#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xpn s SER 2 N 0.00 0.02 0.18 1.61 0.01 -1.26 -5.18 113.70 109.08 1xpn s SER 2 Ca 0.00 -0.50 0.10 0.00 1.31 0.00 0.00 55.95 56.86 1xpn s SER 2 Cb 0.00 0.36 -0.04 0.00 0.21 0.00 0.00 66.02 66.55 1xpn s SER 2 CO 0.00 -0.72 -0.21 -0.55 0.41 0.00 0.00 173.24 172.17 1xpn s SER 3 N -2.66 3.06 -0.12 2.44 0.15 -1.26 -5.14 113.70 110.16 1xpn s SER 3 Ca 0.02 -0.85 -0.05 0.00 0.70 0.00 0.00 55.95 55.77 1xpn s SER 3 Cb 0.03 -0.21 0.06 0.00 -1.71 0.00 0.00 66.02 64.20 1xpn s SER 3 CO -0.09 0.05 0.26 -1.38 1.20 0.00 0.00 173.24 173.27 1xpn s HIS 4 N -1.80 -0.40 -0.32 3.44 0.00 -1.26 -5.11 115.29 109.83 1xpn s HIS 4 Ca 0.18 0.93 0.02 0.00 -3.00 0.00 0.00 55.06 53.19 1xpn s HIS 4 Cb -0.07 -0.04 0.10 0.00 -4.00 0.00 0.00 32.58 28.57 1xpn s HIS 4 CO 0.08 -0.34 0.07 -1.01 -1.00 0.00 0.00 174.74 172.55 1xpn s HIS 5 N 2.28 2.73 -0.49 0.38 4.02 -1.26 -5.07 115.29 117.88 1xpn s HIS 5 Ca 0.00 -2.36 -0.08 0.00 1.02 0.00 0.00 55.06 53.64 1xpn s HIS 5 Cb -0.12 -2.31 0.13 0.00 -1.02 0.00 0.00 32.58 29.26 1xpn s HIS 5 CO -0.08 -0.91 0.34 -1.01 1.02 0.00 0.00 174.74 174.10 1xpn s HIS 6 N 1.26 3.47 -0.28 1.40 3.76 -1.26 -4.86 115.29 118.79 1xpn s HIS 6 Ca 0.10 -2.07 -0.02 0.00 -0.15 0.00 0.00 55.06 52.92 1xpn s HIS 6 Cb -0.18 -3.43 0.01 0.00 1.11 0.00 0.00 32.58 30.08 1xpn s HIS 6 CO -0.17 -0.98 0.04 1.58 -0.85 0.00 0.00 174.74 174.37 1xpn n HIS 7 N 4.68 -3.99 -4.25 1.40 -0.00 -1.26 -5.06 115.22 106.74 1xpn n HIS 7 Ca -0.04 1.87 -0.24 0.00 0.46 0.00 0.00 57.72 59.77 1xpn n HIS 7 Cb 0.41 -3.94 -0.07 0.00 -0.12 0.00 0.00 29.99 26.26 1xpn n HIS 7 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 1xpn s HIS 8 N -1.43 2.63 0.00 1.57 4.02 -1.26 -5.01 115.29 115.81 1xpn s HIS 8 Ca -0.05 -0.36 -0.02 0.00 1.02 0.00 0.00 55.06 55.64 1xpn s HIS 8 Cb 0.00 -1.46 -0.10 0.00 -1.02 0.00 0.00 32.58 30.00 1xpn s HIS 8 CO 0.77 0.47 2.39 1.58 1.02 0.00 0.00 174.74 180.96 1xpn n HIS 9 N -1.00 0.00 1.00 1.40 -0.00 -1.26 -3.67 115.22 111.69 1xpn n HIS 9 Ca -0.04 -1.07 0.10 0.00 -0.00 0.00 0.00 57.72 56.71 1xpn n HIS 9 Cb 0.61 -0.88 -0.08 0.00 -0.00 0.00 0.00 29.99 29.64 1xpn n HIS 9 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.34 176.79 1xpn n SER 10 N 1.97 0.99 0.02 0.26 2.88 -1.26 -4.29 113.62 114.19 1xpn n SER 10 Ca 0.16 -0.95 -0.21 0.00 -1.33 0.00 0.00 58.87 56.53 1xpn n SER 10 Cb 0.60 0.92 -0.14 0.00 -0.75 0.00 0.00 64.21 64.83 1xpn n SER 10 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1xpn h SER 11 N 0.09 0.39 0.00 -3.46 4.64 -1.89 -3.49 113.55 109.83 1xpn h SER 11 Ca 0.00 -0.88 0.00 0.00 -0.47 0.00 0.00 61.79 60.44 1xpn h SER 11 Cb 0.51 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1xpn h SER 11 CO 0.00 1.52 0.00 0.61 -0.87 0.00 0.00 176.83 178.09 1xpn n GLY 12 N 1.70 3.43 0.84 -0.77 0.00 -1.26 -2.02 105.19 107.11 1xpn n GLY 12 Ca -0.21 -0.11 0.08 0.00 0.00 0.00 0.00 46.02 45.78 1xpn n GLY 12 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1xpn n LEU 13 N 0.00 3.09 -3.47 0.99 -0.00 -1.26 -4.71 117.00 111.64 1xpn n LEU 13 Ca 0.00 -1.79 -0.26 0.00 -0.00 0.00 0.00 56.01 53.95 1xpn n LEU 13 Cb 0.00 -0.26 -0.09 0.00 -0.00 0.00 0.00 43.42 43.07 1xpn n LEU 13 CO 0.00 0.74 -0.16 1.33 -0.00 0.00 0.00 177.39 179.30 1xpn n VAL 14 N 0.91 0.38 1.49 1.47 0.24 -0.86 -4.92 118.33 117.05 1xpn n VAL 14 Ca 0.15 -4.31 0.14 0.00 -2.04 0.00 0.00 64.34 58.28 1xpn n VAL 14 Cb 0.47 -1.96 0.59 0.00 -1.47 0.00 0.00 33.84 31.48 1xpn n VAL 14 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1xpn n PRO 15 N 1.83 1.05 -1.44 7.34 -0.04 -1.26 -3.95 135.00 138.53 1xpn n PRO 15 Ca 0.25 -0.46 -0.20 0.00 -0.04 0.00 0.00 63.50 63.06 1xpn n PRO 15 Cb 0.45 -1.49 0.10 0.00 -0.04 0.00 0.00 33.50 32.51 1xpn n PRO 15 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1xpn n ARG 16 N -0.57 2.78 0.00 0.54 -4.01 -1.26 -5.00 116.66 109.13 1xpn n ARG 16 Ca 0.17 -3.63 0.00 0.00 -1.04 0.00 0.00 57.85 53.34 1xpn n ARG 16 Cb 0.29 -2.12 0.00 0.00 -3.04 0.00 0.00 32.46 27.59 1xpn n ARG 16 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1xpn n GLY 17 N -0.90 1.95 3.62 2.89 0.00 -1.25 -4.91 105.19 106.58 1xpn n GLY 17 Ca 0.44 0.05 -0.46 0.00 0.00 0.00 0.00 46.02 46.05 1xpn n GLY 17 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1xpn n SER 18 N 3.82 1.97 0.04 1.61 7.64 -1.26 -4.90 113.62 122.53 1xpn n SER 18 Ca 0.00 1.15 -0.20 0.00 1.01 0.00 0.00 58.87 60.83 1xpn n SER 18 Cb 0.00 -1.32 -0.11 0.00 -1.01 0.00 0.00 64.21 61.77 1xpn n SER 18 CO 0.00 0.00 0.00 0.45 -3.01 0.00 0.00 175.04 172.48 1xpn h HIS 19 N 3.53 0.89 -3.14 1.43 -0.00 -1.94 -3.46 115.15 112.46 1xpn h HIS 19 Ca -0.44 -0.50 -0.18 0.00 -0.00 0.00 0.00 60.37 59.25 1xpn h HIS 19 Cb 1.31 -0.09 -0.28 0.00 -0.00 0.00 0.00 27.41 28.35 1xpn h HIS 19 CO 0.54 1.34 -0.48 0.00 -0.00 0.00 0.00 177.93 179.33 1xpn s MET 20 N -3.20 0.23 -1.03 2.45 0.23 -1.26 -4.95 119.30 111.77 1xpn s MET 20 Ca -0.11 0.39 -0.22 0.00 -1.03 0.00 0.00 55.69 54.72 1xpn s MET 20 Cb 0.05 0.02 0.06 0.00 -1.53 0.00 0.00 34.83 33.44 1xpn s MET 20 CO 0.89 -0.08 1.44 0.00 -2.03 0.00 0.00 175.02 175.23 1xpn s ALA 21 N 0.58 2.83 0.00 3.16 0.00 -1.26 -4.64 121.76 122.42 1xpn s ALA 21 Ca -0.04 -2.36 0.00 0.00 0.00 0.00 0.00 51.96 49.56 1xpn s ALA 21 Cb -0.05 -4.49 0.00 0.00 0.00 0.00 0.00 23.12 18.58 1xpn s ALA 21 CO -0.03 -3.53 0.00 -1.13 0.00 0.00 0.00 175.76 171.07 1xpn n SER 22 N 8.60 0.00 -3.66 0.00 3.41 -1.26 -5.12 113.62 115.59 1xpn n SER 22 Ca 0.33 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.83 1xpn n SER 22 Cb 0.50 -0.05 -0.08 0.00 -0.26 0.00 0.00 64.21 64.33 1xpn n SER 22 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1xpn s ASN 23 N -1.56 -0.71 0.00 4.04 0.01 -1.26 -5.05 114.94 110.41 1xpn s ASN 23 Ca 0.00 1.26 0.00 0.00 -0.71 0.00 0.00 52.86 53.41 1xpn s ASN 23 Cb 0.00 1.22 0.00 0.00 0.41 0.00 0.00 41.25 42.88 1xpn s ASN 23 CO 0.00 -0.22 0.44 -2.65 -1.51 0.00 0.00 177.10 173.16 1xpn n PRO 24 N 3.40 0.75 -2.96 -0.60 -0.02 -1.26 -4.71 135.00 129.60 1xpn n PRO 24 Ca -0.17 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 60.88 1xpn n PRO 24 Cb 0.57 -1.34 -0.05 0.00 -0.02 0.00 0.00 33.50 32.66 1xpn n PRO 24 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1xpn s ASN 25 N -0.04 6.25 -0.27 2.55 4.22 -1.26 -4.82 114.94 121.57 1xpn s ASN 25 Ca 0.00 -0.79 -0.12 0.00 -2.14 0.00 0.00 52.86 49.81 1xpn s ASN 25 Cb 0.00 -2.37 -0.14 0.00 1.28 0.00 0.00 41.25 40.02 1xpn s ASN 25 CO 0.00 -1.17 -0.27 -0.90 -2.04 0.00 0.00 177.10 172.72 1xpn n ASP 26 N 7.03 1.96 -4.09 3.54 5.75 -1.26 -5.00 116.55 124.47 1xpn n ASP 26 Ca -0.03 0.28 -0.14 0.00 -0.01 0.00 0.00 54.79 54.88 1xpn n ASP 26 Cb 0.46 -0.78 -0.12 0.00 -1.03 0.00 0.00 41.12 39.65 1xpn n ASP 26 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1xpn s LEU 27 N -7.40 2.26 0.00 -2.12 1.02 -1.26 -4.74 118.68 106.43 1xpn s LEU 27 Ca -0.37 -0.56 -0.11 0.00 0.02 0.00 0.00 54.13 53.11 1xpn s LEU 27 Cb 0.13 -0.25 0.17 0.00 0.02 0.00 0.00 46.19 46.25 1xpn s LEU 27 CO 0.52 -0.17 0.58 -0.81 0.02 0.00 0.00 176.35 176.49 1xpn n PRO 28 N 1.44 -2.29 -1.63 1.29 -0.04 -1.26 -4.94 135.00 127.57 1xpn n PRO 28 Ca -0.22 -0.93 -0.45 0.00 -0.04 0.00 0.00 63.50 61.86 1xpn n PRO 28 Cb 0.55 -0.89 -0.02 0.00 -0.04 0.00 0.00 33.50 33.09 1xpn n PRO 28 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1xpn n ASP 29 N -4.05 1.91 -4.43 3.54 2.03 -1.26 -4.92 116.55 109.36 1xpn n ASP 29 Ca 0.08 1.17 -0.44 0.00 0.52 0.00 0.00 54.79 56.12 1xpn n ASP 29 Cb 0.32 -1.34 -0.07 0.00 -0.72 0.00 0.00 41.12 39.30 1xpn n ASP 29 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1xpn s PHE 30 N -0.65 3.16 -0.35 -0.67 -0.71 -1.26 -4.70 117.98 112.80 1xpn s PHE 30 Ca 0.63 -0.67 -0.13 0.00 -1.04 0.00 0.00 56.93 55.73 1xpn s PHE 30 Cb -0.70 -3.21 -0.01 0.00 -1.21 0.00 0.00 43.02 37.90 1xpn s PHE 30 CO 0.56 -0.85 0.24 -1.25 -1.34 0.00 0.00 175.22 172.59 1xpn s PRO 31 N 2.08 3.33 0.00 1.99 0.04 -1.26 -4.95 135.00 136.23 1xpn s PRO 31 Ca 0.09 -0.75 0.00 0.00 0.04 0.00 0.00 61.00 60.38 1xpn s PRO 31 Cb -0.21 -3.81 0.00 0.00 0.04 0.00 0.00 34.50 30.52 1xpn s PRO 31 CO 0.10 -0.52 0.74 0.39 0.04 0.00 0.00 177.00 177.75 1xpn n GLU 32 N 5.10 0.86 0.31 4.56 1.02 -1.26 -3.93 120.64 127.30 1xpn n GLU 32 Ca -0.12 0.00 -0.14 0.00 -0.02 0.00 0.00 57.16 56.87 1xpn n GLU 32 Cb 0.49 -1.12 -0.07 0.00 -0.02 0.00 0.00 31.44 30.71 1xpn n GLU 32 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1xpn h HIS 33 N 0.04 -0.96 0.00 -0.32 3.86 -2.00 -3.11 115.15 112.66 1xpn h HIS 33 Ca 0.00 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1xpn h HIS 33 Cb 0.12 0.34 -0.00 0.00 1.06 0.00 0.00 27.41 28.94 1xpn h HIS 33 CO 0.00 -0.53 -0.03 0.93 0.86 0.00 0.00 177.93 179.16 1xpn h GLU 34 N -0.87 0.00 0.00 2.45 5.08 -1.93 -1.07 114.58 118.24 1xpn h GLU 34 Ca -0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 1xpn h GLU 34 Cb 0.70 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1xpn h GLU 34 CO 0.07 0.03 0.00 1.88 -1.00 0.00 0.00 179.01 179.99 1xpn h TYR 35 N 0.00 0.00 -0.01 4.33 0.05 -1.78 -2.85 116.97 116.71 1xpn h TYR 35 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1xpn h TYR 35 Cb 0.29 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.03 1xpn h TYR 35 CO 0.00 0.00 -0.44 0.00 -1.05 0.00 0.00 178.16 176.67 1xpn n ALA 36 N -2.04 3.46 0.40 3.88 0.00 -0.42 -4.34 120.51 121.45 1xpn n ALA 36 Ca 0.02 -0.62 0.12 0.00 0.00 0.00 0.00 53.44 52.96 1xpn n ALA 36 Cb 0.38 -0.74 0.50 0.00 0.00 0.00 0.00 19.45 19.59 1xpn n ALA 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xpn h ALA 37 N 3.63 1.00 0.00 0.00 0.00 -1.38 -2.44 119.26 120.07 1xpn h ALA 37 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1xpn h ALA 37 Cb 0.71 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1xpn h ALA 37 CO 0.00 0.00 -0.44 1.79 0.00 0.00 0.00 179.25 180.60 1xpn h THR 38 N 0.00 0.79 0.00 0.00 1.35 -1.76 -3.48 112.91 109.82 1xpn h THR 38 Ca 0.00 -1.99 0.00 0.00 -0.55 0.00 0.00 66.41 63.87 1xpn h THR 38 Cb 0.39 2.30 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 1xpn h THR 38 CO 0.00 0.43 0.00 0.00 -0.25 0.00 0.00 175.52 175.70 1xpn n GLN 39 N -3.26 0.00 0.00 4.72 1.13 -0.92 -4.52 117.38 114.53 1xpn n GLN 39 Ca 0.02 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.08 1xpn n GLN 39 Cb 0.68 0.00 0.00 0.00 0.11 0.00 0.00 30.24 31.03 1xpn n GLN 39 CO 0.00 0.00 0.00 0.94 -1.44 0.00 0.00 177.06 176.56 1xpn n GLN 40 N 0.00 0.00 -1.91 -1.09 7.27 -1.26 -5.09 117.38 115.30 1xpn n GLN 40 Ca 0.00 0.00 -0.41 0.00 0.07 0.00 0.00 57.00 56.66 1xpn n GLN 40 Cb 0.00 0.00 -0.02 0.00 2.41 0.00 0.00 30.24 32.63 1xpn n GLN 40 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 1xpn s VAL 41 N -2.00 2.40 0.00 1.69 0.11 -1.26 -4.59 120.40 116.75 1xpn s VAL 41 Ca 0.00 0.33 0.00 0.00 -2.93 0.00 0.00 61.98 59.38 1xpn s VAL 41 Cb 0.00 -3.21 0.00 0.00 -1.53 0.00 0.00 36.38 31.64 1xpn s VAL 41 CO 0.00 0.05 0.00 0.61 -3.33 0.00 0.00 175.10 172.43 1xpn n GLY 42 N 2.33 0.75 0.00 6.54 0.00 -1.26 -3.92 105.19 109.63 1xpn n GLY 42 Ca 0.08 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1xpn n GLY 42 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xpn n GLY 43 N -0.03 1.50 3.65 -0.02 0.00 -0.95 -3.50 105.19 105.84 1xpn n GLY 43 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1xpn n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xpn s GLY 44 N -0.68 1.42 -0.23 -0.02 0.00 0.12 -4.58 107.32 103.36 1xpn s GLY 44 Ca 0.00 0.61 -0.06 0.00 0.00 0.00 0.00 44.72 45.27 1xpn s GLY 44 CO 0.00 2.89 0.04 0.14 0.00 0.00 0.00 173.10 176.17 1xpn s VAL 45 N 4.41 4.17 -0.23 1.40 1.01 -1.26 -2.65 120.40 127.25 1xpn s VAL 45 Ca 0.68 -0.23 -0.07 0.00 0.00 0.00 0.00 61.98 62.37 1xpn s VAL 45 Cb -0.27 -2.92 -0.03 0.00 0.00 0.00 0.00 36.38 33.16 1xpn s VAL 45 CO 0.26 0.38 0.05 -0.63 0.00 0.00 0.00 175.10 175.16 1xpn s ILE 46 N 1.32 4.18 -0.46 2.22 1.01 0.14 0.26 121.20 129.86 1xpn s ILE 46 Ca 0.05 -0.22 -0.10 0.00 0.00 0.00 0.00 60.65 60.37 1xpn s ILE 46 Cb -0.15 -2.93 0.10 0.00 0.01 0.00 0.00 42.46 39.50 1xpn s ILE 46 CO 0.02 0.37 0.34 0.20 0.00 0.00 0.00 174.94 175.87 1xpn s ASN 47 N 1.42 5.77 -0.14 3.58 0.02 0.06 -0.87 114.94 124.78 1xpn s ASN 47 Ca 0.05 -1.72 -0.03 0.00 -1.02 0.00 0.00 52.86 50.14 1xpn s ASN 47 Cb -0.15 -2.04 -0.03 0.00 0.02 0.00 0.00 41.25 39.05 1xpn s ASN 47 CO 0.02 -0.66 -0.04 -0.83 0.02 0.00 0.00 177.10 175.62 1xpn s GLY 48 N 2.60 1.73 -0.22 0.66 0.00 0.05 -0.08 107.32 112.07 1xpn s GLY 48 Ca 0.04 -0.82 0.02 0.00 0.00 0.00 0.00 44.72 43.96 1xpn s GLY 48 CO 0.01 -0.20 -0.14 -0.35 0.00 0.00 0.00 173.10 172.42 1xpn s ASP 49 N 0.06 3.80 -0.17 1.64 2.15 -0.69 -0.78 116.67 122.69 1xpn s ASP 49 Ca -0.00 -1.05 -0.16 0.00 0.43 0.00 0.00 52.55 51.77 1xpn s ASP 49 Cb -0.13 -1.46 -0.04 0.00 -0.30 0.00 0.00 42.92 40.98 1xpn s ASP 49 CO 0.03 -0.12 0.37 -0.22 -0.17 0.00 0.00 175.17 175.06 1xpn s LEU 50 N 1.22 4.22 -0.30 -1.34 2.96 0.13 -0.13 118.68 125.44 1xpn s LEU 50 Ca -0.03 0.58 -0.10 0.00 -0.22 0.00 0.00 54.13 54.36 1xpn s LEU 50 Cb -0.17 -2.50 0.17 0.00 0.50 0.00 0.00 46.19 44.19 1xpn s LEU 50 CO -0.08 0.01 0.84 -0.72 -1.32 0.00 0.00 176.35 175.08 1xpn s TYR 51 N 0.81 -1.00 -0.17 5.38 1.13 0.20 -4.39 117.35 119.31 1xpn s TYR 51 Ca 0.20 1.40 -0.10 0.00 -1.41 0.00 0.00 57.07 57.16 1xpn s TYR 51 Cb -0.14 0.48 -0.05 0.00 -1.10 0.00 0.00 41.96 41.15 1xpn s TYR 51 CO 0.07 -0.52 0.16 -0.51 -2.51 0.00 0.00 175.55 172.24 1xpn s LEU 52 N 2.75 4.27 -0.55 -3.49 1.43 -0.12 -4.22 118.68 118.75 1xpn s LEU 52 Ca 0.03 0.35 -0.28 0.00 -1.03 0.00 0.00 54.13 53.20 1xpn s LEU 52 Cb -0.10 -2.13 0.03 0.00 0.03 0.00 0.00 46.19 44.02 1xpn s LEU 52 CO -0.17 0.24 1.14 0.42 0.23 0.00 0.00 176.35 178.20 1xpn s THR 53 N -0.05 4.13 0.93 5.49 -4.23 -1.26 -1.61 115.64 119.03 1xpn s THR 53 Ca 0.11 0.89 -0.11 0.00 -1.18 0.00 0.00 61.69 61.40 1xpn s THR 53 Cb -0.12 -4.66 0.15 0.00 1.34 0.00 0.00 72.50 69.21 1xpn s THR 53 CO 0.01 -1.22 1.10 -0.44 -0.54 0.00 0.00 174.62 173.53 1xpn s SER 54 N 2.80 2.99 0.47 3.99 0.01 -1.26 -4.88 113.70 117.82 1xpn s SER 54 Ca 0.42 1.78 0.24 0.00 1.31 0.00 0.00 55.95 59.70 1xpn s SER 54 Cb -0.08 -2.39 1.15 0.00 0.21 0.00 0.00 66.02 64.92 1xpn s SER 54 CO 0.26 -2.99 1.95 0.00 0.41 0.00 0.00 173.24 172.87 1xpn h ALA 55 N -1.79 1.22 -0.00 1.44 0.00 -2.03 0.10 119.26 118.19 1xpn h ALA 55 Ca -0.49 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1xpn h ALA 55 Cb 1.28 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1xpn h ALA 55 CO 0.49 0.25 -0.06 0.45 0.00 0.00 0.00 179.25 180.38 1xpn n SER 56 N -3.64 0.20 -0.67 0.00 2.88 -1.26 -4.91 113.62 106.22 1xpn n SER 56 Ca -0.01 -0.31 -0.09 0.00 -1.33 0.00 0.00 58.87 57.13 1xpn n SER 56 Cb 0.33 -0.19 -0.04 0.00 -0.75 0.00 0.00 64.21 63.56 1xpn n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1xpn n GLY 57 N 1.29 1.05 0.13 0.46 0.00 0.02 -4.90 105.19 103.24 1xpn n GLY 57 Ca 0.14 -0.62 -0.02 0.00 0.00 0.00 0.00 46.02 45.53 1xpn n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xpn h ALA 58 N 0.00 0.92 -4.83 4.61 0.00 -1.91 -3.46 119.26 114.59 1xpn h ALA 58 Ca -0.18 -0.59 0.01 0.00 0.00 0.00 0.00 54.91 54.15 1xpn h ALA 58 Cb 0.58 -0.10 -0.12 0.00 0.00 0.00 0.00 17.79 18.14 1xpn h ALA 58 CO 0.26 0.81 -1.47 -0.89 0.00 0.00 0.00 179.25 177.96 1xpn n ILE 59 N -3.75-12.17 -3.59 0.00 5.41 -1.26 -4.95 119.36 99.04 1xpn n ILE 59 Ca -0.01 2.55 -0.36 0.00 1.00 0.00 0.00 62.75 65.93 1xpn n ILE 59 Cb 0.64 -6.36 -0.08 0.00 -0.71 0.00 0.00 39.64 33.13 1xpn n ILE 59 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 1xpn s GLN 60 N -0.74 4.17 0.00 0.38 1.11 -0.64 -4.90 119.66 119.05 1xpn s GLN 60 Ca -0.26 -0.07 0.00 0.00 0.01 0.00 0.00 55.36 55.05 1xpn s GLN 60 Cb 0.02 -3.48 0.00 0.00 -1.01 0.00 0.00 33.01 28.54 1xpn s GLN 60 CO 0.74 0.15 0.27 1.63 0.01 0.00 0.00 175.29 178.08 1xpn n LYS 61 N 3.95 0.00 0.00 2.91 4.76 -1.26 -0.95 118.16 127.57 1xpn n LYS 61 Ca -0.13 0.43 0.00 0.00 -2.87 0.00 0.00 58.31 55.74 1xpn n LYS 61 Cb 0.52 -1.08 0.00 0.00 -1.84 0.00 0.00 35.03 32.63 1xpn n LYS 61 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1xpn n GLY 62 N 1.21 1.59 3.57 0.72 0.00 -1.26 -3.90 105.19 107.12 1xpn n GLY 62 Ca 0.00 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1xpn n GLY 62 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xpn s THR 63 N 0.00 5.00 -1.43 2.61 -4.23 -1.26 -4.02 115.64 112.31 1xpn s THR 63 Ca 0.00 0.49 -0.03 0.00 -1.18 0.00 0.00 61.69 60.97 1xpn s THR 63 Cb 0.00 -3.96 0.00 0.00 1.34 0.00 0.00 72.50 69.88 1xpn s THR 63 CO 0.00 -0.18 0.38 0.59 -0.54 0.00 0.00 174.62 174.87 1xpn n ASN 64 N 5.77 -5.52 -4.85 3.99 3.02 -1.18 -4.98 115.26 111.52 1xpn n ASN 64 Ca -0.04 -0.18 -0.35 0.00 -0.03 0.00 0.00 54.58 53.98 1xpn n ASN 64 Cb 0.49 -4.41 -0.06 0.00 -0.61 0.00 0.00 39.78 35.19 1xpn n ASN 64 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1xpn s THR 65 N -3.05 4.92 -0.25 3.41 2.01 -1.26 -4.78 115.64 116.64 1xpn s THR 65 Ca 0.19 0.72 -0.14 0.00 0.31 0.00 0.00 61.69 62.77 1xpn s THR 65 Cb -0.08 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 1xpn s THR 65 CO 0.23 0.24 0.34 -0.75 -0.69 0.00 0.00 174.62 173.99 1xpn s LYS 66 N -1.98 4.05 -0.27 4.92 2.20 -1.26 -0.12 119.74 127.27 1xpn s LYS 66 Ca 0.37 0.01 -0.09 0.00 -0.36 0.00 0.00 55.97 55.89 1xpn s LYS 66 Cb -0.15 -3.62 -0.04 0.00 -1.51 0.00 0.00 37.83 32.52 1xpn s LYS 66 CO 0.19 -0.19 0.14 0.08 -0.36 0.00 0.00 175.35 175.21 1xpn s VAL 67 N 1.79 4.85 -0.12 4.02 1.01 0.78 -3.85 120.40 128.89 1xpn s VAL 67 Ca 0.14 -0.02 -0.06 0.00 0.00 0.00 0.00 61.98 62.04 1xpn s VAL 67 Cb -0.15 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1xpn s VAL 67 CO 0.09 0.27 0.09 0.00 0.00 0.00 0.00 175.10 175.55 1xpn s ALA 68 N 1.69 3.65 -0.38 5.51 0.00 0.11 0.10 121.76 132.44 1xpn s ALA 68 Ca 0.07 -0.70 -0.05 0.00 0.00 0.00 0.00 51.96 51.28 1xpn s ALA 68 Cb -0.16 -1.83 0.08 0.00 0.00 0.00 0.00 23.12 21.21 1xpn s ALA 68 CO 0.08 0.55 0.16 -1.17 0.00 0.00 0.00 175.76 175.38 1xpn s LEU 69 N -0.81 4.82 0.01 0.00 2.96 -0.08 -0.50 118.68 125.08 1xpn s LEU 69 Ca 0.13 -1.62 -0.06 0.00 -0.22 0.00 0.00 54.13 52.36 1xpn s LEU 69 Cb -0.12 -1.85 -0.05 0.00 0.50 0.00 0.00 46.19 44.67 1xpn s LEU 69 CO 0.03 -0.46 0.26 -1.61 -1.32 0.00 0.00 176.35 173.25 1xpn s GLU 70 N 1.27 3.57 0.01 1.98 0.41 0.51 -2.43 118.70 124.03 1xpn s GLU 70 Ca 0.03 -0.09 -0.30 0.00 -0.41 0.00 0.00 54.97 54.19 1xpn s GLU 70 Cb -0.22 -3.08 -0.04 0.00 -1.78 0.00 0.00 34.13 29.02 1xpn s GLU 70 CO -0.01 0.65 1.03 -2.14 -0.49 0.00 0.00 175.26 174.30 1xpn s PRO 71 N -1.78 4.52 -0.39 0.39 0.02 -1.26 -1.42 135.00 135.09 1xpn s PRO 71 Ca 0.28 1.50 -0.28 0.00 0.02 0.00 0.00 61.00 62.52 1xpn s PRO 71 Cb -0.13 -3.44 -0.02 0.00 0.02 0.00 0.00 34.50 30.93 1xpn s PRO 71 CO 0.16 -0.11 1.85 0.00 -0.33 0.00 0.00 177.00 178.57 1xpn s ALA 72 N 1.07 2.68 0.15 -1.55 0.00 -1.26 -4.90 121.76 117.95 1xpn s ALA 72 Ca 0.53 0.09 0.07 0.00 0.00 0.00 0.00 51.96 52.66 1xpn s ALA 72 Cb -0.23 -4.08 -0.04 0.00 0.00 0.00 0.00 23.12 18.77 1xpn s ALA 72 CO 0.28 -2.95 -0.17 0.95 0.00 0.00 0.00 175.76 173.88 1xpn s THR 73 N 7.55 1.62 -0.06 0.00 -4.23 -1.26 -4.90 115.64 114.37 1xpn s THR 73 Ca 0.79 -1.83 0.21 0.00 -1.18 0.00 0.00 61.69 59.67 1xpn s THR 73 Cb -0.21 -1.72 0.19 0.00 1.34 0.00 0.00 72.50 72.10 1xpn s THR 73 CO 0.31 -0.35 1.65 0.28 -0.54 0.00 0.00 174.62 175.97 1xpn h SER 74 N 3.37 0.00 -0.74 3.99 0.02 -1.93 -2.98 113.55 115.27 1xpn h SER 74 Ca -0.41 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.53 1xpn h SER 74 Cb 1.20 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.70 1xpn h SER 74 CO 0.51 0.30 0.43 0.22 -1.14 0.00 0.00 176.83 177.14 1xpn h TYR 75 N 0.00 1.01 -0.28 3.45 3.20 -1.88 -2.49 116.97 119.98 1xpn h TYR 75 Ca -0.00 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.77 1xpn h TYR 75 Cb 1.02 -0.33 -0.05 0.00 1.54 0.00 0.00 36.73 38.91 1xpn h TYR 75 CO 0.00 0.69 0.11 -0.12 -1.64 0.00 0.00 178.16 177.19 1xpn n MET 76 N -4.37 1.98 0.41 1.82 1.56 -1.12 -4.37 117.12 113.02 1xpn n MET 76 Ca 0.08 -1.11 -0.19 0.00 -0.27 0.00 0.00 57.70 56.20 1xpn n MET 76 Cb 0.08 -1.62 -0.09 0.00 2.15 0.00 0.00 33.22 33.74 1xpn n MET 76 CO 0.00 0.00 0.00 -0.22 -0.73 0.00 0.00 175.97 175.02 1xpn h LYS 77 N 0.95 -1.04 0.00 2.12 1.63 -1.56 -2.27 116.57 116.39 1xpn h LYS 77 Ca 0.10 0.07 -0.05 0.00 -0.85 0.00 0.00 60.65 59.92 1xpn h LYS 77 Cb 1.33 0.24 -0.01 0.00 -0.60 0.00 0.00 32.23 33.19 1xpn h LYS 77 CO 0.28 -0.70 -0.25 0.00 -3.45 0.00 0.00 179.45 175.34 1xpn h ALA 78 N -0.89 1.32 -0.34 5.00 0.00 -1.85 -1.93 119.26 120.57 1xpn h ALA 78 Ca -0.10 -0.23 -0.14 0.00 0.00 0.00 0.00 54.91 54.45 1xpn h ALA 78 Cb 0.86 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1xpn h ALA 78 CO 0.13 0.31 -0.34 -0.92 0.00 0.00 0.00 179.25 178.43 1xpn h TYR 79 N 0.00 0.90 0.00 0.00 5.03 -1.81 -0.48 116.97 120.61 1xpn h TYR 79 Ca -0.00 -0.25 -0.11 0.00 2.58 0.00 0.00 58.73 60.95 1xpn h TYR 79 Cb 0.53 -0.20 -0.02 0.00 1.55 0.00 0.00 36.73 38.59 1xpn h TYR 79 CO 0.00 1.00 -0.52 -0.92 -1.32 0.00 0.00 178.16 176.40 1xpn h TYR 80 N 0.64 0.00 0.05 -3.82 3.20 -0.92 -0.63 116.97 115.50 1xpn h TYR 80 Ca 0.07 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 1xpn h TYR 80 Cb 0.88 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.15 1xpn h TYR 80 CO 0.05 0.52 -0.03 0.00 -1.64 0.00 0.00 178.16 177.06 1xpn h ALA 81 N 1.48 -0.07 0.15 1.82 0.00 -1.02 -3.30 119.26 118.32 1xpn h ALA 81 Ca -0.01 -0.31 -0.30 0.00 0.00 0.00 0.00 54.91 54.30 1xpn h ALA 81 Cb 1.21 0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.04 1xpn h ALA 81 CO 0.07 -0.18 -1.41 0.87 0.00 0.00 0.00 179.25 178.59 1xpn h LYS 82 N -0.79 0.32 0.00 0.00 1.57 -1.18 -3.45 116.57 113.04 1xpn h LYS 82 Ca -0.01 -0.55 0.00 0.00 -1.87 0.00 0.00 60.65 58.22 1xpn h LYS 82 Cb 0.64 0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.16 1xpn h LYS 82 CO 0.01 1.23 0.00 1.19 -0.57 0.00 0.00 179.45 181.32 1xpn n PHE 83 N -3.54 0.00 0.00 -1.35 3.72 -0.28 -4.91 117.46 111.09 1xpn n PHE 83 Ca -0.14 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.26 1xpn n PHE 83 Cb 1.05 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.59 1xpn n PHE 83 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1xpn n GLY 84 N 3.95 2.86 3.43 1.37 0.00 -0.96 -3.16 105.19 112.69 1xpn n GLY 84 Ca 0.00 0.31 -0.44 0.00 0.00 0.00 0.00 46.02 45.89 1xpn n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xpn s ASN 85 N -4.00 6.93 -0.33 1.61 6.03 -1.26 -4.16 114.94 119.76 1xpn s ASN 85 Ca 0.00 -2.74 -0.10 0.00 -1.03 0.00 0.00 52.86 48.99 1xpn s ASN 85 Cb 0.00 -2.36 0.01 0.00 -3.03 0.00 0.00 41.25 35.86 1xpn s ASN 85 CO 0.00 -0.78 0.17 -0.22 -2.03 0.00 0.00 177.10 174.24 1xpn s LEU 86 N 1.47 4.33 0.54 3.54 0.20 -0.03 -4.89 118.68 123.84 1xpn s LEU 86 Ca 0.36 -0.69 -0.21 0.00 0.69 0.00 0.00 54.13 54.28 1xpn s LEU 86 Cb -0.05 -2.01 -0.05 0.00 -0.43 0.00 0.00 46.19 43.65 1xpn s LEU 86 CO -0.05 -0.26 1.20 -1.81 -0.29 0.00 0.00 176.35 175.14 1xpn s ASP 87 N 1.59 5.60 0.55 3.68 1.11 -1.26 -1.28 116.67 126.66 1xpn s ASP 87 Ca 0.04 2.38 0.37 0.00 0.18 0.00 0.00 52.55 55.51 1xpn s ASP 87 Cb -0.18 -2.60 1.84 0.00 1.07 0.00 0.00 42.92 43.05 1xpn s ASP 87 CO 0.06 -1.32 2.11 0.00 1.18 0.00 0.00 175.17 177.21 1xpn h ALA 88 N 1.38 1.00 0.00 5.23 0.00 -1.90 -1.30 119.26 123.67 1xpn h ALA 88 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1xpn h ALA 88 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1xpn h ALA 88 CO 0.57 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.82 1xpn h ALA 89 N 2.02 1.00 0.00 0.00 0.00 -1.91 -3.13 119.26 117.25 1xpn h ALA 89 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xpn h ALA 89 Cb 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1xpn h ALA 89 CO 0.00 0.00 -0.48 0.36 0.00 0.00 0.00 179.25 179.13 1xpn n LYS 90 N -2.62 1.54 -2.06 0.00 2.85 -0.50 -5.01 118.16 112.36 1xpn n LYS 90 Ca 0.04 -3.24 -0.41 0.00 -1.05 0.00 0.00 58.31 53.65 1xpn n LYS 90 Cb 0.44 -1.58 -0.03 0.00 -0.65 0.00 0.00 35.03 33.21 1xpn n LYS 90 CO 0.00 0.00 0.00 0.50 -0.05 0.00 0.00 177.40 177.85 1xpn s ARG 91 N -3.16 3.12 -0.15 -1.58 6.06 -1.13 -4.86 118.95 117.26 1xpn s ARG 91 Ca 0.38 1.08 -0.32 0.00 -2.50 0.00 0.00 55.73 54.37 1xpn s ARG 91 Cb 0.36 -4.24 -0.09 0.00 0.06 0.00 0.00 34.95 31.04 1xpn s ARG 91 CO -0.07 -2.13 2.06 -3.47 -2.50 0.00 0.00 175.30 169.20 1xpn n ASP 92 N 10.97 3.32 -0.97 -2.12 2.03 -1.26 -4.85 116.55 123.67 1xpn n ASP 92 Ca 0.21 0.62 0.02 0.00 0.52 0.00 0.00 54.79 56.17 1xpn n ASP 92 Cb 0.49 -1.44 0.14 0.00 -0.72 0.00 0.00 41.12 39.58 1xpn n ASP 92 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1xpn n PRO 93 N 7.77 2.33 0.03 -0.67 -0.04 -1.26 -4.06 135.00 139.10 1xpn n PRO 93 Ca 0.28 -1.09 -0.01 0.00 -0.04 0.00 0.00 63.50 62.63 1xpn n PRO 93 Cb 0.36 -1.75 -0.00 0.00 -0.04 0.00 0.00 33.50 32.06 1xpn n PRO 93 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1xpn n ASP 94 N 0.22 0.99 -4.57 3.54 2.03 -1.26 -5.01 116.55 112.48 1xpn n ASP 94 Ca 0.10 0.13 -0.41 0.00 0.52 0.00 0.00 54.79 55.13 1xpn n ASP 94 Cb 0.57 -0.32 -0.08 0.00 -0.72 0.00 0.00 41.12 40.57 1xpn n ASP 94 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1xpn s VAL 95 N -2.08 5.04 0.37 5.18 1.01 -1.26 -5.06 120.40 123.61 1xpn s VAL 95 Ca -0.03 0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.38 1xpn s VAL 95 Cb 0.01 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 1xpn s VAL 95 CO 0.04 -0.14 0.56 -1.10 0.00 0.00 0.00 175.10 174.47 1xpn s GLN 96 N 2.33 3.28 -0.31 2.72 -0.21 -1.26 -4.87 119.66 121.34 1xpn s GLN 96 Ca 0.18 -0.52 -0.37 0.00 0.02 0.00 0.00 55.36 54.67 1xpn s GLN 96 Cb -0.16 -2.67 -0.13 0.00 1.00 0.00 0.00 33.01 31.05 1xpn s GLN 96 CO 0.12 0.02 2.02 -2.30 -2.12 0.00 0.00 175.29 173.03 1xpn n PRO 97 N -1.83 1.14 -1.06 2.91 -0.02 -1.26 -4.94 135.00 129.95 1xpn n PRO 97 Ca -0.02 0.36 -0.29 0.00 -2.02 0.00 0.00 63.50 61.53 1xpn n PRO 97 Cb 0.57 -2.31 0.20 0.00 -0.02 0.00 0.00 33.50 31.94 1xpn n PRO 97 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 1xpn s PRO 98 N 5.17 -0.06 -1.22 0.52 0.02 -1.26 -4.88 135.00 133.29 1xpn s PRO 98 Ca 1.05 0.47 -0.20 0.00 0.02 0.00 0.00 61.00 62.35 1xpn s PRO 98 Cb -0.95 -1.68 0.02 0.00 0.02 0.00 0.00 34.50 31.91 1xpn s PRO 98 CO 0.56 -3.05 1.76 0.08 -0.33 0.00 0.00 177.00 176.01 1xpn s VAL 99 N -2.89 3.93 0.65 3.83 1.01 -1.26 -4.96 120.40 120.71 1xpn s VAL 99 Ca 0.66 -1.46 -0.17 0.00 0.00 0.00 0.00 61.98 61.01 1xpn s VAL 99 Cb -0.19 -4.98 -0.01 0.00 0.00 0.00 0.00 36.38 31.21 1xpn s VAL 99 CO 0.59 -1.72 1.21 -0.76 0.00 0.00 0.00 175.10 174.41 1xpn s LEU 100 N 6.21 3.52 0.32 3.92 1.43 -1.26 -4.94 118.68 127.88 1xpn s LEU 100 Ca 0.57 2.37 -0.29 0.00 -1.03 0.00 0.00 54.13 55.76 1xpn s LEU 100 Cb 0.02 -4.59 -0.12 0.00 0.03 0.00 0.00 46.19 41.52 1xpn s LEU 100 CO 0.07 -1.86 1.33 0.47 0.23 0.00 0.00 176.35 176.58 1xpn n ASP 101 N -2.06 2.81 0.06 2.29 9.92 -1.26 -4.84 116.55 123.47 1xpn n ASP 101 Ca 0.14 1.19 0.04 0.00 -0.53 0.00 0.00 54.79 55.63 1xpn n ASP 101 Cb 0.50 -1.48 0.20 0.00 -0.64 0.00 0.00 41.12 39.70 1xpn n ASP 101 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 1xpn n PRO 102 N 0.92 0.05 -0.34 -0.24 -0.02 -1.26 -2.09 135.00 132.02 1xpn n PRO 102 Ca 0.06 0.55 0.04 0.00 -2.02 0.00 0.00 63.50 62.12 1xpn n PRO 102 Cb 0.35 -1.66 0.18 0.00 -0.02 0.00 0.00 33.50 32.36 1xpn n PRO 102 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1xpn h ARG 103 N 0.00 0.95 -0.21 -0.52 9.65 -2.02 -0.79 114.38 121.45 1xpn h ARG 103 Ca 0.00 -0.06 -0.07 0.00 -1.10 0.00 0.00 59.98 58.75 1xpn h ARG 103 Cb 0.01 -0.22 -0.01 0.00 -1.39 0.00 0.00 29.97 28.36 1xpn h ARG 103 CO 0.00 0.63 -0.19 0.07 2.80 0.00 0.00 179.97 183.28 1xpn h ARG 104 N 0.98 0.36 0.00 0.20 0.11 -1.78 -2.11 114.38 112.14 1xpn h ARG 104 Ca 0.43 -0.11 0.00 0.00 0.10 0.00 0.00 59.98 60.40 1xpn h ARG 104 Cb 0.31 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.36 1xpn h ARG 104 CO -0.22 0.55 0.00 0.00 0.10 0.00 0.00 179.97 180.40 1xpn h ALA 105 N 1.47 1.00 0.02 0.08 0.00 -1.31 0.44 119.26 120.96 1xpn h ALA 105 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.69 1xpn h ALA 105 Cb 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 1xpn h ALA 105 CO 0.03 0.00 -1.53 2.41 0.00 0.00 0.00 179.25 180.16 1xpn n THR 106 N -2.48 1.57 0.06 0.00 -1.04 -0.82 -4.59 114.28 106.98 1xpn n THR 106 Ca -0.00 -0.16 -0.01 0.00 -2.04 0.00 0.00 64.05 61.83 1xpn n THR 106 Cb 0.13 -1.97 -0.06 0.00 -1.82 0.00 0.00 70.33 66.61 1xpn n THR 106 CO 0.00 0.00 0.00 1.88 -0.64 0.00 0.00 175.07 176.31 1xpn h TYR 107 N -0.84 0.00 -2.70 -1.42 0.05 -1.09 -3.44 116.97 107.54 1xpn h TYR 107 Ca -0.41 0.00 -0.56 0.00 0.05 0.00 0.00 58.73 57.82 1xpn h TYR 107 Cb 1.45 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 39.17 1xpn h TYR 107 CO 0.07 0.68 1.08 0.08 -1.05 0.00 0.00 178.16 179.02 1xpn s VAL 108 N -2.86 3.71 -0.19 -2.88 1.01 0.15 -4.84 120.40 114.51 1xpn s VAL 108 Ca -0.00 0.85 -0.05 0.00 0.00 0.00 0.00 61.98 62.77 1xpn s VAL 108 Cb 0.08 -3.61 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 1xpn s VAL 108 CO 0.79 -0.15 -0.01 -0.60 0.00 0.00 0.00 175.10 175.14 1xpn s ARG 109 N 4.19 3.62 0.04 2.72 3.52 -1.02 -4.87 118.95 127.15 1xpn s ARG 109 Ca 0.70 -0.52 0.01 0.00 -0.13 0.00 0.00 55.73 55.79 1xpn s ARG 109 Cb -0.29 -3.05 -0.04 0.00 -1.56 0.00 0.00 34.95 30.01 1xpn s ARG 109 CO 0.27 0.04 0.12 -1.21 -0.81 0.00 0.00 175.30 173.72 1xpn s GLU 110 N 0.91 3.13 -0.08 5.12 8.01 -1.26 -0.91 118.70 133.63 1xpn s GLU 110 Ca 0.01 -0.54 0.01 0.00 0.01 0.00 0.00 54.97 54.46 1xpn s GLU 110 Cb -0.14 -2.88 0.02 0.00 -4.31 0.00 0.00 34.13 26.82 1xpn s GLU 110 CO 0.02 0.61 -0.07 0.00 0.01 0.00 0.00 175.26 175.82 1xpn s ALA 111 N -1.36 1.09 -0.23 5.21 0.00 0.11 -4.95 121.76 121.63 1xpn s ALA 111 Ca 0.29 -0.35 -0.27 0.00 0.00 0.00 0.00 51.96 51.63 1xpn s ALA 111 Cb -0.12 -0.69 0.00 0.00 0.00 0.00 0.00 23.12 22.31 1xpn s ALA 111 CO 0.21 -0.19 0.94 0.99 0.00 0.00 0.00 175.76 177.71 1xpn s THR 112 N 1.28 4.76 0.28 0.00 2.01 -1.26 -0.15 115.64 122.56 1xpn s THR 112 Ca -0.04 1.81 -0.30 0.00 0.31 0.00 0.00 61.69 63.48 1xpn s THR 112 Cb -0.14 -4.22 -0.11 0.00 0.01 0.00 0.00 72.50 68.05 1xpn s THR 112 CO -0.03 -0.13 1.49 0.42 -0.69 0.00 0.00 174.62 175.68 1xpn s THR 113 N 3.01 2.41 1.13 -0.82 -4.23 0.83 -4.88 115.64 113.08 1xpn s THR 113 Ca 0.40 0.36 -0.16 0.00 -1.18 0.00 0.00 61.69 61.11 1xpn s THR 113 Cb -0.15 -3.23 0.25 0.00 1.34 0.00 0.00 72.50 70.71 1xpn s THR 113 CO 0.07 0.06 1.08 -0.62 -0.54 0.00 0.00 174.62 174.67 1xpn s ASP 114 N 0.29 1.50 0.34 3.99 2.15 0.40 -3.09 116.67 122.25 1xpn s ASP 114 Ca 0.59 0.99 0.12 0.00 0.43 0.00 0.00 52.55 54.68 1xpn s ASP 114 Cb -0.44 -1.50 0.93 0.00 -0.30 0.00 0.00 42.92 41.60 1xpn s ASP 114 CO 0.47 -3.81 1.75 -0.61 -0.17 0.00 0.00 175.17 172.81 1xpn h GLN 115 N -2.36 0.54 -0.26 4.34 5.75 -1.89 0.34 115.11 121.58 1xpn h GLN 115 Ca -0.52 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 57.95 1xpn h GLN 115 Cb 1.32 -0.12 0.00 0.00 1.07 0.00 0.00 27.48 29.75 1xpn h GLN 115 CO 0.47 0.36 0.00 0.27 -2.65 0.00 0.00 178.83 177.28 1xpn n ASN 116 N -4.78 1.54 -1.65 -0.69 6.94 -1.26 -4.75 115.26 110.61 1xpn n ASN 116 Ca 0.26 -1.92 -0.04 0.00 -0.02 0.00 0.00 54.58 52.86 1xpn n ASN 116 Cb 0.75 -0.17 0.02 0.00 -2.36 0.00 0.00 39.78 38.02 1xpn n ASN 116 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1xpn n GLY 117 N 1.00 0.25 3.12 4.83 0.00 0.12 -4.83 105.19 109.69 1xpn n GLY 117 Ca 0.11 -0.30 -0.18 0.00 0.00 0.00 0.00 46.02 45.65 1xpn n GLY 117 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xpn s ARG 118 N -4.25 0.78 -0.00 1.61 3.52 -1.24 0.22 118.95 119.59 1xpn s ARG 118 Ca 0.01 -0.79 -0.07 0.00 -0.13 0.00 0.00 55.73 54.76 1xpn s ARG 118 Cb -0.00 -0.74 0.00 0.00 -1.56 0.00 0.00 34.95 32.65 1xpn s ARG 118 CO 0.19 0.17 0.14 -0.59 -0.81 0.00 0.00 175.30 174.39 1xpn s PHE 119 N -1.05 0.02 0.00 5.12 -0.71 0.04 -0.46 117.98 120.95 1xpn s PHE 119 Ca -0.02 -0.09 0.04 0.00 -1.04 0.00 0.00 56.93 55.82 1xpn s PHE 119 Cb -0.09 -0.04 -0.01 0.00 -1.21 0.00 0.00 43.02 41.67 1xpn s PHE 119 CO 0.01 -0.26 -0.12 -0.51 -1.34 0.00 0.00 175.22 173.00 1xpn s ASP 120 N -1.24 1.35 0.06 1.98 1.11 -1.26 -0.77 116.67 117.91 1xpn s ASP 120 Ca -0.13 -0.27 0.06 0.00 0.18 0.00 0.00 52.55 52.38 1xpn s ASP 120 Cb -0.07 -0.13 -0.03 0.00 1.07 0.00 0.00 42.92 43.76 1xpn s ASP 120 CO 0.01 0.10 -0.16 -0.36 1.18 0.00 0.00 175.17 175.95 1xpn s PHE 121 N -0.43 1.34 0.26 4.23 0.08 -0.05 -4.98 117.98 118.42 1xpn s PHE 121 Ca 0.03 -0.41 -0.10 0.00 0.12 0.00 0.00 56.93 56.56 1xpn s PHE 121 Cb -0.05 -0.76 -0.01 0.00 -0.57 0.00 0.00 43.02 41.63 1xpn s PHE 121 CO -0.00 0.07 0.44 0.16 -0.10 0.00 0.00 175.22 175.80 1xpn s ASP 122 N -1.54 0.07 -1.23 1.36 -4.77 -1.26 0.24 116.67 109.54 1xpn s ASP 122 Ca 0.01 -1.06 -0.02 0.00 -3.30 0.00 0.00 52.55 48.17 1xpn s ASP 122 Cb -0.09 0.58 0.00 0.00 -1.09 0.00 0.00 42.92 42.32 1xpn s ASP 122 CO 0.02 -1.14 1.04 1.57 0.70 0.00 0.00 175.17 177.36 1xpn n HIS 123 N -0.40 -2.34 -5.01 2.11 -0.00 -1.18 -4.96 115.22 103.44 1xpn n HIS 123 Ca -0.01 0.95 -0.32 0.00 -0.00 0.00 0.00 57.72 58.34 1xpn n HIS 123 Cb 0.62 -5.04 -0.15 0.00 -0.00 0.00 0.00 29.99 25.42 1xpn n HIS 123 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1xpn s ILE 124 N -3.35 2.60 0.86 3.57 1.01 -1.09 -4.28 121.20 120.53 1xpn s ILE 124 Ca 0.15 -0.85 -0.11 0.00 0.00 0.00 0.00 60.65 59.84 1xpn s ILE 124 Cb -0.07 -2.03 0.11 0.00 0.01 0.00 0.00 42.46 40.49 1xpn s ILE 124 CO 0.72 0.55 1.09 -2.84 0.00 0.00 0.00 174.94 174.47 1xpn s PRO 125 N 0.05 1.50 0.30 2.79 0.02 -1.25 0.15 135.00 138.56 1xpn s PRO 125 Ca -0.07 1.01 -0.24 0.00 0.02 0.00 0.00 61.00 61.72 1xpn s PRO 125 Cb -0.15 -1.82 -0.10 0.00 0.02 0.00 0.00 34.50 32.45 1xpn s PRO 125 CO 0.05 -2.13 0.89 0.54 -0.33 0.00 0.00 177.00 176.02 1xpn s ASN 126 N -3.30 7.24 0.00 2.53 4.22 -1.26 -4.82 114.94 119.54 1xpn s ASN 126 Ca 0.63 1.71 0.00 0.00 -2.14 0.00 0.00 52.86 53.06 1xpn s ASN 126 Cb -0.18 -2.53 0.00 0.00 1.28 0.00 0.00 41.25 39.81 1xpn s ASN 126 CO 0.57 -0.06 0.00 0.61 -2.04 0.00 0.00 177.10 176.18 1xpn n GLY 127 N 0.52 -0.70 3.69 0.45 0.00 -0.19 -4.98 105.19 103.98 1xpn n GLY 127 Ca 0.01 -1.60 -0.38 0.00 0.00 0.00 0.00 46.02 44.06 1xpn n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xpn s THR 128 N -1.95 5.20 0.17 2.61 -4.23 -1.26 -0.46 115.64 115.71 1xpn s THR 128 Ca 0.00 0.79 0.09 0.00 -1.18 0.00 0.00 61.69 61.38 1xpn s THR 128 Cb 0.00 -3.75 -0.04 0.00 1.34 0.00 0.00 72.50 70.04 1xpn s THR 128 CO 0.00 0.28 -0.18 -0.31 -0.54 0.00 0.00 174.62 173.88 1xpn s TYR 129 N 1.03 1.83 -0.42 3.99 1.51 0.41 -4.02 117.35 121.67 1xpn s TYR 129 Ca 0.21 -0.47 -0.14 0.00 -1.01 0.00 0.00 57.07 55.66 1xpn s TYR 129 Cb -0.15 -0.90 0.04 0.00 -0.11 0.00 0.00 41.96 40.85 1xpn s TYR 129 CO 0.08 0.35 0.31 0.71 -1.11 0.00 0.00 175.55 175.89 1xpn s TYR 130 N -2.17 3.25 -0.44 2.71 2.02 -0.50 -0.50 117.35 121.73 1xpn s TYR 130 Ca 0.17 -0.83 -0.19 0.00 -0.37 0.00 0.00 57.07 55.85 1xpn s TYR 130 Cb -0.05 -2.77 0.03 0.00 -0.40 0.00 0.00 41.96 38.77 1xpn s TYR 130 CO 0.07 -0.68 0.55 0.42 -1.57 0.00 0.00 175.55 174.33 1xpn s ILE 131 N 1.63 4.95 -0.16 2.71 1.01 -0.46 -0.36 121.20 130.52 1xpn s ILE 131 Ca 0.04 -0.16 -0.02 0.00 0.00 0.00 0.00 60.65 60.52 1xpn s ILE 131 Cb -0.21 -4.14 -0.01 0.00 0.01 0.00 0.00 42.46 38.11 1xpn s ILE 131 CO 0.08 -0.54 -0.10 -0.55 0.00 0.00 0.00 174.94 173.83 1xpn s SER 132 N 1.98 4.16 -0.11 3.58 0.15 0.35 -0.61 113.70 123.20 1xpn s SER 132 Ca 0.17 -0.33 -0.01 0.00 0.70 0.00 0.00 55.95 56.48 1xpn s SER 132 Cb -0.16 -1.67 0.03 0.00 -1.71 0.00 0.00 66.02 62.51 1xpn s SER 132 CO 0.16 0.11 -0.06 -0.55 1.20 0.00 0.00 173.24 174.09 1xpn s SER 133 N 0.71 2.09 -0.57 5.45 0.15 -0.05 0.07 113.70 121.55 1xpn s SER 133 Ca -0.05 -0.27 -0.20 0.00 0.70 0.00 0.00 55.95 56.14 1xpn s SER 133 Cb -0.15 -0.78 0.08 0.00 -1.71 0.00 0.00 66.02 63.46 1xpn s SER 133 CO 0.02 -0.13 0.73 -1.83 1.20 0.00 0.00 173.24 173.23 1xpn s GLU 134 N 1.74 3.09 -0.34 5.44 -1.05 -1.25 -0.94 118.70 125.39 1xpn s GLU 134 Ca 0.05 -1.08 0.03 0.00 -0.15 0.00 0.00 54.97 53.82 1xpn s GLU 134 Cb -0.12 -4.20 0.10 0.00 -0.44 0.00 0.00 34.13 29.46 1xpn s GLU 134 CO -0.08 -1.48 0.05 -1.17 0.95 0.00 0.00 175.26 173.53 1xpn s LEU 135 N 2.91 4.65 -0.18 1.83 2.96 0.19 -4.68 118.68 126.36 1xpn s LEU 135 Ca 0.15 -2.04 -0.01 0.00 -0.22 0.00 0.00 54.13 52.01 1xpn s LEU 135 Cb -0.21 -1.64 -0.00 0.00 0.50 0.00 0.00 46.19 44.83 1xpn s LEU 135 CO 0.09 -0.37 -0.12 0.42 -1.32 0.00 0.00 176.35 175.05 1xpn s THR 136 N 0.96 2.87 0.35 3.68 -4.23 -1.26 -1.35 115.64 116.66 1xpn s THR 136 Ca 0.08 -0.68 0.04 0.00 -1.18 0.00 0.00 61.69 59.95 1xpn s THR 136 Cb -0.20 -2.25 -0.06 0.00 1.34 0.00 0.00 72.50 71.34 1xpn s THR 136 CO -0.07 0.49 0.06 -1.66 -0.54 0.00 0.00 174.62 172.90 1xpn s TRP 137 N 1.11 1.99 -0.22 3.99 -2.14 -0.70 -5.00 118.94 117.98 1xpn s TRP 137 Ca 0.01 -0.97 0.02 0.00 2.66 0.00 0.00 56.10 57.81 1xpn s TRP 137 Cb -0.14 -1.33 0.04 0.00 -3.10 0.00 0.00 33.47 28.93 1xpn s TRP 137 CO -0.03 0.02 -0.15 -1.54 -2.66 0.00 0.00 176.95 172.59 1xpn s SER 138 N -3.55 3.80 0.10 -2.66 1.04 -1.26 -1.46 113.70 109.72 1xpn s SER 138 Ca 0.33 -1.04 0.08 0.00 0.48 0.00 0.00 55.95 55.80 1xpn s SER 138 Cb 0.08 -1.49 -0.04 0.00 0.10 0.00 0.00 66.02 64.66 1xpn s SER 138 CO 0.15 -0.11 -0.13 0.00 0.98 0.00 0.00 173.24 174.13 1xpn s ALA 139 N 1.21 2.83 -0.49 5.32 0.00 -0.07 -4.92 121.76 125.64 1xpn s ALA 139 Ca -0.02 -1.27 -0.23 0.00 0.00 0.00 0.00 51.96 50.44 1xpn s ALA 139 Cb -0.17 -0.81 0.04 0.00 0.00 0.00 0.00 23.12 22.18 1xpn s ALA 139 CO -0.09 0.62 0.82 -0.65 0.00 0.00 0.00 175.76 176.47 1xpn s GLN 140 N -2.07 3.35 -1.19 0.00 -0.21 -1.26 -0.48 119.66 117.79 1xpn s GLN 140 Ca 0.19 -0.25 -0.14 0.00 0.02 0.00 0.00 55.36 55.18 1xpn s GLN 140 Cb -0.11 -4.00 0.17 0.00 1.00 0.00 0.00 33.01 30.07 1xpn s GLN 140 CO 0.11 -1.27 1.42 0.45 -2.12 0.00 0.00 175.29 173.89 1xpn s SER 141 N 2.46 7.04 0.00 5.90 0.15 0.18 -4.82 113.70 124.61 1xpn s SER 141 Ca 0.28 -2.92 0.00 0.00 0.70 0.00 0.00 55.95 54.02 1xpn s SER 141 Cb -0.13 -2.41 0.00 0.00 -1.71 0.00 0.00 66.02 61.77 1xpn s SER 141 CO 0.20 -0.78 0.00 -0.67 1.20 0.00 0.00 173.24 173.19 1xpn n ASP 142 N 5.78 0.00 0.00 5.45 2.03 -1.26 -1.25 116.55 127.29 1xpn n ASP 142 Ca 0.36 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.67 1xpn n ASP 142 Cb 0.43 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.83 1xpn n ASP 142 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xpn n GLY 143 N 0.00 -0.32 3.37 0.27 0.00 -1.26 -5.00 105.19 102.24 1xpn n GLY 143 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1xpn n GLY 143 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xpn s LYS 144 N -0.11 3.34 -0.75 1.61 2.20 -0.38 -5.05 119.74 120.61 1xpn s LYS 144 Ca 0.00 -0.68 -0.26 0.00 -0.36 0.00 0.00 55.97 54.67 1xpn s LYS 144 Cb 0.00 -3.26 0.03 0.00 -1.51 0.00 0.00 37.83 33.09 1xpn s LYS 144 CO 0.00 -0.30 1.27 0.99 -0.36 0.00 0.00 175.35 176.95 1xpn s THR 145 N 1.53 3.77 0.33 3.43 2.01 -1.26 0.47 115.64 125.92 1xpn s THR 145 Ca 0.05 0.30 -0.02 0.00 0.31 0.00 0.00 61.69 62.32 1xpn s THR 145 Cb -0.16 -4.91 -0.04 0.00 0.01 0.00 0.00 72.50 67.40 1xpn s THR 145 CO 0.01 -1.84 0.57 0.27 -0.69 0.00 0.00 174.62 172.94 1xpn s ILE 146 N 5.58 5.06 -0.48 1.82 -4.36 0.37 -4.84 121.20 124.34 1xpn s ILE 146 Ca 0.35 -0.17 -0.12 0.00 -0.26 0.00 0.00 60.65 60.45 1xpn s ILE 146 Cb -0.08 -3.80 0.11 0.00 1.25 0.00 0.00 42.46 39.94 1xpn s ILE 146 CO 0.13 -0.47 0.38 -0.89 0.24 0.00 0.00 174.94 174.34 1xpn s THR 147 N -2.24 4.60 0.52 8.37 2.01 -1.26 -0.89 115.64 126.74 1xpn s THR 147 Ca 0.42 -1.58 -0.04 0.00 0.31 0.00 0.00 61.69 60.80 1xpn s THR 147 Cb -0.10 -3.94 -0.01 0.00 0.01 0.00 0.00 72.50 68.45 1xpn s THR 147 CO 0.34 -0.75 0.80 -1.61 -0.69 0.00 0.00 174.62 172.72 1xpn s GLU 148 N 1.47 3.18 0.00 4.92 2.02 -0.53 -4.89 118.70 124.85 1xpn s GLU 148 Ca 0.04 -0.05 0.00 0.00 0.02 0.00 0.00 54.97 54.99 1xpn s GLU 148 Cb -0.27 -2.38 0.00 0.00 0.10 0.00 0.00 34.13 31.59 1xpn s GLU 148 CO 0.01 -0.42 0.00 0.41 0.02 0.00 0.00 175.26 175.29 1xpn n GLY 149 N -2.35 0.62 0.00 -1.39 0.00 -1.26 -1.71 105.19 99.10 1xpn n GLY 149 Ca 0.02 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.32 1xpn n GLY 149 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xpn n GLY 150 N 0.00 0.67 3.22 -0.02 0.00 -0.46 -3.19 105.19 105.41 1xpn n GLY 150 Ca 0.00 -1.62 -0.40 0.00 0.00 0.00 0.00 46.02 44.00 1xpn n GLY 150 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xpn s THR 151 N -3.59 4.02 -0.33 2.61 2.01 -0.41 -0.64 115.64 119.32 1xpn s THR 151 Ca 0.00 -1.64 -0.17 0.00 0.31 0.00 0.00 61.69 60.19 1xpn s THR 151 Cb 0.00 -3.57 -0.01 0.00 0.01 0.00 0.00 72.50 68.93 1xpn s THR 151 CO 0.00 -0.61 0.47 0.54 -0.69 0.00 0.00 174.62 174.32 1xpn s VAL 152 N 1.35 5.07 -0.18 3.82 0.11 -0.12 -0.85 120.40 129.61 1xpn s VAL 152 Ca 0.04 0.37 0.00 0.00 -2.93 0.00 0.00 61.98 59.47 1xpn s VAL 152 Cb -0.24 -3.89 0.01 0.00 -1.53 0.00 0.00 36.38 30.73 1xpn s VAL 152 CO -0.00 -0.11 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.60 1xpn s THR 153 N 2.27 2.38 -0.06 5.04 2.01 -1.26 -0.87 115.64 125.15 1xpn s THR 153 Ca 0.17 -0.84 0.00 0.00 0.31 0.00 0.00 61.69 61.33 1xpn s THR 153 Cb -0.16 -2.01 -0.03 0.00 0.01 0.00 0.00 72.50 70.31 1xpn s THR 153 CO 0.12 0.52 -0.04 -0.54 -0.69 0.00 0.00 174.62 173.99 1xpn s LYS 154 N 1.15 2.79 -0.79 4.92 1.02 0.22 -4.47 119.74 124.58 1xpn s LYS 154 Ca 0.01 -0.54 -0.25 0.00 0.02 0.00 0.00 55.97 55.22 1xpn s LYS 154 Cb -0.14 -2.64 0.05 0.00 -0.52 0.00 0.00 37.83 34.58 1xpn s LYS 154 CO -0.07 0.66 1.23 -1.17 -0.92 0.00 0.00 175.35 175.09 1xpn s LEU 155 N -0.97 3.63 -0.42 3.17 2.96 -1.26 -1.35 118.68 124.44 1xpn s LEU 155 Ca 0.14 -0.88 -0.17 0.00 -0.22 0.00 0.00 54.13 53.00 1xpn s LEU 155 Cb -0.11 -2.52 0.02 0.00 0.50 0.00 0.00 46.19 44.08 1xpn s LEU 155 CO 0.03 -1.63 0.41 -0.69 -1.32 0.00 0.00 176.35 173.15 1xpn s VAL 156 N 5.01 5.12 -0.49 1.68 1.01 0.35 -4.91 120.40 128.18 1xpn s VAL 156 Ca 0.34 -0.43 -0.18 0.00 0.00 0.00 0.00 61.98 61.71 1xpn s VAL 156 Cb -0.08 -4.03 0.06 0.00 0.00 0.00 0.00 36.38 32.33 1xpn s VAL 156 CO 0.07 -0.41 0.55 0.28 0.00 0.00 0.00 175.10 175.59 1xpn s THR 157 N 2.05 4.98 -1.14 3.92 -1.32 -1.26 -0.44 115.64 122.42 1xpn s THR 157 Ca 0.11 -0.62 -0.18 0.00 -1.21 0.00 0.00 61.69 59.78 1xpn s THR 157 Cb -0.18 -4.23 0.10 0.00 -1.51 0.00 0.00 72.50 66.68 1xpn s THR 157 CO 0.13 -0.71 1.48 -0.69 -2.21 0.00 0.00 174.62 172.62 1xpn s VAL 158 N 2.34 4.41 0.19 5.08 1.01 0.39 -4.78 120.40 129.04 1xpn s VAL 158 Ca 0.12 -1.76 0.01 0.00 0.00 0.00 0.00 61.98 60.35 1xpn s VAL 158 Cb -0.20 -5.02 -0.10 0.00 0.00 0.00 0.00 36.38 31.06 1xpn s VAL 158 CO 0.11 -1.81 1.46 -1.28 0.00 0.00 0.00 175.10 173.57 1xpn h SER 159 N 8.22 0.39 -3.07 3.32 0.87 -1.94 -0.47 113.55 120.87 1xpn h SER 159 Ca 0.30 -0.26 -0.56 0.00 -1.23 0.00 0.00 61.79 60.05 1xpn h SER 159 Cb 0.93 -0.11 -0.16 0.00 -0.44 0.00 0.00 62.40 62.61 1xpn h SER 159 CO 1.33 0.98 -0.77 -0.83 -0.53 0.00 0.00 176.83 177.01 1xpn s GLY 160 N -4.35 1.59 -0.02 5.77 0.00 -1.26 -4.83 107.32 104.22 1xpn s GLY 160 Ca -0.05 -1.65 0.04 0.00 0.00 0.00 0.00 44.72 43.06 1xpn s GLY 160 CO 0.83 -1.72 0.97 -1.14 0.00 0.00 0.00 173.10 172.04 1xpn n SER 161 N -0.08 1.25 -4.91 1.64 3.41 -1.26 -4.69 113.62 108.98 1xpn n SER 161 Ca -0.10 -2.07 -0.27 0.00 -0.26 0.00 0.00 58.87 56.17 1xpn n SER 161 Cb 0.58 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.27 1xpn n SER 161 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1xpn s GLN 162 N -1.63 3.43 -0.20 4.33 -0.21 -1.26 -4.33 119.66 119.79 1xpn s GLN 162 Ca 0.10 0.13 -0.30 0.00 0.02 0.00 0.00 55.36 55.32 1xpn s GLN 162 Cb 0.06 -2.37 -0.07 0.00 1.00 0.00 0.00 33.01 31.63 1xpn s GLN 162 CO 0.05 -0.28 2.17 -2.30 -2.12 0.00 0.00 175.29 172.81 1xpn n PRO 163 N -2.30 1.94 -3.21 2.91 -0.02 -1.26 -4.09 135.00 128.97 1xpn n PRO 163 Ca 0.01 0.57 -0.43 0.00 -2.02 0.00 0.00 63.50 61.63 1xpn n PRO 163 Cb 0.56 -3.05 -0.07 0.00 -0.02 0.00 0.00 33.50 30.91 1xpn n PRO 163 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1xpn s GLN 164 N 5.97 3.13 -0.24 -0.52 -1.52 0.14 -4.94 119.66 121.68 1xpn s GLN 164 Ca 1.00 -0.80 -0.25 0.00 -1.95 0.00 0.00 55.36 53.36 1xpn s GLN 164 Cb -0.45 -4.04 -0.00 0.00 -0.22 0.00 0.00 33.01 28.29 1xpn s GLN 164 CO 0.39 -1.07 0.84 0.21 -0.25 0.00 0.00 175.29 175.41 1xpn s LYS 165 N 2.45 4.18 -0.21 2.91 2.20 -1.26 -0.76 119.74 129.25 1xpn s LYS 165 Ca 0.15 0.96 0.02 0.00 -0.36 0.00 0.00 55.97 56.73 1xpn s LYS 165 Cb -0.18 -3.65 0.04 0.00 -1.51 0.00 0.00 37.83 32.53 1xpn s LYS 165 CO 0.13 -0.53 -0.13 0.08 -0.36 0.00 0.00 175.35 174.54 1xpn s VAL 166 N 2.87 1.91 -0.48 4.02 1.01 0.89 -4.93 120.40 125.68 1xpn s VAL 166 Ca 0.35 -1.18 -0.28 0.00 0.00 0.00 0.00 61.98 60.88 1xpn s VAL 166 Cb -0.15 -1.92 0.03 0.00 0.00 0.00 0.00 36.38 34.34 1xpn s VAL 166 CO 0.07 0.21 1.08 -0.76 0.00 0.00 0.00 175.10 175.70 1xpn s LEU 167 N 1.28 3.73 -0.91 3.92 1.43 -1.26 -1.70 118.68 125.17 1xpn s LEU 167 Ca -0.02 0.32 -0.24 0.00 -1.03 0.00 0.00 54.13 53.16 1xpn s LEU 167 Cb -0.17 -3.41 0.05 0.00 0.03 0.00 0.00 46.19 42.69 1xpn s LEU 167 CO -0.08 -1.22 1.36 -0.22 0.23 0.00 0.00 176.35 176.42 1xpn s LEU 168 N 4.29 3.46 0.00 1.79 1.98 0.81 -4.81 118.68 126.20 1xpn s LEU 168 Ca 0.44 -1.10 0.00 0.00 -2.89 0.00 0.00 54.13 50.58 1xpn s LEU 168 Cb -0.08 -2.56 0.00 0.00 0.66 0.00 0.00 46.19 44.21 1xpn s LEU 168 CO 0.30 -1.61 0.00 1.07 -1.89 0.00 0.00 176.35 174.22 1xpn n THR 169 N 6.63 0.00 1.68 3.68 5.66 -1.26 -0.63 114.28 130.05 1xpn n THR 169 Ca 0.21 0.00 0.15 0.00 -3.05 0.00 0.00 64.05 61.36 1xpn n THR 169 Cb 0.50 0.00 0.68 0.00 -1.55 0.00 0.00 70.33 69.96 1xpn n THR 169 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56