#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 5.07 -1.47 1.39 1.01 0.67 -4.22 120.40 122.84 1xmn s VAL 17 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.03 1xmn s VAL 17 Cb 0.00 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 33.11 1xmn s VAL 17 CO 0.00 0.49 0.09 -0.62 0.00 0.00 0.00 175.10 175.06 1xmn n GLU 18 N 3.14 -1.88 -0.32 2.72 -0.58 -1.26 -2.41 120.64 120.05 1xmn n GLU 18 Ca -0.17 0.84 0.00 0.00 -0.42 0.00 0.00 57.16 57.41 1xmn n GLU 18 Cb 0.53 -5.33 0.00 0.00 -0.57 0.00 0.00 31.44 26.07 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 -1.08 2.75 3.36 0.62 0.00 -1.26 -4.73 105.19 104.85 1xmn n GLY 19 Ca -0.19 -2.07 -0.12 0.00 0.00 0.00 0.00 46.02 43.65 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 -0.75 0.21 0.26 1.61 1.04 -0.45 -4.90 113.70 110.72 1xmn s SER 20 Ca 0.00 -1.25 -0.30 0.00 0.48 0.00 0.00 55.95 54.87 1xmn s SER 20 Cb 0.00 0.48 -0.11 0.00 0.10 0.00 0.00 66.02 66.50 1xmn s SER 20 CO 0.00 -0.99 1.53 -1.81 0.98 0.00 0.00 173.24 172.95 1xmn s ASP 21 N -3.13 6.50 0.52 7.02 1.11 -1.26 -0.85 116.67 126.58 1xmn s ASP 21 Ca 0.33 2.81 -0.17 0.00 0.18 0.00 0.00 52.55 55.69 1xmn s ASP 21 Cb 0.03 -2.63 -0.07 0.00 1.07 0.00 0.00 42.92 41.33 1xmn s ASP 21 CO 0.12 -0.82 1.00 0.00 1.18 0.00 0.00 175.17 176.65 1xmn s ALA 22 N 0.11 2.96 0.48 5.23 0.00 -0.50 -4.82 121.76 125.23 1xmn s ALA 22 Ca 0.63 0.30 -0.12 0.00 0.00 0.00 0.00 51.96 52.77 1xmn s ALA 22 Cb -0.45 -3.16 -0.06 0.00 0.00 0.00 0.00 23.12 19.44 1xmn s ALA 22 CO 0.44 -0.34 0.88 -1.21 0.00 0.00 0.00 175.76 175.53 1xmn s GLU 23 N -3.88 3.78 0.22 0.00 2.02 -1.26 -4.93 118.70 114.65 1xmn s GLU 23 Ca 0.61 0.63 -0.32 0.00 0.02 0.00 0.00 54.97 55.92 1xmn s GLU 23 Cb -0.12 -2.26 -0.12 0.00 0.10 0.00 0.00 34.13 31.72 1xmn s GLU 23 CO 0.29 -0.21 1.65 -0.89 0.02 0.00 0.00 175.26 176.12 1xmn n ILE 24 N -1.70 0.32 -1.03 -1.63 2.08 -1.26 -1.65 119.36 114.49 1xmn n ILE 24 Ca 0.04 -0.08 -0.01 0.00 0.56 0.00 0.00 62.75 63.26 1xmn n ILE 24 Cb 0.54 -1.87 -0.00 0.00 -0.75 0.00 0.00 39.64 37.56 1xmn n ILE 24 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1xmn n GLY 25 N 3.30 0.29 0.20 7.39 0.00 -1.26 -4.88 105.19 110.24 1xmn n GLY 25 Ca 0.14 -0.03 0.06 0.00 0.00 0.00 0.00 46.02 46.19 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 0.39 0.00 -2.02 1.61 -1.53 -1.69 -3.33 114.93 108.37 1xmn h MET 26 Ca -0.02 0.00 -0.54 0.00 -3.44 0.00 0.00 59.70 55.70 1xmn h MET 26 Cb 0.59 0.00 -0.40 0.00 -0.55 0.00 0.00 31.60 31.25 1xmn h MET 26 CO 0.03 0.33 -1.08 0.45 0.14 0.00 0.00 176.91 176.77 1xmn n SER 27 N -3.73 0.74 0.06 1.39 2.88 -1.26 -4.97 113.62 108.73 1xmn n SER 27 Ca -0.01 -2.86 0.04 0.00 -1.33 0.00 0.00 58.87 54.71 1xmn n SER 27 Cb 0.42 -0.63 0.22 0.00 -0.75 0.00 0.00 64.21 63.47 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 1.01 0.05 -0.03 -1.46 -0.04 -1.25 -1.32 135.00 131.95 1xmn n PRO 28 Ca 0.23 0.53 0.12 0.00 -0.04 0.00 0.00 63.50 64.34 1xmn n PRO 28 Cb 0.55 -1.66 0.24 0.00 -0.04 0.00 0.00 33.50 32.59 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 -1.76 0.08 -2.03 0.54 2.14 -1.03 -1.53 117.44 113.85 1xmn n TRP 29 Ca -0.00 -0.04 -0.41 0.00 2.07 0.00 0.00 57.50 59.11 1xmn n TRP 29 Cb 0.03 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 -1.92 4.28 0.02 -2.67 2.00 -0.43 -0.52 119.66 120.42 1xmn s GLN 30 Ca 0.32 2.27 0.04 0.00 -2.00 0.00 0.00 55.36 55.99 1xmn s GLN 30 Cb 0.20 -3.13 -0.02 0.00 0.80 0.00 0.00 33.01 30.87 1xmn s GLN 30 CO 0.31 -0.42 -0.11 0.08 -0.50 0.00 0.00 175.29 174.64 1xmn s VAL 31 N 0.18 0.85 -0.12 1.34 1.01 -0.49 -4.02 120.40 119.14 1xmn s VAL 31 Ca 0.60 -0.76 -0.03 0.00 0.00 0.00 0.00 61.98 61.79 1xmn s VAL 31 Cb -0.41 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 1xmn s VAL 31 CO 0.41 0.02 -0.01 -0.04 0.00 0.00 0.00 175.10 175.48 1xmn s MET 32 N -0.83 3.37 -0.31 2.72 1.00 -0.12 -1.27 119.30 123.85 1xmn s MET 32 Ca 0.00 -0.45 -0.09 0.00 0.00 0.00 0.00 55.69 55.16 1xmn s MET 32 Cb -0.06 -2.88 0.00 0.00 0.00 0.00 0.00 34.83 31.89 1xmn s MET 32 CO 0.00 0.47 0.13 -1.17 0.00 0.00 0.00 175.02 174.45 1xmn s LEU 33 N -0.24 4.10 0.06 -0.03 0.20 -0.71 -1.11 118.68 120.95 1xmn s LEU 33 Ca 0.05 -0.67 0.04 0.00 0.69 0.00 0.00 54.13 54.24 1xmn s LEU 33 Cb -0.12 -1.96 -0.04 0.00 -0.43 0.00 0.00 46.19 43.64 1xmn s LEU 33 CO 0.02 -0.22 -0.03 -0.36 -0.29 0.00 0.00 176.35 175.47 1xmn s PHE 34 N 1.56 2.95 -0.13 5.38 0.40 0.50 -0.46 117.98 128.17 1xmn s PHE 34 Ca 0.03 -0.03 -0.13 0.00 -0.60 0.00 0.00 56.93 56.20 1xmn s PHE 34 Cb -0.17 -1.56 -0.05 0.00 0.51 0.00 0.00 43.02 41.75 1xmn s PHE 34 CO 0.05 0.45 0.30 0.50 0.70 0.00 0.00 175.22 177.21 1xmn s ARG 35 N -2.01 4.11 0.02 0.44 3.52 0.18 -1.71 118.95 123.51 1xmn s ARG 35 Ca 0.23 0.12 -0.26 0.00 -0.13 0.00 0.00 55.73 55.69 1xmn s ARG 35 Cb -0.11 -3.37 -0.17 0.00 -1.56 0.00 0.00 34.95 29.74 1xmn s ARG 35 CO 0.14 0.37 1.34 0.87 -0.81 0.00 0.00 175.30 177.21 1xmn h LYS 36 N 6.17 -0.39 -2.80 5.12 1.57 -1.38 -2.62 116.57 122.24 1xmn h LYS 36 Ca -0.44 0.03 -0.17 0.00 -1.87 0.00 0.00 60.65 58.19 1xmn h LYS 36 Cb 1.18 0.09 -0.30 0.00 0.08 0.00 0.00 32.23 33.28 1xmn h LYS 36 CO 0.71 -0.10 -0.45 0.45 -0.57 0.00 0.00 179.45 179.49 1xmn s SER 36 N -5.04 -0.06 0.43 0.86 0.15 -1.26 -2.85 113.70 105.93 1xmn s SER 36 Ca -0.15 0.70 -0.23 0.00 0.70 0.00 0.00 55.95 56.97 1xmn s SER 36 Cb 0.03 0.75 -0.08 0.00 -1.71 0.00 0.00 66.02 65.01 1xmn s SER 36 CO 0.57 -0.21 1.11 -2.16 1.20 0.00 0.00 173.24 173.76 1xmn s PRO 37 N 1.98 3.94 -0.26 5.44 0.04 -1.26 -5.06 135.00 139.83 1xmn s PRO 37 Ca -0.04 1.66 -0.40 0.00 0.04 0.00 0.00 61.00 62.26 1xmn s PRO 37 Cb -0.11 -2.46 -0.16 0.00 0.04 0.00 0.00 34.50 31.81 1xmn s PRO 37 CO -0.10 -0.37 1.70 0.94 0.04 0.00 0.00 177.00 179.21 1xmn n GLN 38 N -0.30 1.10 -3.64 4.56 7.27 -1.13 -4.75 117.38 120.48 1xmn n GLN 38 Ca 0.06 0.40 -0.10 0.00 0.07 0.00 0.00 57.00 57.43 1xmn n GLN 38 Cb 0.49 -2.07 -0.07 0.00 2.41 0.00 0.00 30.24 30.99 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 3.26 0.68 -0.52 3.69 2.12 -0.99 -4.97 118.70 121.97 1xmn s GLU 39 Ca 0.98 0.91 -0.26 0.00 0.36 0.00 0.00 54.97 56.95 1xmn s GLU 39 Cb -1.08 0.28 0.03 0.00 0.26 0.00 0.00 34.13 33.62 1xmn s GLU 39 CO 0.65 -0.10 1.03 -1.17 -0.54 0.00 0.00 175.26 175.13 1xmn s LEU 40 N 0.70 3.84 -0.13 2.70 2.96 -1.26 0.50 118.68 127.99 1xmn s LEU 40 Ca -0.02 0.03 -0.18 0.00 -0.22 0.00 0.00 54.13 53.73 1xmn s LEU 40 Cb -0.05 -3.14 -0.16 0.00 0.50 0.00 0.00 46.19 43.34 1xmn s LEU 40 CO -0.07 -1.24 0.47 -0.07 -1.32 0.00 0.00 176.35 174.12 1xmn h LEU 41 N 11.13 0.00 0.00 -0.68 3.38 -1.11 -3.48 115.31 124.54 1xmn h LEU 41 Ca -0.25 -0.62 -0.07 0.00 0.09 0.00 0.00 57.88 57.03 1xmn h LEU 41 Cb 1.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1xmn h LEU 41 CO 1.10 0.84 0.03 0.00 0.09 0.00 0.00 178.44 180.50 1xmn s GLY 43 N -2.01 1.99 0.09 0.00 0.00 0.21 -1.74 107.32 105.85 1xmn s GLY 43 Ca 0.11 -1.81 -0.26 0.00 0.00 0.00 0.00 44.72 42.76 1xmn s GLY 43 CO 0.08 -1.74 1.14 0.00 0.00 0.00 0.00 173.10 172.58 1xmn s ALA 44 N -2.64 -1.96 0.02 3.20 0.00 -0.40 -3.77 121.76 116.21 1xmn s ALA 44 Ca 0.51 0.02 -0.00 0.00 0.00 0.00 0.00 51.96 52.49 1xmn s ALA 44 Cb -0.05 0.70 -0.02 0.00 0.00 0.00 0.00 23.12 23.76 1xmn s ALA 44 CO 0.32 -1.08 -0.02 -1.54 0.00 0.00 0.00 175.76 173.44 1xmn s SER 45 N -3.37 0.19 -0.23 0.00 1.04 0.28 -1.40 113.70 110.20 1xmn s SER 45 Ca 0.21 -0.39 -0.20 0.00 0.48 0.00 0.00 55.95 56.05 1xmn s SER 45 Cb -0.00 0.09 -0.02 0.00 0.10 0.00 0.00 66.02 66.18 1xmn s SER 45 CO 0.02 -0.24 0.63 -0.22 0.98 0.00 0.00 173.24 174.40 1xmn s LEU 46 N -1.17 4.09 0.00 2.42 2.96 0.32 -0.13 118.68 127.18 1xmn s LEU 46 Ca -0.13 0.75 0.08 0.00 -0.22 0.00 0.00 54.13 54.61 1xmn s LEU 46 Cb -0.08 -2.86 0.04 0.00 0.50 0.00 0.00 46.19 43.79 1xmn s LEU 46 CO -0.01 -0.33 0.68 2.30 -1.32 0.00 0.00 176.35 177.67 1xmn n ILE 47 N 5.01 0.00 -3.90 6.68 -5.35 -0.70 -1.59 119.36 119.50 1xmn n ILE 47 Ca -0.01 -0.48 0.01 0.00 -0.27 0.00 0.00 62.75 62.00 1xmn n ILE 47 Cb 0.49 1.14 0.01 0.00 -1.74 0.00 0.00 39.64 39.54 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 -0.79 -0.01 0.02 7.28 1.04 -1.21 -4.77 113.70 115.26 1xmn s SER 48 Ca 0.08 -0.31 0.17 0.00 0.48 0.00 0.00 55.95 56.37 1xmn s SER 48 Cb 0.06 0.24 0.72 0.00 0.10 0.00 0.00 66.02 67.15 1xmn s SER 48 CO 0.12 -0.47 1.54 -0.90 0.98 0.00 0.00 173.24 174.51 1xmn n ASP 49 N -1.00 0.06 0.00 7.02 5.75 -1.26 -3.55 116.55 123.57 1xmn n ASP 49 Ca -0.00 0.51 0.00 0.00 -0.01 0.00 0.00 54.79 55.29 1xmn n ASP 49 Cb 0.60 -0.53 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 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 -1.57 3.42 -5.10 0.11 1.74 -1.26 -0.68 116.66 113.32 1xmn n ARG 50 Ca 0.04 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.80 1xmn n ARG 50 Cb 0.20 -0.59 -0.15 0.00 -1.02 0.00 0.00 32.46 30.90 1xmn n ARG 50 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 1xmn s TRP 51 N -1.03 2.52 -0.05 -1.55 0.52 -1.23 -0.30 118.94 117.81 1xmn s TRP 51 Ca 0.00 -0.33 0.05 0.00 0.02 0.00 0.00 56.10 55.83 1xmn s TRP 51 Cb 0.00 -1.57 -0.00 0.00 -1.15 0.00 0.00 33.47 30.74 1xmn s TRP 51 CO 0.00 0.05 -0.19 0.08 0.02 0.00 0.00 176.95 176.91 1xmn s VAL 52 N -0.62 1.60 -0.06 4.03 1.01 -0.47 -1.73 120.40 124.17 1xmn s VAL 52 Ca 0.09 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.24 1xmn s VAL 52 Cb -0.11 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 1xmn s VAL 52 CO 0.00 0.46 0.09 -0.22 0.00 0.00 0.00 175.10 175.43 1xmn s LEU 53 N 0.06 4.05 0.00 3.92 2.96 0.82 -1.07 118.68 129.42 1xmn s LEU 53 Ca -0.06 0.28 -0.04 0.00 -0.22 0.00 0.00 54.13 54.10 1xmn s LEU 53 Cb -0.13 -2.13 0.01 0.00 0.50 0.00 0.00 46.19 44.44 1xmn s LEU 53 CO 0.03 0.34 0.24 1.07 -1.32 0.00 0.00 176.35 176.71 1xmn n THR 54 N 1.66 0.00 -3.45 3.68 5.66 -0.66 -0.56 114.28 120.61 1xmn n THR 54 Ca -0.17 -0.44 -0.38 0.00 -3.05 0.00 0.00 64.05 60.01 1xmn n THR 54 Cb 0.54 0.36 -0.06 0.00 -1.55 0.00 0.00 70.33 69.62 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 -1.59 3.67 0.31 1.79 0.00 -1.26 -1.72 121.76 122.95 1xmn s ALA 55 Ca 0.07 -0.18 0.01 0.00 0.00 0.00 0.00 51.96 51.86 1xmn s ALA 55 Cb -0.01 -2.43 0.53 0.00 0.00 0.00 0.00 23.12 21.20 1xmn s ALA 55 CO 0.05 0.47 1.93 0.00 0.00 0.00 0.00 175.76 178.21 1xmn h ALA 56 N 4.46 1.51 0.00 0.00 0.00 -1.71 -2.99 119.26 120.54 1xmn h ALA 56 Ca -0.51 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.32 1xmn h ALA 56 Cb 1.21 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1xmn h ALA 56 CO 0.63 0.38 -0.23 1.12 0.00 0.00 0.00 179.25 181.14 1xmn h HIS 57 N 1.02 0.00 -0.30 0.00 2.07 -1.89 0.62 115.15 116.68 1xmn h HIS 57 Ca 0.37 0.00 0.09 0.00 -2.85 0.00 0.00 60.37 57.97 1xmn h HIS 57 Cb 0.14 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.11 1xmn h HIS 57 CO -0.00 0.23 0.27 0.00 -3.07 0.00 0.00 177.93 175.36 1xmn n LEU 59 N -3.99 2.39 -3.74 0.00 4.77 -0.44 -4.91 117.00 111.08 1xmn n LEU 59 Ca 0.04 -0.07 -0.25 0.00 -0.03 0.00 0.00 56.01 55.71 1xmn n LEU 59 Cb 0.43 -0.39 -0.17 0.00 -2.33 0.00 0.00 43.42 40.96 1xmn n LEU 59 CO 0.30 0.68 -0.37 -0.22 -1.33 0.00 0.00 177.39 176.45 1xmn s LEU 60 N -5.74 0.74 0.15 2.23 2.96 0.08 -1.00 118.68 118.09 1xmn s LEU 60 Ca -0.19 -0.36 -0.18 0.00 -0.22 0.00 0.00 54.13 53.18 1xmn s LEU 60 Cb 0.05 -0.46 0.04 0.00 0.50 0.00 0.00 46.19 46.32 1xmn s LEU 60 CO 0.40 -0.25 0.47 -0.47 -1.32 0.00 0.00 176.35 175.19 1xmn s TYR 60 N 1.96 -0.27 0.00 5.38 5.04 0.83 -4.12 117.35 126.17 1xmn s TYR 60 Ca 0.03 -0.02 0.00 0.00 -2.44 0.00 0.00 57.07 54.64 1xmn s TYR 60 Cb -0.14 0.36 0.00 0.00 0.35 0.00 0.00 41.96 42.53 1xmn s TYR 60 CO -0.06 -0.78 0.00 -2.30 -1.34 0.00 0.00 175.55 171.07 1xmn n PRO 60 N -0.28 0.00 -0.33 4.97 -0.02 -1.26 -2.45 135.00 135.63 1xmn n PRO 60 Ca -0.15 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.40 1xmn n PRO 60 Cb 0.64 -0.07 0.22 0.00 -0.02 0.00 0.00 33.50 34.27 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 0.79 -3.44 6.00 8.01 -1.26 -4.97 117.44 122.57 1xmn n TRP 60 Ca 0.00 -0.63 -0.18 0.00 -1.31 0.00 0.00 57.50 55.38 1xmn n TRP 60 Cb 0.00 -0.15 0.07 0.00 -2.01 0.00 0.00 31.31 29.23 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 0.35 -3.18 -4.12 -0.99 -0.08 -1.13 -5.00 116.55 102.39 1xmn n ASP 60 Ca 0.17 -0.69 -0.32 0.00 -1.51 0.00 0.00 54.79 52.44 1xmn n ASP 60 Cb 0.65 -4.91 -0.16 0.00 2.34 0.00 0.00 41.12 39.03 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 -5.24 2.83 -0.45 -0.67 -0.14 -1.02 -5.02 119.74 110.03 1xmn s LYS 60 Ca 0.13 -0.78 0.07 0.00 -1.36 0.00 0.00 55.97 54.04 1xmn s LYS 60 Cb -0.02 -2.38 0.18 0.00 -1.68 0.00 0.00 37.83 33.94 1xmn s LYS 60 CO 0.75 -0.11 0.65 1.21 -0.76 0.00 0.00 175.35 177.10 1xmn s ASN 60 N 1.06 -1.32 0.27 2.83 3.84 -1.23 -0.12 114.94 120.27 1xmn s ASN 60 Ca -0.02 -1.27 -0.16 0.00 0.21 0.00 0.00 52.86 51.62 1xmn s ASN 60 Cb -0.14 1.83 -0.08 0.00 -0.55 0.00 0.00 41.25 42.30 1xmn s ASN 60 CO -0.06 -0.12 0.71 -0.36 -2.79 0.00 0.00 177.10 174.47 1xmn s PHE 60 N 1.38 3.48 0.33 0.43 0.08 -0.17 -5.03 117.98 118.48 1xmn s PHE 60 Ca 0.22 1.24 0.08 0.00 0.12 0.00 0.00 56.93 58.59 1xmn s PHE 60 Cb -0.03 -2.53 -0.04 0.00 -0.57 0.00 0.00 43.02 39.86 1xmn s PHE 60 CO -0.06 0.21 0.20 0.95 -0.10 0.00 0.00 175.22 176.42 1xmn s THR 60 N -1.78 3.32 0.23 0.64 -4.23 -1.26 -4.93 115.64 107.63 1xmn s THR 60 Ca 0.49 -1.56 -0.09 0.00 -1.18 0.00 0.00 61.69 59.35 1xmn s THR 60 Cb -0.13 -3.08 0.27 0.00 1.34 0.00 0.00 72.50 70.90 1xmn s THR 60 CO 0.19 -0.19 1.63 -0.33 -0.54 0.00 0.00 174.62 175.37 1xmn h GLU 61 N 1.44 0.06 0.00 3.99 3.07 -1.93 -1.41 114.58 119.79 1xmn h GLU 61 Ca -0.44 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.41 1xmn h GLU 61 Cb 1.25 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.15 1xmn h GLU 61 CO 0.61 0.04 0.00 0.09 -1.40 0.00 0.00 179.01 178.35 1xmn n ASN 62 N -5.39 0.00 0.06 1.42 3.02 -1.26 -2.67 115.26 110.44 1xmn n ASN 62 Ca 0.11 -0.23 0.12 0.00 -0.03 0.00 0.00 54.58 54.56 1xmn n ASN 62 Cb 0.42 -0.19 0.25 0.00 -0.61 0.00 0.00 39.78 39.65 1xmn n ASN 62 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1xmn n ASP 63 N -1.19 0.67 -4.49 6.41 8.00 -0.53 -4.92 116.55 120.50 1xmn n ASP 63 Ca 0.12 0.20 -0.23 0.00 0.71 0.00 0.00 54.79 55.59 1xmn n ASP 63 Cb 0.14 -0.07 -0.11 0.00 -0.02 0.00 0.00 41.12 41.06 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 -4.12 2.35 0.07 0.64 1.43 -1.09 -1.00 118.68 116.95 1xmn s LEU 64 Ca 0.08 -1.37 -0.15 0.00 -1.03 0.00 0.00 54.13 51.66 1xmn s LEU 64 Cb 0.14 -0.51 0.02 0.00 0.03 0.00 0.00 46.19 45.87 1xmn s LEU 64 CO 0.68 -0.56 0.34 -0.76 0.23 0.00 0.00 176.35 176.28 1xmn s LEU 65 N -3.54 0.72 0.08 1.79 1.43 -0.69 -4.53 118.68 113.93 1xmn s LEU 65 Ca 0.36 -0.22 0.09 0.00 -1.03 0.00 0.00 54.13 53.33 1xmn s LEU 65 Cb 0.09 1.52 -0.03 0.00 0.03 0.00 0.00 46.19 47.80 1xmn s LEU 65 CO 0.16 -0.69 -0.24 0.68 0.23 0.00 0.00 176.35 176.49 1xmn s VAL 66 N -2.95 1.95 -0.11 -1.59 -7.23 -1.05 -0.37 120.40 109.04 1xmn s VAL 66 Ca -0.02 -1.47 0.04 0.00 -1.81 0.00 0.00 61.98 58.72 1xmn s VAL 66 Cb 0.00 -1.71 0.00 0.00 0.56 0.00 0.00 36.38 35.24 1xmn s VAL 66 CO -0.06 0.16 -0.23 -0.13 -0.31 0.00 0.00 175.10 174.53 1xmn s ARG 67 N -1.58 3.01 0.11 4.82 0.52 -0.27 -2.09 118.95 123.48 1xmn s ARG 67 Ca 0.10 -0.86 0.09 0.00 -0.52 0.00 0.00 55.73 54.54 1xmn s ARG 67 Cb -0.10 -2.32 -0.04 0.00 0.52 0.00 0.00 34.95 33.02 1xmn s ARG 67 CO 0.03 0.12 -0.23 0.42 0.02 0.00 0.00 175.30 175.66 1xmn s ILE 68 N 0.48 1.92 0.00 1.52 1.01 -0.20 -0.94 121.20 124.99 1xmn s ILE 68 Ca -0.15 -1.61 0.00 0.00 0.00 0.00 0.00 60.65 58.89 1xmn s ILE 68 Cb -0.17 -1.72 0.00 0.00 0.01 0.00 0.00 42.46 40.58 1xmn s ILE 68 CO 0.06 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.62 1xmn n GLY 69 N 1.06 0.56 3.86 6.18 0.00 -1.26 -0.61 105.19 114.99 1xmn n GLY 69 Ca -0.19 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.19 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 -0.72 3.87 0.08 1.61 1.02 -1.26 -4.27 119.74 120.07 1xmn s LYS 70 Ca 0.00 0.52 0.00 0.00 0.02 0.00 0.00 55.97 56.51 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 0.09 0.00 1.58 -0.92 0.00 0.00 175.35 176.10 1xmn n HIS 71 N -0.76 -0.30 -3.18 3.18 -0.00 -1.26 -4.91 115.22 107.99 1xmn n HIS 71 Ca 0.03 0.05 -0.43 0.00 -0.00 0.00 0.00 57.72 57.36 1xmn n HIS 71 Cb 0.53 0.11 -0.07 0.00 -0.00 0.00 0.00 29.99 30.57 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 6.23 0.10 0.26 0.15 -1.26 -0.78 113.70 112.97 1xmn s SER 72 Ca 0.00 -0.80 -0.02 0.00 0.70 0.00 0.00 55.95 55.83 1xmn s SER 72 Cb 0.00 -2.28 0.18 0.00 -1.71 0.00 0.00 66.02 62.21 1xmn s SER 72 CO 0.00 -0.82 0.53 -1.14 1.20 0.00 0.00 173.24 173.02 1xmn n ARG 73 N 6.06 -0.03 -3.05 5.44 0.00 0.97 -3.29 116.66 122.76 1xmn n ARG 73 Ca -0.06 0.53 -0.16 0.00 -0.00 0.00 0.00 57.85 58.15 1xmn n ARG 73 Cb 0.46 -0.80 -0.03 0.00 0.00 0.00 0.00 32.46 32.09 1xmn n ARG 73 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 1xmn n THR 74 N -4.50 -0.53 -2.71 5.15 -2.24 -1.26 -4.93 114.28 103.26 1xmn n THR 74 Ca 0.06 -2.49 -0.07 0.00 -2.27 0.00 0.00 64.05 59.27 1xmn n THR 74 Cb 0.19 -0.36 0.11 0.00 -2.10 0.00 0.00 70.33 68.17 1xmn n THR 74 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1xmn n ARG 75 N 2.34 1.16 0.00 -0.78 3.00 -1.21 -5.13 116.66 116.04 1xmn n ARG 75 Ca 0.21 -1.88 0.00 0.00 -0.01 0.00 0.00 57.85 56.17 1xmn n ARG 75 Cb 0.54 -0.27 0.00 0.00 0.00 0.00 0.00 32.46 32.74 1xmn n ARG 75 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.63 178.61 1xmn n TYR 76 N -0.40 0.00 -3.90 -1.55 9.36 -1.26 -4.90 117.16 114.51 1xmn n TYR 76 Ca -0.01 0.00 -0.34 0.00 3.32 0.00 0.00 57.90 60.87 1xmn n TYR 76 Cb 0.82 0.00 -0.13 0.00 -0.63 0.00 0.00 39.34 39.40 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 0.00 1.88 0.00 2.98 2.02 -1.26 -5.09 118.70 119.23 1xmn s GLU 77 Ca 0.00 -1.74 0.00 0.00 0.02 0.00 0.00 54.97 53.25 1xmn s GLU 77 Cb 0.00 -3.35 0.00 0.00 0.10 0.00 0.00 34.13 30.88 1xmn s GLU 77 CO 0.00 -0.93 0.00 2.89 0.02 0.00 0.00 175.26 177.24 1xmn n ARG 77 N 4.46 0.00 -0.86 1.61 -4.01 -1.26 -1.99 116.66 114.61 1xmn n ARG 77 Ca -0.02 0.00 -0.17 0.00 -1.04 0.00 0.00 57.85 56.62 1xmn n ARG 77 Cb 0.42 0.00 0.06 0.00 -3.04 0.00 0.00 32.46 29.90 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 0.00 5.71 -0.04 2.89 4.13 -1.26 -4.29 115.26 122.41 1xmn n ASN 78 Ca 0.00 -3.07 -0.04 0.00 1.68 0.00 0.00 54.58 53.15 1xmn n ASN 78 Cb 0.00 -0.95 -0.01 0.00 -1.54 0.00 0.00 39.78 37.28 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 0.04 0.74 -2.22 2.41 5.41 -0.84 -5.02 119.36 119.88 1xmn n ILE 79 Ca 0.33 0.30 -0.35 0.00 1.00 0.00 0.00 62.75 64.04 1xmn n ILE 79 Cb 0.74 -1.84 0.00 0.00 -0.71 0.00 0.00 39.64 37.84 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 -1.90 3.34 0.17 0.38 -1.05 -1.01 -4.78 118.70 113.84 1xmn s GLU 80 Ca -0.13 1.54 0.05 0.00 -0.15 0.00 0.00 54.97 56.28 1xmn s GLU 80 Cb 0.02 -2.01 -0.05 0.00 -0.44 0.00 0.00 34.13 31.65 1xmn s GLU 80 CO 0.19 -0.85 -0.09 0.15 0.95 0.00 0.00 175.26 175.60 1xmn s LYS 81 N -3.42 1.14 0.05 -4.83 -0.14 0.22 -4.97 119.74 107.79 1xmn s LYS 81 Ca 0.71 -1.51 0.07 0.00 -1.36 0.00 0.00 55.97 53.88 1xmn s LYS 81 Cb -0.22 -0.70 -0.03 0.00 -1.68 0.00 0.00 37.83 35.20 1xmn s LYS 81 CO 0.28 0.07 -0.20 0.42 -0.76 0.00 0.00 175.35 175.16 1xmn s ILE 82 N -3.28 1.62 0.02 2.17 1.01 -1.26 -1.03 121.20 120.44 1xmn s ILE 82 Ca 0.19 -1.24 -0.00 0.00 0.00 0.00 0.00 60.65 59.60 1xmn s ILE 82 Cb 0.03 -1.42 -0.02 0.00 0.01 0.00 0.00 42.46 41.05 1xmn s ILE 82 CO 0.03 0.14 -0.02 -0.44 0.00 0.00 0.00 174.94 174.65 1xmn s SER 83 N -1.30 0.25 0.26 3.58 0.01 -0.89 -5.01 113.70 110.60 1xmn s SER 83 Ca 0.07 -0.52 0.01 0.00 1.31 0.00 0.00 55.95 56.82 1xmn s SER 83 Cb -0.09 0.11 -0.04 0.00 0.21 0.00 0.00 66.02 66.22 1xmn s SER 83 CO 0.02 -0.33 0.44 -0.04 0.41 0.00 0.00 173.24 173.75 1xmn s MET 84 N -1.63 3.49 -0.24 12.44 -1.94 -1.26 -2.54 119.30 127.62 1xmn s MET 84 Ca -0.14 -0.45 -0.12 0.00 -1.71 0.00 0.00 55.69 53.26 1xmn s MET 84 Cb -0.09 -2.79 -0.05 0.00 2.01 0.00 0.00 34.83 33.92 1xmn s MET 84 CO -0.01 0.32 0.23 -0.51 -0.01 0.00 0.00 175.02 175.03 1xmn s LEU 85 N -3.86 4.11 -0.04 -0.03 1.43 -1.26 -1.32 118.68 117.70 1xmn s LEU 85 Ca 0.38 0.20 -0.15 0.00 -1.03 0.00 0.00 54.13 53.53 1xmn s LEU 85 Cb -0.10 -2.22 -0.31 0.00 0.03 0.00 0.00 46.19 43.59 1xmn s LEU 85 CO 0.32 0.01 0.77 -0.08 0.23 0.00 0.00 176.35 177.59 1xmn h GLU 86 N 7.59 0.38 -2.18 1.70 4.81 -0.71 -3.43 114.58 122.74 1xmn h GLU 86 Ca -0.37 -0.65 -0.06 0.00 -0.13 0.00 0.00 59.36 58.15 1xmn h GLU 86 Cb 1.17 0.24 -0.21 0.00 0.63 0.00 0.00 28.75 30.58 1xmn h GLU 86 CO 0.66 1.31 0.07 0.21 -0.73 0.00 0.00 179.01 180.53 1xmn s LYS 87 N -2.53 0.85 -0.12 1.92 2.47 -1.18 -4.98 119.74 116.17 1xmn s LYS 87 Ca -0.15 0.61 -0.03 0.00 -1.56 0.00 0.00 55.97 54.84 1xmn s LYS 87 Cb 0.04 0.41 -0.03 0.00 -1.46 0.00 0.00 37.83 36.78 1xmn s LYS 87 CO 0.85 -0.18 0.01 0.42 0.16 0.00 0.00 175.35 176.61 1xmn s ILE 88 N -0.28 4.33 -0.26 5.43 1.01 -1.26 -1.33 121.20 128.82 1xmn s ILE 88 Ca -0.05 -0.23 0.00 0.00 0.00 0.00 0.00 60.65 60.38 1xmn s ILE 88 Cb -0.03 -2.86 0.08 0.00 0.01 0.00 0.00 42.46 39.66 1xmn s ILE 88 CO 0.04 0.56 0.02 -0.31 0.00 0.00 0.00 174.94 175.25 1xmn s TYR 89 N -0.39 2.14 -0.10 3.97 1.51 0.51 -5.00 117.35 119.98 1xmn s TYR 89 Ca 0.08 -1.76 -0.08 0.00 -1.01 0.00 0.00 57.07 54.29 1xmn s TYR 89 Cb -0.12 -1.70 -0.04 0.00 -0.11 0.00 0.00 41.96 39.99 1xmn s TYR 89 CO 0.02 -0.80 0.18 0.42 -1.11 0.00 0.00 175.55 174.26 1xmn s ILE 90 N 1.47 5.44 0.06 2.71 1.01 -1.26 -0.29 121.20 130.35 1xmn s ILE 90 Ca 0.02 0.30 -0.34 0.00 0.00 0.00 0.00 60.65 60.62 1xmn s ILE 90 Cb -0.18 -3.44 -0.13 0.00 0.01 0.00 0.00 42.46 38.71 1xmn s ILE 90 CO -0.12 0.61 1.67 1.57 0.00 0.00 0.00 174.94 178.67 1xmn n HIS 91 N 1.98 2.24 0.24 3.97 -0.00 -1.02 -4.82 115.22 117.81 1xmn n HIS 91 Ca -0.19 0.20 0.18 0.00 -0.00 0.00 0.00 57.72 57.91 1xmn n HIS 91 Cb 0.55 -2.57 0.88 0.00 -0.00 0.00 0.00 29.99 28.84 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 6.97 0.00 -0.32 1.57 0.13 -1.95 -1.60 132.00 136.81 1xmn h PRO 92 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1xmn h PRO 92 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1xmn h PRO 92 CO 0.90 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 179.21 1xmn n ARG 93 N -3.47 3.09 -1.68 0.86 1.74 -1.26 -4.99 116.66 110.95 1xmn n ARG 93 Ca 0.01 -2.71 -0.43 0.00 -0.77 0.00 0.00 57.85 53.94 1xmn n ARG 93 Cb 0.34 -1.76 -0.03 0.00 -1.02 0.00 0.00 32.46 29.98 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 -0.15 2.51 -3.25 -1.55 9.36 -0.60 -4.78 117.16 118.69 1xmn n TYR 94 Ca 0.20 -0.20 -0.46 0.00 3.32 0.00 0.00 57.90 60.77 1xmn n TYR 94 Cb 0.82 -2.74 -0.01 0.00 -0.63 0.00 0.00 39.34 36.78 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 3.56 6.95 0.33 2.98 3.84 -0.04 -4.84 114.94 127.72 1xmn s ASN 95 Ca 0.86 -2.92 0.19 0.00 0.21 0.00 0.00 52.86 51.21 1xmn s ASN 95 Cb -0.51 -2.25 0.16 0.00 -0.55 0.00 0.00 41.25 38.10 1xmn s ASN 95 CO 0.42 -0.56 1.46 4.11 -2.79 0.00 0.00 177.10 179.73 1xmn h TRP 96 N 7.52 0.00 0.00 0.43 5.08 -1.91 0.15 115.95 127.22 1xmn h TRP 96 Ca 0.15 0.00 -0.07 0.00 1.08 0.00 0.00 58.89 60.05 1xmn h TRP 96 Cb 0.97 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.12 1xmn h TRP 96 CO 0.97 0.27 -0.33 0.00 -1.28 0.00 0.00 178.44 178.08 1xmn h ARG 97 N 0.00 0.00 0.00 0.12 3.08 -2.00 -3.44 114.38 112.14 1xmn h ARG 97 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1xmn h ARG 97 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 1xmn h ARG 97 CO 0.03 0.33 0.00 -1.91 -1.07 0.00 0.00 179.97 177.36 1xmn n GLU 97 N -4.06 0.00 -0.06 0.04 2.13 -1.25 -5.00 120.64 112.43 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 0.38 -0.05 0.03 0.00 0.27 0.00 0.00 31.44 32.06 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 -2.61 1.33 -1.86 4.31 0.23 -1.24 -4.97 115.26 110.45 1xmn n ASN 98 Ca 0.00 -1.93 -0.17 0.00 -0.53 0.00 0.00 54.58 51.95 1xmn n ASN 98 Cb 0.00 -0.10 -0.01 0.00 -2.08 0.00 0.00 39.78 37.59 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 -0.49 -1.71 -4.74 -4.53 4.32 0.51 -4.94 117.00 105.43 1xmn n LEU 99 Ca 0.03 0.03 -0.42 0.00 -0.02 0.00 0.00 56.01 55.63 1xmn n LEU 99 Cb 0.43 -2.47 -0.02 0.00 -1.62 0.00 0.00 43.42 39.74 1xmn n LEU 99 CO 0.00 -0.25 1.25 -0.62 -1.22 0.00 0.00 177.39 176.55 1xmn s ASP 100 N -2.30 6.45 -0.94 -1.43 2.15 -1.21 -2.40 116.67 116.99 1xmn s ASP 100 Ca 0.00 2.83 -0.01 0.00 0.43 0.00 0.00 52.55 55.81 1xmn s ASP 100 Cb 0.00 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 40.00 1xmn s ASP 100 CO 0.00 -0.88 0.79 0.54 -0.17 0.00 0.00 175.17 175.45 1xmn n ARG 101 N 2.91 -5.23 -2.27 4.34 1.74 -1.26 -0.86 116.66 116.03 1xmn n ARG 101 Ca 0.11 0.66 -0.42 0.00 -0.77 0.00 0.00 57.85 57.42 1xmn n ARG 101 Cb 0.37 -5.11 -0.00 0.00 -1.02 0.00 0.00 32.46 26.70 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 -2.59 4.47 -3.82 0.55 2.03 -1.01 -4.38 116.55 111.80 1xmn n ASP 102 Ca -0.20 -2.88 -0.12 0.00 0.52 0.00 0.00 54.79 52.11 1xmn n ASP 102 Cb 0.62 -1.71 -0.10 0.00 -0.72 0.00 0.00 41.12 39.21 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 4.35 0.05 -0.02 5.18 2.07 -1.26 -3.72 121.20 127.84 1xmn s ILE 103 Ca 0.53 -0.43 -0.23 0.00 -1.41 0.00 0.00 60.65 59.11 1xmn s ILE 103 Cb 0.07 -0.44 0.05 0.00 0.13 0.00 0.00 42.46 42.27 1xmn s ILE 103 CO 0.04 -0.24 0.51 0.00 -1.91 0.00 0.00 174.94 173.34 1xmn s ALA 104 N -0.91 -1.31 0.08 1.50 0.00 -0.70 -2.44 121.76 117.99 1xmn s ALA 104 Ca -0.10 0.82 0.08 0.00 0.00 0.00 0.00 51.96 52.77 1xmn s ALA 104 Cb -0.05 0.07 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1xmn s ALA 104 CO 0.02 -0.34 -0.19 -0.51 0.00 0.00 0.00 175.76 174.74 1xmn s LEU 105 N -1.33 2.60 -0.09 0.00 1.43 0.60 -1.65 118.68 120.24 1xmn s LEU 105 Ca -0.11 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 52.46 1xmn s LEU 105 Cb -0.02 -1.49 0.02 0.00 0.03 0.00 0.00 46.19 44.73 1xmn s LEU 105 CO 0.06 0.21 -0.06 -0.04 0.23 0.00 0.00 176.35 176.75 1xmn s MET 106 N -1.81 1.28 -0.13 1.70 -1.94 -0.23 -0.37 119.30 117.80 1xmn s MET 106 Ca 0.16 -0.19 -0.18 0.00 -1.71 0.00 0.00 55.69 53.77 1xmn s MET 106 Cb -0.10 -1.33 -0.04 0.00 2.01 0.00 0.00 34.83 35.36 1xmn s MET 106 CO 0.07 -0.20 0.49 0.21 -0.01 0.00 0.00 175.02 175.58 1xmn s LYS 107 N 1.48 4.32 0.29 2.03 2.20 -0.45 -1.37 119.74 128.26 1xmn s LYS 107 Ca -0.00 0.45 -0.28 0.00 -0.36 0.00 0.00 55.97 55.78 1xmn s LYS 107 Cb -0.13 -3.45 -0.09 0.00 -1.51 0.00 0.00 37.83 32.64 1xmn s LYS 107 CO -0.05 0.12 0.95 -0.51 -0.36 0.00 0.00 175.35 175.50 1xmn s LEU 108 N 0.75 4.47 0.20 5.43 1.43 0.58 -0.03 118.68 131.52 1xmn s LEU 108 Ca 0.26 1.89 -0.10 0.00 -1.03 0.00 0.00 54.13 55.15 1xmn s LEU 108 Cb -0.15 -3.84 0.21 0.00 0.03 0.00 0.00 46.19 42.44 1xmn s LEU 108 CO 0.10 0.02 1.81 0.50 0.23 0.00 0.00 176.35 179.01 1xmn h LYS 109 N 3.59 0.64 -5.77 1.70 1.63 -1.50 -3.43 116.57 113.43 1xmn h LYS 109 Ca -0.46 -0.04 -0.50 0.00 -0.85 0.00 0.00 60.65 58.80 1xmn h LYS 109 Cb 1.20 -0.14 -0.23 0.00 -0.60 0.00 0.00 32.23 32.45 1xmn h LYS 109 CO 0.66 0.42 -0.81 0.15 -3.45 0.00 0.00 179.45 176.43 1xmn s LYS 110 N -6.11 1.04 0.45 1.90 3.01 -1.26 -4.98 119.74 113.79 1xmn s LYS 110 Ca -0.13 -0.99 -0.24 0.00 -1.01 0.00 0.00 55.97 53.60 1xmn s LYS 110 Cb 0.15 -1.17 -0.08 0.00 -1.01 0.00 0.00 37.83 35.73 1xmn s LYS 110 CO 0.75 0.28 1.23 -1.25 0.51 0.00 0.00 175.35 176.87 1xmn s PRO 111 N -1.60 3.78 0.05 -1.68 0.04 -1.26 -4.88 135.00 129.44 1xmn s PRO 111 Ca 0.03 1.95 -0.11 0.00 0.04 0.00 0.00 61.00 62.92 1xmn s PRO 111 Cb -0.09 -2.53 -0.06 0.00 0.04 0.00 0.00 34.50 31.86 1xmn s PRO 111 CO 0.03 -0.58 0.38 0.54 0.04 0.00 0.00 177.00 177.41 1xmn s VAL 112 N -1.41 5.11 0.01 -0.36 0.11 0.15 -5.02 120.40 118.99 1xmn s VAL 112 Ca 0.62 0.51 -0.24 0.00 -2.93 0.00 0.00 61.98 59.93 1xmn s VAL 112 Cb -0.33 -3.64 -0.05 0.00 -1.53 0.00 0.00 36.38 30.82 1xmn s VAL 112 CO 0.41 0.37 0.72 0.00 -3.33 0.00 0.00 175.10 173.27 1xmn s ALA 113 N -1.30 3.38 0.62 1.54 0.00 -1.26 -4.75 121.76 119.99 1xmn s ALA 113 Ca 0.30 0.21 -0.13 0.00 0.00 0.00 0.00 51.96 52.33 1xmn s ALA 113 Cb -0.14 -2.94 -0.03 0.00 0.00 0.00 0.00 23.12 20.01 1xmn s ALA 113 CO 0.16 0.05 1.04 -0.06 0.00 0.00 0.00 175.76 176.95 1xmn s PHE 114 N 0.10 3.19 0.00 0.00 0.08 -1.26 -4.87 117.98 115.21 1xmn s PHE 114 Ca 0.37 1.44 0.00 0.00 0.12 0.00 0.00 56.93 58.86 1xmn s PHE 114 Cb -0.19 -2.89 0.00 0.00 -0.57 0.00 0.00 43.02 39.36 1xmn s PHE 114 CO 0.21 -0.99 0.00 -1.13 -0.10 0.00 0.00 175.22 173.21 1xmn n SER 115 N -2.47 0.00 0.17 1.36 3.41 0.34 -4.92 113.62 111.51 1xmn n SER 115 Ca 0.08 -0.93 0.13 0.00 -0.26 0.00 0.00 58.87 57.89 1xmn n SER 115 Cb 0.53 0.00 0.57 0.00 -0.26 0.00 0.00 64.21 65.05 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 -3.01 116.42 118.78 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 -0.50 -1.22 -1.72 0.00 0.00 179.24 175.80 1xmn n TYR 117 N -2.46 0.00 -3.89 4.55 4.01 -1.26 -4.76 117.16 113.34 1xmn n TYR 117 Ca 0.01 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.46 1xmn n TYR 117 Cb 0.23 -0.02 -0.16 0.00 -0.31 0.00 0.00 39.34 39.07 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 -1.85 1.19 -0.19 -0.72 1.01 -1.14 -4.35 121.20 115.15 1xmn s ILE 118 Ca 0.02 -0.84 -0.15 0.00 0.00 0.00 0.00 60.65 59.68 1xmn s ILE 118 Cb 0.06 -1.44 0.05 0.00 0.01 0.00 0.00 42.46 41.14 1xmn s ILE 118 CO 0.33 -0.00 0.49 -2.28 0.00 0.00 0.00 174.94 173.48 1xmn s HIS 119 N 1.58 -0.62 0.52 3.97 2.46 -0.58 -0.50 115.29 122.11 1xmn s HIS 119 Ca -0.02 1.40 -0.20 0.00 0.47 0.00 0.00 55.06 56.71 1xmn s HIS 119 Cb -0.17 0.25 -0.07 0.00 -0.13 0.00 0.00 32.58 32.47 1xmn s HIS 119 CO -0.07 -0.31 1.11 -1.25 -2.47 0.00 0.00 174.74 171.75 1xmn s PRO 120 N 0.72 3.53 0.32 2.88 0.04 -1.26 -2.47 135.00 138.75 1xmn s PRO 120 Ca -0.04 1.58 -0.00 0.00 0.04 0.00 0.00 61.00 62.58 1xmn s PRO 120 Cb -0.05 -2.10 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 1xmn s PRO 120 CO -0.05 -0.70 0.53 0.54 0.04 0.00 0.00 177.00 177.36 1xmn s VAL 121 N -1.78 5.11 0.31 -0.36 0.11 -0.62 -4.92 120.40 118.25 1xmn s VAL 121 Ca 0.70 -0.39 -0.09 0.00 -2.93 0.00 0.00 61.98 59.27 1xmn s VAL 121 Cb -0.23 -3.83 -0.07 0.00 -1.53 0.00 0.00 36.38 30.72 1xmn s VAL 121 CO 0.27 -0.48 0.64 0.00 -3.33 0.00 0.00 175.10 172.19 1xmn s LEU 123 N -3.36 4.35 0.53 0.00 1.43 -1.26 -0.98 118.68 119.39 1xmn s LEU 123 Ca 0.48 0.45 -0.22 0.00 -1.03 0.00 0.00 54.13 53.82 1xmn s LEU 123 Cb -0.11 -2.06 -0.05 0.00 0.03 0.00 0.00 46.19 44.00 1xmn s LEU 123 CO 0.26 0.40 1.33 -2.16 0.23 0.00 0.00 176.35 176.41 1xmn s PRO 124 N -0.99 3.24 0.45 1.29 0.04 -1.26 -4.93 135.00 132.84 1xmn s PRO 124 Ca 0.15 2.16 0.08 0.00 0.04 0.00 0.00 61.00 63.42 1xmn s PRO 124 Cb -0.12 -2.28 0.01 0.00 0.04 0.00 0.00 34.50 32.15 1xmn s PRO 124 CO 0.04 -1.09 0.48 0.16 0.04 0.00 0.00 177.00 176.63 1xmn s ASP 125 N -1.02 5.15 0.16 6.66 1.47 -1.26 -4.90 116.67 122.93 1xmn s ASP 125 Ca 0.70 -0.74 -0.25 0.00 1.18 0.00 0.00 52.55 53.44 1xmn s ASP 125 Cb -0.38 -0.37 0.04 0.00 -0.34 0.00 0.00 42.92 41.87 1xmn s ASP 125 CO 0.46 -0.82 1.58 0.08 0.68 0.00 0.00 175.17 177.15 1xmn h ARG 126 N 0.80 -0.25 -0.64 2.11 -0.00 -1.99 -2.52 114.38 111.88 1xmn h ARG 126 Ca -0.39 0.02 -0.09 0.00 -0.00 0.00 0.00 59.98 59.52 1xmn h ARG 126 Cb 1.28 0.06 -0.02 0.00 -0.00 0.00 0.00 29.97 31.28 1xmn h ARG 126 CO 0.52 -0.17 0.05 0.93 -0.00 0.00 0.00 179.97 181.31 1xmn h GLU 127 N -0.26 1.10 -0.01 0.08 4.39 -2.04 -2.46 114.58 115.37 1xmn h GLU 127 Ca 0.17 -0.32 0.00 0.00 0.34 0.00 0.00 59.36 59.55 1xmn h GLU 127 Cb 0.57 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1xmn h GLU 127 CO -0.61 1.04 0.00 2.41 -1.16 0.00 0.00 179.01 180.69 1xmn n THR 128 N -4.19 0.00 0.00 1.13 -1.04 -0.95 -1.15 114.28 108.08 1xmn n THR 128 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 1xmn n THR 128 Cb 0.32 -0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.83 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 0.46 0.00 0.06 2.41 0.00 -0.93 -0.87 120.51 121.64 1xmn n ALA 129 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1xmn n ALA 129 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 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 0.57 0.25 0.00 4.64 -1.42 -3.38 113.55 114.22 1xmn h SER 129 Ca 0.00 -0.44 -0.33 0.00 -0.47 0.00 0.00 61.79 60.55 1xmn h SER 129 Cb 0.00 -0.17 -0.06 0.00 -0.31 0.00 0.00 62.40 61.86 1xmn h SER 129 CO 0.00 1.23 -2.02 0.18 -0.87 0.00 0.00 176.83 175.35 1xmn n LEU 129 N -3.78 0.85 -4.33 5.97 4.77 -0.05 -4.70 117.00 115.74 1xmn n LEU 129 Ca -0.07 0.22 -0.39 0.00 -0.03 0.00 0.00 56.01 55.74 1xmn n LEU 129 Cb 0.81 0.11 -0.02 0.00 -2.33 0.00 0.00 43.42 41.99 1xmn n LEU 129 CO 0.51 0.50 2.01 0.18 -1.33 0.00 0.00 177.39 179.26 1xmn n LEU 130 N -2.99 4.75 -3.91 2.23 4.77 -1.26 -4.82 117.00 115.76 1xmn n LEU 130 Ca -0.26 -3.67 -0.13 0.00 -0.03 0.00 0.00 56.01 51.92 1xmn n LEU 130 Cb 1.09 -1.67 -0.14 0.00 -2.33 0.00 0.00 43.42 40.37 1xmn n LEU 130 CO 0.43 -0.21 -0.37 -1.10 -1.33 0.00 0.00 177.39 174.80 1xmn s GLN 131 N 4.67 0.17 0.25 3.23 -0.21 -1.26 -4.93 119.66 121.57 1xmn s GLN 131 Ca 0.57 -0.14 -0.31 0.00 0.02 0.00 0.00 55.36 55.50 1xmn s GLN 131 Cb 0.06 -0.12 -0.13 0.00 1.00 0.00 0.00 33.01 33.82 1xmn s GLN 131 CO 0.07 0.03 1.41 0.00 -2.12 0.00 0.00 175.29 174.68 1xmn n ALA 132 N 2.84 1.25 0.00 6.09 0.00 -1.26 -1.53 120.51 127.89 1xmn n ALA 132 Ca -0.14 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.71 1xmn n ALA 132 Cb 0.59 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.75 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 2.06 2.97 3.73 0.00 0.00 0.25 -4.94 105.19 109.27 1xmn n GLY 133 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.80 3.25 0.07 1.61 1.51 -0.58 -4.55 117.35 115.86 1xmn s TYR 134 Ca 0.00 1.14 -0.10 0.00 -1.01 0.00 0.00 57.07 57.10 1xmn s TYR 134 Cb 0.00 -3.63 -0.06 0.00 -0.11 0.00 0.00 41.96 38.16 1xmn s TYR 134 CO 0.00 -2.04 0.39 0.15 -1.11 0.00 0.00 175.55 172.93 1xmn s LYS 135 N 0.26 3.75 0.43 -0.62 1.02 -1.26 -0.12 119.74 123.20 1xmn s LYS 135 Ca 0.59 0.16 0.04 0.00 0.02 0.00 0.00 55.97 56.78 1xmn s LYS 135 Cb -0.37 -3.02 -0.05 0.00 -0.52 0.00 0.00 37.83 33.88 1xmn s LYS 135 CO 0.36 0.58 0.03 0.20 -0.92 0.00 0.00 175.35 175.60 1xmn s GLY 136 N -1.71 2.64 -0.07 -3.33 0.00 0.85 -4.83 107.32 100.87 1xmn s GLY 136 Ca 0.32 -1.44 0.05 0.00 0.00 0.00 0.00 44.72 43.65 1xmn s GLY 136 CO 0.17 -2.06 -0.24 -1.60 0.00 0.00 0.00 173.10 169.38 1xmn s ARG 137 N -3.80 2.59 -0.01 2.90 3.52 0.19 -1.04 118.95 123.32 1xmn s ARG 137 Ca 0.23 -0.87 0.06 0.00 -0.13 0.00 0.00 55.73 55.03 1xmn s ARG 137 Cb 0.06 -2.14 -0.03 0.00 -1.56 0.00 0.00 34.95 31.29 1xmn s ARG 137 CO 0.12 0.32 -0.20 0.08 -0.81 0.00 0.00 175.30 174.81 1xmn s VAL 138 N -0.03 2.60 0.05 7.11 1.01 0.22 -0.67 120.40 130.69 1xmn s VAL 138 Ca -0.07 -1.03 0.02 0.00 0.00 0.00 0.00 61.98 60.90 1xmn s VAL 138 Cb -0.15 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.20 1xmn s VAL 138 CO 0.05 0.50 -0.07 0.42 0.00 0.00 0.00 175.10 175.99 1xmn s THR 139 N -0.76 0.51 0.00 3.92 -4.23 -1.23 -1.50 115.64 112.35 1xmn s THR 139 Ca 0.12 -1.16 0.00 0.00 -1.18 0.00 0.00 61.69 59.47 1xmn s THR 139 Cb -0.10 -0.70 0.00 0.00 1.34 0.00 0.00 72.50 73.04 1xmn s THR 139 CO 0.01 -0.45 0.00 0.61 -0.54 0.00 0.00 174.62 174.25 1xmn n GLY 140 N 1.30 1.52 1.67 3.99 0.00 -0.85 -4.51 105.19 108.31 1xmn n GLY 140 Ca -0.22 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 44.90 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 -0.54 1.94 -1.83 1.61 8.01 -1.26 -2.16 117.44 123.20 1xmn n TRP 141 Ca 0.00 -1.07 -0.29 0.00 -1.31 0.00 0.00 57.50 54.83 1xmn n TRP 141 Cb 0.00 -0.56 0.21 0.00 -2.01 0.00 0.00 31.31 28.95 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 -0.17 -1.61 3.50 6.99 0.00 -1.26 -4.33 105.19 108.31 1xmn n GLY 142 Ca 0.33 -1.69 -0.49 0.00 0.00 0.00 0.00 46.02 44.18 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 -3.93 0.17 -0.01 1.61 5.03 -0.77 -3.01 115.26 114.35 1xmn n ASN 143 Ca 0.16 1.15 0.14 0.00 0.87 0.00 0.00 54.58 56.91 1xmn n ASN 143 Cb 0.57 -1.10 0.69 0.00 -1.02 0.00 0.00 39.78 38.92 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 1.75 0.08 -3.58 3.41 4.77 -0.89 -0.99 117.00 121.55 1xmn n LEU 144 Ca 0.15 0.30 -0.06 0.00 -0.03 0.00 0.00 56.01 56.37 1xmn n LEU 144 Cb 0.25 -0.33 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 1xmn n LEU 144 CO 0.59 0.02 0.92 -1.59 -1.33 0.00 0.00 177.39 175.99 1xmn s LYS 145 N -2.69 0.43 0.02 3.23 -2.85 -1.26 -4.26 119.74 112.36 1xmn s LYS 145 Ca 0.24 -0.09 -0.36 0.00 -1.00 0.00 0.00 55.97 54.76 1xmn s LYS 145 Cb 0.20 0.20 -0.15 0.00 -2.06 0.00 0.00 37.83 36.02 1xmn s LYS 145 CO 0.49 -0.18 1.59 -1.91 0.10 0.00 0.00 175.35 175.45 1xmn n GLU 146 N 0.10 1.70 -4.62 1.78 2.13 -1.26 -4.83 120.64 115.64 1xmn n GLU 146 Ca -0.03 0.62 -0.23 0.00 0.66 0.00 0.00 57.16 58.18 1xmn n GLU 146 Cb 0.59 -2.35 -0.15 0.00 0.27 0.00 0.00 31.44 29.80 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 1.81 1.09 0.00 6.31 2.01 -1.26 -5.00 115.64 120.61 1xmn s THR 147 Ca 0.86 -0.56 0.00 0.00 0.31 0.00 0.00 61.69 62.31 1xmn s THR 147 Cb -0.83 -0.93 0.00 0.00 0.01 0.00 0.00 72.50 70.75 1xmn s THR 147 CO 0.48 0.32 0.47 0.79 -0.69 0.00 0.00 174.62 175.99 1xmn n TRP 147 N 3.00 0.00 -0.02 4.92 7.02 -1.26 -5.14 117.44 125.97 1xmn n TRP 147 Ca -0.16 -0.11 -0.01 0.00 -1.02 0.00 0.00 57.50 56.19 1xmn n TRP 147 Cb 0.54 -0.01 -0.00 0.00 -2.42 0.00 0.00 31.31 29.42 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 -0.11 0.29 -4.63 -0.99 -2.24 -1.26 -5.37 114.28 99.97 1xmn n THR 147 Ca 0.00 0.44 -0.29 0.00 -2.27 0.00 0.00 64.05 61.93 1xmn n THR 147 Cb 0.24 -1.67 -0.08 0.00 -2.10 0.00 0.00 70.33 66.71 1xmn n THR 147 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1xmn s GLY 150 N -3.09 2.77 0.05 3.38 0.00 -1.26 -5.30 107.32 103.88 1xmn s GLY 150 Ca -0.04 -0.94 0.04 0.00 0.00 0.00 0.00 44.72 43.78 1xmn s GLY 150 CO 0.06 -2.02 -0.04 1.20 0.00 0.00 0.00 173.10 172.30 1xmn s GLN 151 N -3.80 2.49 0.82 2.90 -0.21 -1.26 -2.10 119.66 118.50 1xmn s GLN 151 Ca 0.17 -0.81 -0.12 0.00 0.02 0.00 0.00 55.36 54.61 1xmn s GLN 151 Cb 0.03 -2.50 0.09 0.00 1.00 0.00 0.00 33.01 31.63 1xmn s GLN 151 CO 0.09 0.56 1.18 -2.14 -2.12 0.00 0.00 175.29 172.87 1xmn s PRO 152 N -1.90 1.60 -0.20 2.91 0.02 -1.26 -4.99 135.00 131.16 1xmn s PRO 152 Ca 0.21 1.66 -0.03 0.00 0.02 0.00 0.00 61.00 62.86 1xmn s PRO 152 Cb -0.11 -1.78 -0.20 0.00 0.02 0.00 0.00 34.50 32.42 1xmn s PRO 152 CO 0.13 -2.22 0.01 0.45 -0.33 0.00 0.00 177.00 175.04 1xmn n SER 153 N -3.47 2.04 -4.45 2.53 2.88 -1.26 -4.75 113.62 107.14 1xmn n SER 153 Ca 0.13 0.03 -0.29 0.00 -1.33 0.00 0.00 58.87 57.41 1xmn n SER 153 Cb 0.51 -0.62 -0.12 0.00 -0.75 0.00 0.00 64.21 63.23 1xmn n SER 153 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1xmn s VAL 154 N -2.53 2.57 0.16 2.46 -7.23 -1.26 0.32 120.40 114.89 1xmn s VAL 154 Ca -0.30 -1.67 -0.32 0.00 -1.81 0.00 0.00 61.98 57.87 1xmn s VAL 154 Cb 0.08 -2.17 -0.17 0.00 0.56 0.00 0.00 36.38 34.68 1xmn s VAL 154 CO 0.66 0.06 0.99 -0.11 -0.31 0.00 0.00 175.10 176.39 1xmn n LEU 155 N 0.75 0.68 -4.83 1.32 7.94 0.04 -4.81 117.00 118.10 1xmn n LEU 155 Ca -0.16 1.15 -0.29 0.00 -1.11 0.00 0.00 56.01 55.59 1xmn n LEU 155 Cb 0.53 -1.11 -0.05 0.00 0.53 0.00 0.00 43.42 43.31 1xmn n LEU 155 CO 0.27 -1.79 -0.22 -1.10 -1.11 0.00 0.00 177.39 173.44 1xmn s GLN 156 N -0.57 3.05 0.00 1.96 -1.52 -0.92 -1.41 119.66 120.26 1xmn s GLN 156 Ca 0.73 -0.66 0.00 0.00 -1.95 0.00 0.00 55.36 53.48 1xmn s GLN 156 Cb -0.93 -2.80 -0.00 0.00 -0.22 0.00 0.00 33.01 29.06 1xmn s GLN 156 CO 0.55 0.56 -0.01 0.54 -0.25 0.00 0.00 175.29 176.67 1xmn s VAL 157 N -1.51 0.06 -0.09 1.09 0.11 -0.03 -2.02 120.40 118.02 1xmn s VAL 157 Ca 0.31 -0.12 -0.11 0.00 -2.93 0.00 0.00 61.98 59.13 1xmn s VAL 157 Cb -0.12 -0.08 0.03 0.00 -1.53 0.00 0.00 36.38 34.68 1xmn s VAL 157 CO 0.24 -0.04 0.30 0.54 -3.33 0.00 0.00 175.10 172.81 1xmn s VAL 158 N -0.16 0.01 -0.18 2.04 0.11 -0.56 -1.34 120.40 120.31 1xmn s VAL 158 Ca -0.01 -0.12 -0.08 0.00 -2.93 0.00 0.00 61.98 58.83 1xmn s VAL 158 Cb -0.01 -0.47 -0.04 0.00 -1.53 0.00 0.00 36.38 34.33 1xmn s VAL 158 CO -0.00 -0.07 0.07 0.20 -3.33 0.00 0.00 175.10 171.98 1xmn s ASN 159 N -0.20 5.74 0.03 3.54 0.01 -1.26 -0.61 114.94 122.20 1xmn s ASN 159 Ca -0.03 0.12 0.02 0.00 -0.71 0.00 0.00 52.86 52.25 1xmn s ASN 159 Cb -0.03 -1.98 -0.02 0.00 0.41 0.00 0.00 41.25 39.63 1xmn s ASN 159 CO 0.01 0.18 -0.07 -0.76 -1.51 0.00 0.00 177.10 174.96 1xmn s LEU 160 N 0.33 2.19 0.22 0.60 1.43 -0.20 -4.94 118.68 118.29 1xmn s LEU 160 Ca 0.04 -0.43 -0.17 0.00 -1.03 0.00 0.00 54.13 52.55 1xmn s LEU 160 Cb -0.12 -0.18 -0.08 0.00 0.03 0.00 0.00 46.19 45.84 1xmn s LEU 160 CO -0.00 -0.14 0.67 -2.16 0.23 0.00 0.00 176.35 174.95 1xmn s PRO 161 N -1.19 4.11 0.37 1.29 0.04 -1.26 -0.11 135.00 138.25 1xmn s PRO 161 Ca -0.07 0.70 -0.26 0.00 0.04 0.00 0.00 61.00 61.41 1xmn s PRO 161 Cb -0.08 -2.82 -0.09 0.00 0.04 0.00 0.00 34.50 31.56 1xmn s PRO 161 CO 0.00 0.38 1.16 0.42 0.04 0.00 0.00 177.00 179.00 1xmn s ILE 162 N -1.59 3.24 0.01 0.56 1.01 0.83 -0.81 121.20 124.44 1xmn s ILE 162 Ca 0.43 1.09 0.04 0.00 0.00 0.00 0.00 60.65 62.21 1xmn s ILE 162 Cb -0.15 -3.63 -0.03 0.00 0.01 0.00 0.00 42.46 38.65 1xmn s ILE 162 CO 0.20 0.14 -0.07 -0.69 0.00 0.00 0.00 174.94 174.52 1xmn s VAL 163 N -1.36 3.60 0.26 2.92 1.01 -0.41 -0.58 120.40 125.84 1xmn s VAL 163 Ca 0.54 -0.83 -0.30 0.00 0.00 0.00 0.00 61.98 61.38 1xmn s VAL 163 Cb -0.31 -2.58 -0.13 0.00 0.00 0.00 0.00 36.38 33.37 1xmn s VAL 163 CO 0.39 0.37 1.41 -0.62 0.00 0.00 0.00 175.10 176.64 1xmn n GLU 164 N 1.47 2.12 -0.26 2.72 4.71 -1.26 -4.59 120.64 125.56 1xmn n GLU 164 Ca -0.15 0.75 0.06 0.00 -0.01 0.00 0.00 57.16 57.81 1xmn n GLU 164 Cb 0.52 -2.41 0.20 0.00 -1.01 0.00 0.00 31.44 28.74 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 3.96 0.37 -0.86 3.49 2.43 -1.98 -0.69 114.38 121.10 1xmn h ARG 165 Ca -0.45 -0.02 0.10 0.00 -0.81 0.00 0.00 59.98 58.80 1xmn h ARG 165 Cb 1.27 -0.08 -0.08 0.00 -0.42 0.00 0.00 29.97 30.66 1xmn h ARG 165 CO 0.74 0.24 0.50 -1.35 -1.51 0.00 0.00 179.97 178.59 1xmn h PRO 166 N 0.38 0.79 -0.28 0.20 0.11 -2.00 0.11 132.00 131.32 1xmn h PRO 166 Ca 0.43 -0.05 -0.15 0.00 0.11 0.00 0.00 66.00 66.35 1xmn h PRO 166 Cb 0.70 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.62 1xmn h PRO 166 CO -0.45 0.52 -0.42 0.28 -0.21 0.00 0.00 178.00 177.73 1xmn h VAL 167 N 0.82 1.29 -0.23 3.15 2.07 -1.53 -1.99 116.25 119.82 1xmn h VAL 167 Ca 0.42 -1.59 -0.01 0.00 0.82 0.00 0.00 66.70 66.34 1xmn h VAL 167 Cb 0.42 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 1xmn h VAL 167 CO -0.26 0.51 0.10 0.00 0.02 0.00 0.00 177.57 177.94 1xmn h LYS 169 N 0.23 0.36 0.00 0.00 3.64 -0.75 -2.69 116.57 117.35 1xmn h LYS 169 Ca 0.08 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1xmn h LYS 169 Cb 0.16 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 1xmn h LYS 169 CO -0.01 0.26 0.00 -0.25 -2.27 0.00 0.00 179.45 177.18 1xmn n ASP 170 N -4.89 0.45 0.05 4.20 10.43 -0.76 -3.07 116.55 122.97 1xmn n ASP 170 Ca -0.02 0.59 0.13 0.00 2.57 0.00 0.00 54.79 58.07 1xmn n ASP 170 Cb 0.04 -0.69 0.45 0.00 1.84 0.00 0.00 41.12 42.76 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 -1.98 0.44 -3.89 -2.24 3.41 -0.82 -4.89 113.62 103.66 1xmn n SER 171 Ca 0.03 0.42 -0.10 0.00 -0.26 0.00 0.00 58.87 58.96 1xmn n SER 171 Cb 0.25 -0.48 -0.09 0.00 -0.26 0.00 0.00 64.21 63.63 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 -3.06 0.12 -0.51 6.66 -1.32 -1.17 -4.83 115.64 111.53 1xmn s THR 172 Ca 0.12 -0.98 0.24 0.00 -1.21 0.00 0.00 61.69 59.86 1xmn s THR 172 Cb 0.16 -0.87 0.18 0.00 -1.51 0.00 0.00 72.50 70.46 1xmn s THR 172 CO 0.59 -0.54 1.45 0.03 -2.21 0.00 0.00 174.62 173.94 1xmn h ARG 173 N 3.62 0.00 -6.65 7.08 3.08 -1.90 -3.46 114.38 116.15 1xmn h ARG 173 Ca -0.32 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.20 1xmn h ARG 173 Cb 1.19 0.00 0.03 0.00 0.08 0.00 0.00 29.97 31.27 1xmn h ARG 173 CO 0.49 0.00 0.69 0.42 -1.07 0.00 0.00 179.97 180.50 1xmn s ILE 174 N -3.21 3.15 -0.02 2.04 1.01 -1.26 -4.95 121.20 117.97 1xmn s ILE 174 Ca 0.06 0.91 -0.30 0.00 0.00 0.00 0.00 60.65 61.32 1xmn s ILE 174 Cb 0.10 -3.58 -0.06 0.00 0.01 0.00 0.00 42.46 38.93 1xmn s ILE 174 CO 0.69 0.12 1.57 -0.60 0.00 0.00 0.00 174.94 176.72 1xmn s ARG 175 N 0.19 4.21 0.25 2.79 3.52 -1.26 -5.01 118.95 123.65 1xmn s ARG 175 Ca 0.59 2.14 0.06 0.00 -0.13 0.00 0.00 55.73 58.39 1xmn s ARG 175 Cb -0.37 -3.77 -0.03 0.00 -1.56 0.00 0.00 34.95 29.22 1xmn s ARG 175 CO 0.37 -0.74 0.31 0.96 -0.81 0.00 0.00 175.30 175.39 1xmn s ILE 176 N 3.23 4.88 0.35 4.11 -4.36 -1.26 -4.79 121.20 123.36 1xmn s ILE 176 Ca 0.70 -1.14 0.03 0.00 -0.26 0.00 0.00 60.65 59.98 1xmn s ILE 176 Cb -0.34 -3.67 -0.04 0.00 1.25 0.00 0.00 42.46 39.67 1xmn s ILE 176 CO 0.29 -0.32 0.11 0.42 0.24 0.00 0.00 174.94 175.67 1xmn s THR 177 N -2.05 0.73 -1.25 8.37 -4.23 -1.26 -5.02 115.64 110.93 1xmn s THR 177 Ca 0.34 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 59.04 1xmn s THR 177 Cb -0.09 -2.54 0.25 0.00 1.34 0.00 0.00 72.50 71.47 1xmn s THR 177 CO 0.28 0.00 1.57 0.47 -0.54 0.00 0.00 174.62 176.40 1xmn n ASP 178 N -0.97 0.00 -0.44 3.99 8.00 -1.26 -2.48 116.55 123.39 1xmn n ASP 178 Ca -0.03 0.22 0.03 0.00 0.71 0.00 0.00 54.79 55.72 1xmn n ASP 178 Cb 0.66 -0.37 0.09 0.00 -0.02 0.00 0.00 41.12 41.47 1xmn n ASP 178 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1xmn n ASN 179 N -1.37 1.22 -3.86 -2.24 3.02 -1.26 -4.82 115.26 105.94 1xmn n ASN 179 Ca 0.07 -2.04 -0.09 0.00 -0.03 0.00 0.00 54.58 52.49 1xmn n ASN 179 Cb 0.17 -0.20 -0.07 0.00 -0.61 0.00 0.00 39.78 39.07 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 -1.70 0.82 0.10 3.52 0.23 -1.04 -0.51 119.30 120.73 1xmn s MET 180 Ca 0.13 -0.92 -0.07 0.00 -1.03 0.00 0.00 55.69 53.81 1xmn s MET 180 Cb 0.07 0.33 -0.01 0.00 -1.53 0.00 0.00 34.83 33.69 1xmn s MET 180 CO 0.08 -0.25 0.16 -0.59 -2.03 0.00 0.00 175.02 172.38 1xmn s PHE 181 N -3.68 0.34 0.17 3.16 -0.12 -0.45 -4.81 117.98 112.59 1xmn s PHE 181 Ca 0.04 -0.77 0.10 0.00 -0.05 0.00 0.00 56.93 56.24 1xmn s PHE 181 Cb 0.04 -0.16 -0.04 0.00 -0.63 0.00 0.00 43.02 42.23 1xmn s PHE 181 CO -0.10 -0.55 -0.21 0.00 -0.05 0.00 0.00 175.22 174.31 1xmn s ALA 183 N -1.80 0.02 0.00 0.00 0.00 -0.48 -1.29 121.76 118.21 1xmn s ALA 183 Ca 0.17 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1xmn s ALA 183 Cb -0.07 0.24 0.00 0.00 0.00 0.00 0.00 23.12 23.29 1xmn s ALA 183 CO 0.08 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 175.94 1xmn n GLY 184 N 0.80 3.54 3.83 0.00 0.00 0.00 -2.16 105.19 111.20 1xmn n GLY 184 Ca -0.19 -1.47 -0.33 0.00 0.00 0.00 0.00 46.02 44.02 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 3.42 0.57 1.61 2.02 -1.26 -4.50 117.35 117.20 1xmn s TYR 184 Ca 0.00 1.40 -0.11 0.00 -0.37 0.00 0.00 57.07 57.99 1xmn s TYR 184 Cb 0.00 -2.67 -0.05 0.00 -0.40 0.00 0.00 41.96 38.84 1xmn s TYR 184 CO 0.00 0.08 0.97 0.15 -1.57 0.00 0.00 175.55 175.18 1xmn s LYS 185 N -2.82 3.66 0.28 -0.62 1.02 -1.26 -4.83 119.74 115.16 1xmn s LYS 185 Ca 0.55 0.68 -0.05 0.00 0.02 0.00 0.00 55.97 57.16 1xmn s LYS 185 Cb -0.11 -2.15 0.52 0.00 -0.52 0.00 0.00 37.83 35.57 1xmn s LYS 185 CO 0.17 -0.43 1.52 -2.30 -0.92 0.00 0.00 175.35 173.39 1xmn n PRO 186 N -2.40 -0.08 -0.24 -1.68 -0.02 -1.26 -1.45 135.00 127.86 1xmn n PRO 186 Ca 0.05 1.50 0.11 0.00 -2.02 0.00 0.00 63.50 63.14 1xmn n PRO 186 Cb 0.54 -2.28 0.26 0.00 -0.02 0.00 0.00 33.50 32.01 1xmn n PRO 186 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1xmn n ASP 186 N -5.55 3.39 0.04 2.55 9.92 -1.26 -4.21 116.55 121.43 1xmn n ASP 186 Ca 0.17 -1.98 0.09 0.00 -0.53 0.00 0.00 54.79 52.55 1xmn n ASP 186 Cb 0.55 -0.32 0.39 0.00 -0.64 0.00 0.00 41.12 41.10 1xmn n ASP 186 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1xmn n GLU 186 N 1.40 0.06 0.00 -1.24 1.02 -0.53 -4.93 120.64 116.42 1xmn n GLU 186 Ca 0.21 0.27 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 1xmn n GLU 186 Cb 0.57 -1.61 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 1xmn n GLU 186 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xmn n GLY 186 N 0.20 2.08 3.42 0.62 0.00 -1.26 -5.00 105.19 105.25 1xmn n GLY 186 Ca 0.04 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.32 1xmn n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xmn n LYS 186 N 0.00 -0.43 -2.46 1.61 5.02 -1.26 -5.05 118.16 115.60 1xmn n LYS 186 Ca 0.00 -0.08 -0.05 0.00 -2.02 0.00 0.00 58.31 56.16 1xmn n LYS 186 Cb 0.00 -1.88 -0.01 0.00 -0.02 0.00 0.00 35.03 33.11 1xmn n LYS 186 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1xmn n ARG 187 N -1.95 0.67 0.00 1.97 1.74 -1.26 -4.74 116.66 113.09 1xmn n ARG 187 Ca 0.07 -0.66 0.00 0.00 -0.77 0.00 0.00 57.85 56.48 1xmn n ARG 187 Cb 0.54 0.41 0.00 0.00 -1.02 0.00 0.00 32.46 32.39 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 1.27 3.89 0.00 -0.13 0.00 -1.26 -4.90 105.19 104.05 1xmn n GLY 188 Ca -0.00 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1xmn n GLY 188 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xmn n ASP 189 N 0.00 0.00 -4.48 1.61 2.03 -1.01 -4.65 116.55 110.05 1xmn n ASP 189 Ca 0.00 0.00 -0.26 0.00 0.52 0.00 0.00 54.79 55.05 1xmn n ASP 189 Cb 0.00 0.00 0.14 0.00 -0.72 0.00 0.00 41.12 40.54 1xmn n ASP 189 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xmn s ALA 190 N -2.00 3.14 0.37 -1.67 0.00 -1.26 -0.24 121.76 120.10 1xmn s ALA 190 Ca 0.00 -1.52 -0.12 0.00 0.00 0.00 0.00 51.96 50.32 1xmn s ALA 190 Cb 0.00 -2.31 0.04 0.00 0.00 0.00 0.00 23.12 20.85 1xmn s ALA 190 CO 0.00 -1.83 0.71 0.00 0.00 0.00 0.00 175.76 174.64 1xmn n GLU 192 N -0.54 1.94 0.00 0.00 4.71 -1.26 -1.07 120.64 124.42 1xmn n GLU 192 Ca -0.06 0.69 0.00 0.00 -0.01 0.00 0.00 57.16 57.78 1xmn n GLU 192 Cb 0.60 -2.30 0.00 0.00 -1.01 0.00 0.00 31.44 28.74 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 1.77 3.44 0.02 0.62 0.00 -1.26 -1.84 105.19 107.93 1xmn n GLY 193 Ca 0.10 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.25 1xmn n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1xmn n ASP 194 N 0.00 0.43 -4.68 1.61 8.00 -0.24 -3.99 116.55 117.69 1xmn n ASP 194 Ca 0.00 0.03 -0.41 0.00 0.71 0.00 0.00 54.79 55.13 1xmn n ASP 194 Cb 0.00 0.01 0.01 0.00 -0.02 0.00 0.00 41.12 41.13 1xmn n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1xmn n SER 195 N -1.65 2.14 0.00 -2.24 7.64 -1.26 -1.63 113.62 116.62 1xmn n SER 195 Ca 0.05 1.07 0.00 0.00 1.01 0.00 0.00 58.87 61.01 1xmn n SER 195 Cb 0.36 -1.46 0.00 0.00 -1.01 0.00 0.00 64.21 62.10 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 0.93 3.22 3.76 0.23 0.00 -0.17 0.64 105.19 113.80 1xmn n GLY 196 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.12 1.93 0.35 -0.02 0.00 -0.65 -2.87 107.32 103.95 1xmn s GLY 197 Ca 0.00 0.47 -0.11 0.00 0.00 0.00 0.00 44.72 45.08 1xmn s GLY 197 CO 0.00 0.83 0.71 2.56 0.00 0.00 0.00 173.10 177.20 1xmn s PRO 198 N -4.46 3.83 -0.31 2.90 0.04 -1.26 -0.84 135.00 134.90 1xmn s PRO 198 Ca 0.65 0.45 -0.01 0.00 0.04 0.00 0.00 61.00 62.13 1xmn s PRO 198 Cb -0.20 -2.46 0.06 0.00 0.04 0.00 0.00 34.50 31.93 1xmn s PRO 198 CO 0.49 0.09 0.01 0.12 0.04 0.00 0.00 177.00 177.75 1xmn s PHE 199 N -2.16 3.32 0.23 0.56 2.19 -0.63 -3.56 117.98 117.94 1xmn s PHE 199 Ca 0.51 -2.05 0.09 0.00 0.33 0.00 0.00 56.93 55.81 1xmn s PHE 199 Cb -0.10 -2.24 -0.04 0.00 -1.31 0.00 0.00 43.02 39.33 1xmn s PHE 199 CO 0.26 -0.84 -0.05 0.14 1.83 0.00 0.00 175.22 176.56 1xmn s VAL 200 N 1.20 3.29 0.00 3.12 -7.23 0.15 -1.13 120.40 119.81 1xmn s VAL 200 Ca -0.04 -1.85 0.01 0.00 -1.81 0.00 0.00 61.98 58.29 1xmn s VAL 200 Cb -0.20 -2.71 -0.00 0.00 0.56 0.00 0.00 36.38 34.03 1xmn s VAL 200 CO -0.02 -0.27 -0.02 -0.04 -0.31 0.00 0.00 175.10 174.43 1xmn s MET 201 N -3.34 0.17 -0.31 4.82 -1.94 -0.08 0.57 119.30 119.19 1xmn s MET 201 Ca 0.29 -0.13 -0.15 0.00 -1.71 0.00 0.00 55.69 53.99 1xmn s MET 201 Cb -0.07 -0.12 -0.02 0.00 2.01 0.00 0.00 34.83 36.62 1xmn s MET 201 CO 0.18 0.03 0.38 0.21 -0.01 0.00 0.00 175.02 175.81 1xmn s LYS 202 N -0.21 3.81 -0.02 2.03 2.20 -1.26 -0.52 119.74 125.76 1xmn s LYS 202 Ca -0.01 -0.16 -0.30 0.00 -0.36 0.00 0.00 55.97 55.14 1xmn s LYS 202 Cb -0.02 -3.73 -0.06 0.00 -1.51 0.00 0.00 37.83 32.51 1xmn s LYS 202 CO -0.00 -0.40 1.65 0.45 -0.36 0.00 0.00 175.35 176.68 1xmn s SER 203 N 1.69 6.66 0.00 1.43 0.15 -0.23 -4.86 113.70 118.55 1xmn s SER 203 Ca 0.14 2.29 0.27 0.00 0.70 0.00 0.00 55.95 59.35 1xmn s SER 203 Cb -0.16 -2.54 1.58 0.00 -1.71 0.00 0.00 66.02 63.19 1xmn s SER 203 CO 0.11 -0.91 1.96 -0.81 1.20 0.00 0.00 173.24 174.79 1xmn n PRO 204 N 6.72 0.78 -0.05 5.44 -0.04 -1.26 -0.82 135.00 145.77 1xmn n PRO 204 Ca 0.17 0.01 -0.13 0.00 -0.04 0.00 0.00 63.50 63.50 1xmn n PRO 204 Cb 0.42 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.24 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 -1.04 0.70 -0.77 0.54 3.72 -1.26 -4.66 117.46 114.69 1xmn n PHE 204 Ca 0.19 0.21 0.00 0.00 -0.05 0.00 0.00 57.45 57.80 1xmn n PHE 204 Cb 0.11 -1.11 0.00 0.00 -0.94 0.00 0.00 39.48 37.54 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 -3.12 0.43 -0.11 4.37 2.04 -1.20 -5.02 115.26 112.65 1xmn n ASN 204 Ca -0.28 -1.20 -0.01 0.00 -0.44 0.00 0.00 54.58 52.64 1xmn n ASN 204 Cb 1.07 0.00 -0.01 0.00 -2.53 0.00 0.00 39.78 38.31 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 -0.10 -5.14 -4.91 0.53 5.15 0.00 -4.99 115.26 105.80 1xmn n ASN 205 Ca 0.00 0.03 -0.31 0.00 -0.60 0.00 0.00 54.58 53.70 1xmn n ASN 205 Cb 0.42 -2.76 -0.04 0.00 -0.53 0.00 0.00 39.78 36.86 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 -1.62 3.53 -0.04 1.20 0.52 -1.25 -4.81 118.95 116.48 1xmn s ARG 206 Ca 0.00 -0.26 -0.20 0.00 -0.52 0.00 0.00 55.73 54.75 1xmn s ARG 206 Cb 0.00 -2.94 -0.05 0.00 0.52 0.00 0.00 34.95 32.48 1xmn s ARG 206 CO 0.00 0.54 0.58 -1.58 0.02 0.00 0.00 175.30 174.86 1xmn s TRP 207 N -1.58 3.63 -0.04 -0.53 0.52 -1.26 -1.06 118.94 118.61 1xmn s TRP 207 Ca 0.38 1.13 0.07 0.00 0.02 0.00 0.00 56.10 57.70 1xmn s TRP 207 Cb -0.13 -2.62 -0.01 0.00 -1.15 0.00 0.00 33.47 29.56 1xmn s TRP 207 CO 0.26 0.27 -0.25 0.71 0.02 0.00 0.00 176.95 177.96 1xmn s TYR 208 N 0.15 2.32 -0.52 -1.98 2.02 0.32 -2.42 117.35 117.24 1xmn s TYR 208 Ca 0.31 -0.56 -0.21 0.00 -0.37 0.00 0.00 57.07 56.23 1xmn s TYR 208 Cb -0.17 -1.51 0.05 0.00 -0.40 0.00 0.00 41.96 39.93 1xmn s TYR 208 CO 0.16 -0.12 0.76 -1.14 -1.57 0.00 0.00 175.55 173.64 1xmn s GLN 209 N -0.37 3.22 0.11 -0.62 0.74 -0.16 -0.90 119.66 121.69 1xmn s GLN 209 Ca 0.03 -0.58 0.19 0.00 0.05 0.00 0.00 55.36 55.05 1xmn s GLN 209 Cb -0.12 -4.07 -0.09 0.00 1.10 0.00 0.00 33.01 29.84 1xmn s GLN 209 CO 0.01 -1.32 0.90 -1.33 -0.55 0.00 0.00 175.29 173.00 1xmn n MET 210 N 6.73 0.62 -4.09 1.67 2.81 -0.29 -4.31 117.12 120.26 1xmn n MET 210 Ca -0.03 0.17 -0.12 0.00 -1.81 0.00 0.00 57.70 55.91 1xmn n MET 210 Cb 0.46 -1.81 -0.06 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 -4.62 1.17 -0.08 3.03 0.00 -0.98 -1.93 107.32 103.92 1xmn s GLY 211 Ca -0.02 -1.36 0.01 0.00 0.00 0.00 0.00 44.72 43.35 1xmn s GLY 211 CO 0.81 -0.98 -0.08 -0.42 0.00 0.00 0.00 173.10 172.42 1xmn s ILE 212 N -3.69 0.93 -0.16 0.90 1.01 -0.96 -1.60 121.20 117.63 1xmn s ILE 212 Ca 0.30 -0.31 -0.36 0.00 0.00 0.00 0.00 60.65 60.28 1xmn s ILE 212 Cb 0.01 -0.91 -0.13 0.00 0.01 0.00 0.00 42.46 41.44 1xmn s ILE 212 CO 0.15 0.33 1.85 0.52 0.00 0.00 0.00 174.94 177.78 1xmn n VAL 213 N 4.31 0.50 0.02 2.92 0.31 -0.02 -0.78 118.33 125.59 1xmn n VAL 213 Ca -0.19 -0.09 -0.02 0.00 -0.01 0.00 0.00 64.34 64.03 1xmn n VAL 213 Cb 0.51 -1.67 -0.01 0.00 -0.91 0.00 0.00 33.84 31.76 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 6.34 1.22 -3.13 4.52 2.88 -0.70 -0.99 113.62 123.75 1xmn n SER 214 Ca 0.24 0.17 -0.10 0.00 -1.33 0.00 0.00 58.87 57.85 1xmn n SER 214 Cb 0.24 -0.41 0.00 0.00 -0.75 0.00 0.00 64.21 63.30 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 -2.13 0.28 0.05 0.66 1.48 -0.96 -4.92 118.94 113.41 1xmn s TRP 215 Ca -0.06 -0.83 -0.26 0.00 -1.06 0.00 0.00 56.10 53.88 1xmn s TRP 215 Cb 0.01 0.62 0.09 0.00 -1.16 0.00 0.00 33.47 33.03 1xmn s TRP 215 CO 0.09 -1.43 1.20 0.20 -4.06 0.00 0.00 176.95 172.95 1xmn s GLY 216 N -3.08 -0.04 -0.30 3.67 0.00 -1.26 -0.33 107.32 105.98 1xmn s GLY 216 Ca 0.18 -0.10 0.01 0.00 0.00 0.00 0.00 44.72 44.81 1xmn s GLY 216 CO 0.13 4.62 0.06 -0.54 0.00 0.00 0.00 173.10 177.37 1xmn s GLU 217 N -2.05 1.10 1.40 2.90 2.02 -1.26 -5.02 118.70 117.79 1xmn s GLU 217 Ca 0.27 -1.30 0.00 0.00 0.02 0.00 0.00 54.97 53.96 1xmn s GLU 217 Cb -0.01 -2.48 0.00 0.00 0.10 0.00 0.00 34.13 31.74 1xmn s GLU 217 CO 0.01 -0.90 0.00 0.41 0.02 0.00 0.00 175.26 174.81 1xmn n GLY 219 N 4.63 -1.80 2.78 -1.39 0.00 -1.26 -4.81 105.19 103.35 1xmn n GLY 219 Ca -0.02 -1.36 -0.17 0.00 0.00 0.00 0.00 46.02 44.48 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 4.74 -6.14 -4.79 0.00 2.03 -1.26 -4.40 116.55 106.72 1xmn n ASP 221 Ca -0.16 -0.44 -0.38 0.00 0.52 0.00 0.00 54.79 54.33 1xmn n ASP 221 Cb 0.50 -4.89 -0.06 0.00 -0.72 0.00 0.00 41.12 35.95 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 -6.05 4.17 0.29 -0.67 0.52 -1.26 -4.92 118.95 111.02 1xmn s ARG 221 Ca 0.46 0.58 -0.30 0.00 -0.52 0.00 0.00 55.73 55.96 1xmn s ARG 221 Cb -0.21 -3.29 -0.12 0.00 0.52 0.00 0.00 34.95 31.85 1xmn s ARG 221 CO 0.57 0.51 1.45 -0.25 0.02 0.00 0.00 175.30 177.60 1xmn n ASP 222 N 2.32 3.19 0.00 0.23 8.00 -1.26 -1.41 116.55 127.62 1xmn n ASP 222 Ca -0.10 1.17 0.00 0.00 0.71 0.00 0.00 54.79 56.56 1xmn n ASP 222 Cb 0.51 -1.51 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 1.71 3.09 3.82 0.44 0.00 -1.26 -5.02 105.19 107.96 1xmn n GLY 223 Ca 0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.62 2.96 0.02 1.61 -0.14 -0.50 -4.78 119.74 118.29 1xmn s LYS 224 Ca 0.00 -0.86 0.01 0.00 -1.36 0.00 0.00 55.97 53.76 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 0.48 -0.04 0.71 -0.76 0.00 0.00 175.35 175.73 1xmn s TYR 225 N -1.80 0.38 0.34 3.18 1.51 -1.26 -4.71 117.35 114.99 1xmn s TYR 225 Ca 0.32 -0.29 -0.28 0.00 -1.01 0.00 0.00 57.07 55.81 1xmn s TYR 225 Cb -0.10 -0.24 -0.09 0.00 -0.11 0.00 0.00 41.96 41.42 1xmn s TYR 225 CO 0.24 -0.07 1.18 0.20 -1.11 0.00 0.00 175.55 175.99 1xmn s GLY 226 N -0.82 2.97 -0.06 0.71 0.00 -0.92 -4.76 107.32 104.43 1xmn s GLY 226 Ca -0.06 1.01 -0.01 0.00 0.00 0.00 0.00 44.72 45.66 1xmn s GLY 226 CO -0.00 1.59 0.02 -1.36 0.00 0.00 0.00 173.10 173.35 1xmn s PHE 227 N -1.26 3.18 0.05 1.90 0.40 0.56 -1.39 117.98 121.41 1xmn s PHE 227 Ca 0.51 0.19 0.05 0.00 -0.60 0.00 0.00 56.93 57.07 1xmn s PHE 227 Cb -0.33 -1.76 -0.02 0.00 0.51 0.00 0.00 43.02 41.41 1xmn s PHE 227 CO 0.43 0.49 -0.14 0.71 0.70 0.00 0.00 175.22 177.41 1xmn s TYR 228 N -0.97 1.25 0.15 0.36 1.51 0.60 -1.72 117.35 118.53 1xmn s TYR 228 Ca 0.16 -0.38 -0.31 0.00 -1.01 0.00 0.00 57.07 55.53 1xmn s TYR 228 Cb -0.11 -0.73 -0.08 0.00 -0.11 0.00 0.00 41.96 40.93 1xmn s TYR 228 CO 0.05 0.05 1.34 0.99 -1.11 0.00 0.00 175.55 176.87 1xmn s THR 229 N -0.97 3.30 -0.86 -0.71 2.01 0.04 -1.35 115.64 117.11 1xmn s THR 229 Ca 0.01 1.00 -0.25 0.00 0.31 0.00 0.00 61.69 62.75 1xmn s THR 229 Cb -0.08 -3.64 0.03 0.00 0.01 0.00 0.00 72.50 68.82 1xmn s THR 229 CO 0.02 0.11 1.43 -2.28 -0.69 0.00 0.00 174.62 173.21 1xmn s HIS 230 N 0.59 2.31 0.11 4.92 2.46 0.33 -2.27 115.29 123.75 1xmn s HIS 230 Ca 0.60 -0.28 -0.21 0.00 0.47 0.00 0.00 55.06 55.64 1xmn s HIS 230 Cb -0.36 -4.59 -0.07 0.00 -0.13 0.00 0.00 32.58 27.43 1xmn s HIS 230 CO 0.34 -2.02 1.72 0.28 -2.47 0.00 0.00 174.74 172.59 1xmn h VAL 231 N 6.48 0.87 -0.81 0.89 2.07 -1.70 -2.90 116.25 121.15 1xmn h VAL 231 Ca -0.06 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.51 1xmn h VAL 231 Cb 1.04 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 31.62 1xmn h VAL 231 CO 1.33 0.00 0.50 0.15 0.02 0.00 0.00 177.57 179.57 1xmn h PHE 232 N -0.00 0.93 0.00 1.57 3.57 -1.86 -1.06 116.94 120.09 1xmn h PHE 232 Ca 0.06 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.58 1xmn h PHE 232 Cb 0.10 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 38.53 1xmn h PHE 232 CO -0.17 0.50 -0.05 0.00 -2.23 0.00 0.00 178.31 176.36 1xmn h ARG 233 N 0.94 0.00 -0.47 1.11 3.08 -1.89 -1.90 114.38 115.25 1xmn h ARG 233 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 1xmn h ARG 233 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 1xmn h ARG 233 CO -0.15 0.05 0.00 1.28 -1.07 0.00 0.00 179.97 180.08 1xmn n LEU 234 N -3.55 3.34 0.22 3.04 4.77 -0.53 -4.58 117.00 119.71 1xmn n LEU 234 Ca -0.02 -2.06 0.05 0.00 -0.03 0.00 0.00 56.01 53.95 1xmn n LEU 234 Cb 0.16 -0.33 0.50 0.00 -2.33 0.00 0.00 43.42 41.41 1xmn n LEU 234 CO 0.27 0.81 0.89 0.50 -1.33 0.00 0.00 177.39 178.52 1xmn h LYS 235 N 2.74 0.00 -0.74 3.23 3.64 -0.39 -2.20 116.57 122.85 1xmn h LYS 235 Ca 0.00 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1xmn h LYS 235 Cb 0.86 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.65 1xmn h LYS 235 CO 0.02 0.20 0.49 -0.22 -2.27 0.00 0.00 179.45 177.66 1xmn h LYS 236 N 0.00 0.96 -0.30 1.90 3.64 -1.81 -0.71 116.57 120.25 1xmn h LYS 236 Ca -0.00 -0.06 -0.09 0.00 -1.27 0.00 0.00 60.65 59.23 1xmn h LYS 236 Cb 0.35 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1xmn h LYS 236 CO 0.03 0.63 -0.17 2.35 -2.27 0.00 0.00 179.45 180.02 1xmn h TRP 237 N 0.99 0.75 -0.30 1.91 7.01 -1.76 -2.03 115.95 122.51 1xmn h TRP 237 Ca 0.27 -0.19 0.04 0.00 2.11 0.00 0.00 58.89 61.12 1xmn h TRP 237 Cb -0.10 -0.17 -0.04 0.00 -2.10 0.00 0.00 29.16 26.76 1xmn h TRP 237 CO -0.02 0.89 0.08 0.82 -2.79 0.00 0.00 178.44 177.41 1xmn h ILE 238 N 0.40 0.88 -0.56 2.65 2.04 -1.05 -1.48 117.51 120.39 1xmn h ILE 238 Ca 0.07 -0.07 -0.06 0.00 1.00 0.00 0.00 64.86 65.80 1xmn h ILE 238 Cb 0.70 0.67 -0.03 0.00 -0.74 0.00 0.00 36.82 37.42 1xmn h ILE 238 CO 0.05 0.04 0.11 1.56 0.00 0.00 0.00 178.15 179.90 1xmn h GLN 239 N 0.20 0.89 -0.22 2.37 4.20 -1.11 -2.15 115.11 119.28 1xmn h GLN 239 Ca 0.14 -0.20 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 1xmn h GLN 239 Cb 0.13 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 1xmn h GLN 239 CO -0.17 0.81 0.10 -0.22 -0.67 0.00 0.00 178.83 178.69 1xmn h LYS 240 N 0.85 0.32 -0.01 1.46 3.64 -0.89 -0.79 116.57 121.14 1xmn h LYS 240 Ca 0.18 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1xmn h LYS 240 Cb 0.35 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1xmn h LYS 240 CO 0.00 0.34 0.00 0.28 -2.27 0.00 0.00 179.45 177.81 1xmn h VAL 241 N 0.22 1.02 -0.88 2.00 2.07 -1.12 0.32 116.25 119.89 1xmn h VAL 241 Ca 0.08 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 1xmn h VAL 241 Cb 0.13 1.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 1xmn h VAL 241 CO -0.01 0.01 0.53 0.40 0.02 0.00 0.00 177.57 178.52 1xmn h ILE 242 N -0.01 1.25 -0.13 4.57 2.04 -1.31 0.13 117.51 124.04 1xmn h ILE 242 Ca 0.00 -0.54 -0.07 0.00 1.00 0.00 0.00 64.86 65.25 1xmn h ILE 242 Cb 0.02 0.01 -0.00 0.00 -0.74 0.00 0.00 36.82 36.11 1xmn h ILE 242 CO -0.00 0.26 -0.18 0.44 0.00 0.00 0.00 178.15 178.67 1xmn h ASP 243 N 1.21 0.39 -0.01 1.72 3.32 -0.99 0.24 116.42 122.30 1xmn h ASP 243 Ca 0.32 -0.52 -0.10 0.00 0.02 0.00 0.00 57.03 56.75 1xmn h ASP 243 Cb -0.04 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1xmn h ASP 243 CO -0.06 0.83 -0.28 1.56 -1.72 0.00 0.00 179.24 179.57 1xmn h GLN 244 N -0.05 0.45 0.00 3.56 4.20 -0.77 -3.33 115.11 119.17 1xmn h GLN 244 Ca 0.01 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.55 1xmn h GLN 244 Cb 0.74 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.50 1xmn h GLN 244 CO 0.04 0.69 -0.02 1.19 -0.67 0.00 0.00 178.83 180.07 1xmn n PHE 245 N -4.10 0.00 0.00 2.96 3.01 0.02 -4.87 117.46 114.48 1xmn n PHE 245 Ca -0.01 -0.61 0.00 0.00 1.01 0.00 0.00 57.45 57.84 1xmn n PHE 245 Cb 0.42 -0.08 0.00 0.00 -0.01 0.00 0.00 39.48 39.81 1xmn n PHE 245 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1xmn n GLY 246 N -0.75 -1.42 0.00 1.37 0.00 0.85 -4.98 105.19 100.25 1xmn n GLY 246 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1xmn n GLY 246 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50