 -0.76 0.00 0.00 175.35 175.71 1xmn s TYR 225 N -2.09 0.12 0.37 3.18 1.51 -1.26 -4.73 117.35 114.45 1xmn s TYR 225 Ca 0.33 -0.23 -0.26 0.00 -1.01 0.00 0.00 57.07 55.90 1xmn s TYR 225 Cb -0.08 -0.09 -0.09 0.00 -0.11 0.00 0.00 41.96 41.59 1xmn s TYR 225 CO 0.26 -0.13 1.11 0.20 -1.11 0.00 0.00 175.55 175.88 1xmn s GLY 226 N -0.84 2.86 -0.03 0.71 0.00 -0.98 -4.75 107.32 104.29 1xmn s GLY 226 Ca -0.09 0.85 0.00 0.00 0.00 0.00 0.00 44.72 45.48 1xmn s GLY 226 CO -0.00 1.35 0.01 -1.36 0.00 0.00 0.00 173.10 173.10 1xmn s PHE 227 N -1.45 3.12 0.03 1.90 0.40 0.23 -1.61 117.98 120.60 1xmn s PHE 227 Ca 0.55 0.12 0.05 0.00 -0.60 0.00 0.00 56.93 57.05 1xmn s PHE 227 Cb -0.28 -1.71 -0.02 0.00 0.51 0.00 0.00 43.02 41.52 1xmn s PHE 227 CO 0.35 0.47 -0.14 0.71 0.70 0.00 0.00 175.22 177.31 1xmn s TYR 228 N -1.03 1.22 0.19 0.36 1.51 0.11 -1.94 117.35 117.77 1xmn s TYR 228 Ca 0.18 -0.34 -0.30 0.00 -1.01 0.00 0.00 57.07 55.60 1xmn s TYR 228 Cb -0.11 -0.73 -0.09 0.00 -0.11 0.00 0.00 41.96 40.92 1xmn s TYR 228 CO 0.08 0.03 1.37 0.99 -1.11 0.00 0.00 175.55 176.91 1xmn s THR 229 N -0.79 3.09 -0.82 -0.71 2.01 -0.02 -1.08 115.64 117.32 1xmn s THR 229 Ca 0.02 0.86 -0.25 0.00 0.31 0.00 0.00 61.69 62.63 1xmn s THR 229 Cb -0.08 -3.55 0.04 0.00 0.01 0.00 0.00 72.50 68.92 1xmn s THR 229 CO 0.01 0.11 1.31 -2.28 -0.69 0.00 0.00 174.62 173.08 1xmn s HIS 230 N 0.37 2.39 0.16 4.92 2.46 0.41 -2.38 115.29 123.63 1xmn s HIS 230 Ca 0.60 -0.33 -0.15 0.00 0.47 0.00 0.00 55.06 55.64 1xmn s HIS 230 Cb -0.38 -4.62 0.05 0.00 -0.13 0.00 0.00 32.58 27.50 1xmn s HIS 230 CO 0.37 -2.00 1.81 0.28 -2.47 0.00 0.00 174.74 172.73 1xmn h VAL 231 N 6.24 1.07 -0.90 0.89 2.07 -1.75 -2.91 116.25 120.96 1xmn h VAL 231 Ca -0.14 -0.19 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 1xmn h VAL 231 Cb 1.04 0.47 -0.04 0.00 -1.52 0.00 0.00 31.29 31.24 1xmn h VAL 231 CO 1.31 0.10 0.50 0.15 0.02 0.00 0.00 177.57 179.65 1xmn h PHE 232 N 0.55 1.24 0.00 1.57 3.57 -1.87 -0.73 116.94 121.28 1xmn h PHE 232 Ca 0.17 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 1xmn h PHE 232 Cb -0.02 -0.40 -0.00 0.00 2.79 0.00 0.00 35.95 38.32 1xmn h PHE 232 CO -0.06 0.86 -0.13 0.00 -2.23 0.00 0.00 178.31 176.75 1xmn h ARG 233 N 1.27 0.00 -0.53 1.11 3.08 -1.89 -2.36 114.38 115.05 1xmn h ARG 233 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 1xmn h ARG 233 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.07 1xmn h ARG 233 CO -0.05 0.13 0.00 1.28 -1.07 0.00 0.00 179.97 180.25 1xmn n LEU 234 N -3.67 3.54 -0.07 3.04 4.77 -0.74 -4.57 117.00 119.30 1xmn n LEU 234 Ca -0.02 -2.07 0.00 0.00 -0.03 0.00 0.00 56.01 53.90 1xmn n LEU 234 Cb 0.24 -0.38 0.30 0.00 -2.33 0.00 0.00 43.42 41.25 1xmn n LEU 234 CO 0.30 0.85 1.05 0.50 -1.33 0.00 0.00 177.39 178.77 1xmn h LYS 235 N 3.14 0.68 -0.96 3.23 3.64 -0.60 -2.02 116.57 123.69 1xmn h LYS 235 Ca 0.00 -0.10 0.09 0.00 -1.27 0.00 0.00 60.65 59.38 1xmn h LYS 235 Cb 0.92 -0.12 -0.08 0.00 -0.41 0.00 0.00 32.23 32.54 1xmn h LYS 235 CO 0.02 0.57 0.60 0.87 -2.27 0.00 0.00 179.45 179.24 1xmn h LYS 236 N 0.67 0.98 -0.08 1.90 1.57 -1.80 0.64 116.57 120.46 1xmn h LYS 236 Ca 0.16 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.86 1xmn h LYS 236 Cb 0.15 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 1xmn h LYS 236 CO -0.02 0.65 -0.06 2.35 -0.57 0.00 0.00 179.45 181.81 1xmn h TRP 237 N 1.01 0.22 -0.39 -1.35 7.01 -1.72 -1.90 115.95 118.83 1xmn h TRP 237 Ca 0.45 -0.06 0.07 0.00 2.11 0.00 0.00 58.89 61.46 1xmn h TRP 237 Cb 0.34 -0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 27.29 1xmn h TRP 237 CO -0.02 0.59 0.01 0.82 -2.79 0.00 0.00 178.44 177.06 1xmn h ILE 238 N -0.22 0.72 -0.57 2.65 2.04 -0.81 -1.15 117.51 120.17 1xmn h ILE 238 Ca 0.02 -0.04 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 1xmn h ILE 238 Cb 0.54 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1xmn h ILE 238 CO 0.02 0.02 0.25 -0.61 0.00 0.00 0.00 178.15 177.83 1xmn h GLN 239 N 0.12 0.84 -0.12 2.37 5.75 -0.90 -2.28 115.11 120.88 1xmn h GLN 239 Ca 0.19 -0.14 0.03 0.00 -0.15 0.00 0.00 58.65 58.58 1xmn h GLN 239 Cb 0.26 -0.14 -0.03 0.00 1.07 0.00 0.00 27.48 28.64 1xmn h GLN 239 CO -0.31 0.70 -0.06 -0.22 -2.65 0.00 0.00 178.83 176.30 1xmn h LYS 240 N 0.78 -0.04 -0.18 1.69 3.64 -0.70 -0.39 116.57 121.36 1xmn h LYS 240 Ca 0.19 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.59 1xmn h LYS 240 Cb 0.16 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 1xmn h LYS 240 CO -0.02 -0.03 0.06 0.28 -2.27 0.00 0.00 179.45 177.47 1xmn h VAL 241 N -0.05 0.96 -0.72 2.00 2.07 -1.10 -0.23 116.25 119.19 1xmn h VAL 241 Ca 0.07 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 67.50 1xmn h VAL 241 Cb 0.15 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 1xmn h VAL 241 CO -0.15 0.03 0.29 0.40 0.02 0.00 0.00 177.57 178.16 1xmn h ILE 242 N 0.15 1.24 -0.17 4.57 2.04 -1.21 0.61 117.51 124.74 1xmn h ILE 242 Ca 0.08 -0.76 -0.10 0.00 1.00 0.00 0.00 64.86 65.08 1xmn h ILE 242 Cb 0.05 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 1xmn h ILE 242 CO -0.08 0.31 -0.28 0.44 0.00 0.00 0.00 178.15 178.53 1xmn h ASP 243 N 1.03 0.54 0.09 1.72 3.32 -0.83 0.32 116.42 122.62 1xmn h ASP 243 Ca 0.24 -0.53 -0.14 0.00 0.02 0.00 0.00 57.03 56.61 1xmn h ASP 243 Cb 0.19 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 1xmn h ASP 243 CO -0.02 0.97 -0.50 1.56 -1.72 0.00 0.00 179.24 179.53 1xmn h GLN 244 N 0.13 0.47 -0.01 3.56 4.20 -0.91 -3.32 115.11 119.23 1xmn h GLN 244 Ca 0.01 -0.27 0.00 0.00 0.06 0.00 0.00 58.65 58.45 1xmn h GLN 244 Cb 0.86 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.66 1xmn h GLN 244 CO 0.06 0.86 0.00 1.19 -0.67 0.00 0.00 178.83 180.27 1xmn n PHE 245 N -3.97 0.02 0.00 2.96 3.01 0.19 -5.09 117.46 114.58 1xmn n PHE 245 Ca -0.02 -0.82 0.00 0.00 1.01 0.00 0.00 57.45 57.61 1xmn n PHE 245 Cb 0.57 -0.12 0.00 0.00 -0.01 0.00 0.00 39.48 39.92 1xmn n PHE 245 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18