#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xn2 s SER 46 N 0.00 -0.23 -0.42 1.61 0.15 -1.26 -2.31 113.70 111.24 1xn2 s SER 46 Ca 0.00 0.98 0.10 0.00 0.70 0.00 0.00 55.95 57.73 1xn2 s SER 46 Cb 0.00 1.32 0.34 0.00 -1.71 0.00 0.00 66.02 65.97 1xn2 s SER 46 CO 0.00 -0.23 0.78 0.49 1.20 0.00 0.00 173.24 175.48 1xn2 n PHE 47 N 5.38 1.14 0.06 3.44 3.01 -1.26 -4.97 117.46 124.26 1xn2 n PHE 47 Ca -0.08 -3.86 0.21 0.00 1.01 0.00 0.00 57.45 54.73 1xn2 n PHE 47 Cb 0.49 -0.44 0.73 0.00 -0.01 0.00 0.00 39.48 40.26 1xn2 n PHE 47 CO 0.00 0.00 0.00 -0.39 1.01 0.00 0.00 176.76 177.38 1xn2 h VAL 48 N 1.53 0.38 0.00 -4.37 -1.51 -1.97 0.07 116.25 110.38 1xn2 h VAL 48 Ca 0.11 0.00 -0.05 0.00 -1.23 0.00 0.00 66.70 65.53 1xn2 h VAL 48 Cb 0.85 0.62 -0.01 0.00 -2.13 0.00 0.00 31.29 30.63 1xn2 h VAL 48 CO 0.58 0.00 -0.23 1.05 -1.23 0.00 0.00 177.57 177.73 1xn2 h GLU 1 N 0.00 0.00 0.00 5.19 4.11 -1.95 -3.04 114.58 118.89 1xn2 h GLU 1 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.65 1xn2 h GLU 1 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1xn2 h GLU 1 CO -0.00 0.23 -1.20 -1.33 0.07 0.00 0.00 179.01 176.78 1xn2 n MET 2 N -4.10 0.24 -1.76 1.06 2.81 -0.00 -4.69 117.12 110.68 1xn2 n MET 2 Ca -0.02 -0.04 -0.41 0.00 -1.81 0.00 0.00 57.70 55.41 1xn2 n MET 2 Cb 0.30 -1.54 -0.01 0.00 -0.71 0.00 0.00 33.22 31.27 1xn2 n MET 2 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1xn2 n VAL 3 N -1.83 1.70 -2.69 2.03 0.31 -1.12 -2.33 118.33 114.40 1xn2 n VAL 3 Ca 0.02 -0.42 -0.21 0.00 -0.01 0.00 0.00 64.34 63.72 1xn2 n VAL 3 Cb 0.42 -1.93 0.01 0.00 -0.91 0.00 0.00 33.84 31.44 1xn2 n VAL 3 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1xn2 n ASP 4 N 1.00 -5.83 -0.73 4.52 10.43 -1.19 -4.90 116.55 119.86 1xn2 n ASP 4 Ca 0.04 -0.15 0.09 0.00 2.57 0.00 0.00 54.79 57.33 1xn2 n ASP 4 Cb 0.38 -4.75 0.26 0.00 1.84 0.00 0.00 41.12 38.86 1xn2 n ASP 4 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 1xn2 n ASN 5 N -2.07 2.14 -4.60 -2.24 6.94 -0.99 -4.84 115.26 109.61 1xn2 n ASN 5 Ca -0.17 -1.88 -0.25 0.00 -0.02 0.00 0.00 54.58 52.25 1xn2 n ASN 5 Cb 0.65 -0.21 -0.08 0.00 -2.36 0.00 0.00 39.78 37.77 1xn2 n ASN 5 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 1xn2 s LEU 6 N -1.27 3.05 0.10 -4.53 1.43 -0.56 -4.39 118.68 112.52 1xn2 s LEU 6 Ca 0.31 -0.63 -0.02 0.00 -1.03 0.00 0.00 54.13 52.76 1xn2 s LEU 6 Cb 0.17 -1.66 -0.03 0.00 0.03 0.00 0.00 46.19 44.69 1xn2 s LEU 6 CO 0.23 0.06 0.06 -0.13 0.23 0.00 0.00 176.35 176.80 1xn2 s ARG 7 N -3.21 0.84 0.00 1.70 0.52 -0.80 0.56 118.95 118.55 1xn2 s ARG 7 Ca 0.28 -1.30 0.00 0.00 -0.52 0.00 0.00 55.73 54.19 1xn2 s ARG 7 Cb -0.08 0.25 0.00 0.00 0.52 0.00 0.00 34.95 35.65 1xn2 s ARG 7 CO 0.17 -0.23 0.00 0.41 0.02 0.00 0.00 175.30 175.67 1xn2 n GLY 8 N -0.04 0.30 3.53 -3.53 0.00 -1.26 -0.22 105.19 103.98 1xn2 n GLY 8 Ca -0.09 -2.29 -0.09 0.00 0.00 0.00 0.00 46.02 43.54 1xn2 n GLY 8 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xn2 s LYS 9 N -0.08 1.40 0.28 1.61 -2.85 -1.05 -4.67 119.74 114.39 1xn2 s LYS 9 Ca 0.00 -0.90 0.01 0.00 -1.00 0.00 0.00 55.97 54.08 1xn2 s LYS 9 Cb 0.00 0.52 0.54 0.00 -2.06 0.00 0.00 37.83 36.83 1xn2 s LYS 9 CO 0.00 -0.59 1.84 0.66 0.10 0.00 0.00 175.35 177.35 1xn2 h SER 10 N 2.20 0.93 0.36 0.03 4.64 -1.93 0.16 113.55 119.94 1xn2 h SER 10 Ca -0.28 0.05 -0.07 0.00 -0.47 0.00 0.00 61.79 61.01 1xn2 h SER 10 Cb 1.26 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 63.20 1xn2 h SER 10 CO 0.37 0.50 -0.34 1.23 -0.87 0.00 0.00 176.83 177.72 1xn2 h GLY 11 N 1.00 0.00 -0.20 -0.77 0.00 -1.96 -3.29 103.07 97.85 1xn2 h GLY 11 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.82 1xn2 h GLY 11 CO -0.26 0.00 -0.11 -1.06 0.00 0.00 0.00 176.54 175.11 1xn2 n GLN 12 N -4.10 2.74 0.00 4.80 6.02 -1.05 -4.95 117.38 120.83 1xn2 n GLN 12 Ca -0.02 -0.39 0.00 0.00 -0.01 0.00 0.00 57.00 56.58 1xn2 n GLN 12 Cb 0.38 -0.90 0.00 0.00 1.02 0.00 0.00 30.24 30.74 1xn2 n GLN 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xn2 n GLY 13 N 0.72 1.64 3.59 1.08 0.00 0.54 -4.90 105.19 107.86 1xn2 n GLY 13 Ca 0.02 -1.86 -0.34 0.00 0.00 0.00 0.00 46.02 43.84 1xn2 n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1xn2 s TYR 14 N -2.93 3.07 0.14 1.61 1.51 -1.26 -2.51 117.35 116.99 1xn2 s TYR 14 Ca 0.00 -0.02 0.05 0.00 -1.01 0.00 0.00 57.07 56.09 1xn2 s TYR 14 Cb 0.00 -1.85 -0.04 0.00 -0.11 0.00 0.00 41.96 39.96 1xn2 s TYR 14 CO 0.00 0.24 -0.12 1.52 -1.11 0.00 0.00 175.55 176.08 1xn2 s TYR 15 N -0.34 1.37 0.15 2.71 -0.85 0.69 -1.06 117.35 120.02 1xn2 s TYR 15 Ca 0.06 -0.65 0.10 0.00 -0.52 0.00 0.00 57.07 56.06 1xn2 s TYR 15 Cb -0.12 -0.69 -0.04 0.00 0.38 0.00 0.00 41.96 41.48 1xn2 s TYR 15 CO 0.02 0.14 -0.24 0.54 -1.52 0.00 0.00 175.55 174.50 1xn2 s VAL 16 N -2.81 2.16 0.09 -3.49 0.11 -0.02 -1.91 120.40 114.53 1xn2 s VAL 16 Ca 0.14 -1.84 -0.26 0.00 -2.93 0.00 0.00 61.98 57.09 1xn2 s VAL 16 Cb -0.01 -1.96 -0.06 0.00 -1.53 0.00 0.00 36.38 32.82 1xn2 s VAL 16 CO 0.02 -0.05 0.81 -0.70 -3.33 0.00 0.00 175.10 171.85 1xn2 s GLU 17 N -2.34 4.56 0.13 1.54 2.12 -1.26 -0.66 118.70 122.78 1xn2 s GLU 17 Ca 0.15 1.16 -0.00 0.00 0.36 0.00 0.00 54.97 56.65 1xn2 s GLU 17 Cb -0.09 -3.34 -0.04 0.00 0.26 0.00 0.00 34.13 30.92 1xn2 s GLU 17 CO 0.07 0.35 0.02 -1.64 -0.54 0.00 0.00 175.26 173.51 1xn2 s MET 18 N -0.34 0.91 0.01 4.30 -1.94 0.41 -4.07 119.30 118.59 1xn2 s MET 18 Ca 0.39 -1.42 0.05 0.00 -1.71 0.00 0.00 55.69 53.01 1xn2 s MET 18 Cb -0.22 0.06 -0.02 0.00 2.01 0.00 0.00 34.83 36.66 1xn2 s MET 18 CO 0.25 -0.18 -0.16 0.95 -0.01 0.00 0.00 175.02 175.87 1xn2 s THR 19 N -3.88 1.30 0.05 2.05 -4.23 -0.21 -0.42 115.64 110.29 1xn2 s THR 19 Ca 0.20 -0.88 0.05 0.00 -1.18 0.00 0.00 61.69 59.88 1xn2 s THR 19 Cb 0.07 -1.12 -0.02 0.00 1.34 0.00 0.00 72.50 72.77 1xn2 s THR 19 CO -0.00 0.22 -0.14 0.68 -0.54 0.00 0.00 174.62 174.84 1xn2 s VAL 20 N -0.60 1.13 0.00 2.29 -7.23 -0.03 -1.38 120.40 114.58 1xn2 s VAL 20 Ca 0.05 -1.09 0.00 0.00 -1.81 0.00 0.00 61.98 59.13 1xn2 s VAL 20 Cb -0.07 -1.04 0.00 0.00 0.56 0.00 0.00 36.38 35.83 1xn2 s VAL 20 CO 0.00 -0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.35 1xn2 n GLY 21 N 1.73 -1.50 2.79 2.32 0.00 -0.21 -0.49 105.19 109.82 1xn2 n GLY 21 Ca -0.19 -1.52 -0.24 0.00 0.00 0.00 0.00 46.02 44.07 1xn2 n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xn2 s SER 22 N -3.04 1.83 0.86 1.61 0.01 -1.26 -2.74 113.70 110.96 1xn2 s SER 22 Ca 0.00 -0.20 -0.10 0.00 1.31 0.00 0.00 55.95 56.96 1xn2 s SER 22 Cb 0.00 -0.52 0.11 0.00 0.21 0.00 0.00 66.02 65.82 1xn2 s SER 22 CO 0.00 -0.19 1.12 -2.16 0.41 0.00 0.00 173.24 172.42 1xn2 s PRO 23 N 1.92 1.52 0.20 12.44 0.04 -1.26 -1.13 135.00 148.73 1xn2 s PRO 23 Ca 0.04 1.39 -0.32 0.00 0.04 0.00 0.00 61.00 62.15 1xn2 s PRO 23 Cb -0.13 -1.80 -0.13 0.00 0.04 0.00 0.00 34.50 32.49 1xn2 s PRO 23 CO -0.06 -2.23 1.67 -2.30 0.04 0.00 0.00 177.00 174.12 1xn2 n PRO 24 N -3.95 2.59 -3.76 0.56 -0.02 -1.11 -4.91 135.00 124.40 1xn2 n PRO 24 Ca 0.11 0.93 -0.37 0.00 -2.02 0.00 0.00 63.50 62.16 1xn2 n PRO 24 Cb 0.52 -2.75 -0.13 0.00 -0.02 0.00 0.00 33.50 31.13 1xn2 n PRO 24 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1xn2 s GLN 25 N 0.94 3.53 0.05 -0.52 -0.21 0.35 -4.87 119.66 118.94 1xn2 s GLN 25 Ca 0.75 -0.56 -0.30 0.00 0.02 0.00 0.00 55.36 55.27 1xn2 s GLN 25 Cb -0.55 -3.31 -0.05 0.00 1.00 0.00 0.00 33.01 30.10 1xn2 s GLN 25 CO 0.35 -0.24 1.02 0.99 -2.12 0.00 0.00 175.29 175.30 1xn2 s THR 26 N 1.58 4.54 -0.01 -0.19 2.01 -1.26 -0.85 115.64 121.46 1xn2 s THR 26 Ca 0.06 1.92 -0.04 0.00 0.31 0.00 0.00 61.69 63.94 1xn2 s THR 26 Cb -0.15 -4.23 0.00 0.00 0.01 0.00 0.00 72.50 68.13 1xn2 s THR 26 CO 0.03 0.20 0.08 -0.76 -0.69 0.00 0.00 174.62 173.48 1xn2 s LEU 27 N 0.64 1.75 -0.19 4.42 1.43 0.44 -4.95 118.68 122.22 1xn2 s LEU 27 Ca 0.52 -0.08 -0.15 0.00 -1.03 0.00 0.00 54.13 53.39 1xn2 s LEU 27 Cb -0.24 0.37 -0.04 0.00 0.03 0.00 0.00 46.19 46.31 1xn2 s LEU 27 CO 0.29 -0.19 0.36 0.20 0.23 0.00 0.00 176.35 177.25 1xn2 s ASN 28 N -0.69 6.42 -0.12 2.29 0.02 -1.26 -0.44 114.94 121.15 1xn2 s ASN 28 Ca -0.08 0.49 0.03 0.00 -1.02 0.00 0.00 52.86 52.28 1xn2 s ASN 28 Cb -0.05 -2.21 0.01 0.00 0.02 0.00 0.00 41.25 39.02 1xn2 s ASN 28 CO 0.00 -0.03 -0.21 -0.63 0.02 0.00 0.00 177.10 176.26 1xn2 s ILE 29 N 1.10 1.92 0.25 0.60 -1.09 0.16 -0.38 121.20 123.76 1xn2 s ILE 29 Ca 0.18 -0.91 -0.30 0.00 -2.23 0.00 0.00 60.65 57.39 1xn2 s ILE 29 Cb -0.14 -1.70 -0.10 0.00 -1.58 0.00 0.00 42.46 38.94 1xn2 s ILE 29 CO 0.07 0.53 1.37 -0.22 -1.23 0.00 0.00 174.94 175.45 1xn2 s LEU 30 N 0.76 4.41 -0.33 2.97 0.20 -0.27 -0.84 118.68 125.57 1xn2 s LEU 30 Ca -0.09 2.59 -0.20 0.00 0.69 0.00 0.00 54.13 57.12 1xn2 s LEU 30 Cb -0.16 -3.63 -0.00 0.00 -0.43 0.00 0.00 46.19 41.97 1xn2 s LEU 30 CO 0.00 -0.61 0.60 -0.69 -0.29 0.00 0.00 176.35 175.36 1xn2 s VAL 31 N -0.25 4.94 -0.30 1.68 1.01 -0.22 -0.38 120.40 126.89 1xn2 s VAL 31 Ca 0.56 0.62 0.01 0.00 0.00 0.00 0.00 61.98 63.17 1xn2 s VAL 31 Cb -0.40 -4.01 0.09 0.00 0.00 0.00 0.00 36.38 32.06 1xn2 s VAL 31 CO 0.44 -0.21 0.05 -0.62 0.00 0.00 0.00 175.10 174.75 1xn2 s ASP 32 N 1.73 4.15 0.00 3.32 2.15 -0.70 -3.99 116.67 123.33 1xn2 s ASP 32 Ca 0.23 -1.64 0.30 0.00 0.43 0.00 0.00 52.55 51.87 1xn2 s ASP 32 Cb -0.15 -1.14 1.57 0.00 -0.30 0.00 0.00 42.92 42.90 1xn2 s ASP 32 CO 0.13 -0.36 2.05 0.35 -0.17 0.00 0.00 175.17 177.17 1xn2 n THR 33 N 4.65 0.00 0.78 1.71 -2.24 -1.26 -0.61 114.28 117.30 1xn2 n THR 33 Ca -0.03 -0.06 0.10 0.00 -2.27 0.00 0.00 64.05 61.80 1xn2 n THR 33 Cb 0.43 -0.25 0.28 0.00 -2.10 0.00 0.00 70.33 68.70 1xn2 n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xn2 n GLY 34 N 1.12 0.94 3.40 3.38 0.00 -1.26 -4.03 105.19 108.73 1xn2 n GLY 34 Ca 0.20 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.56 1xn2 n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xn2 s SER 35 N -1.39 0.53 -0.01 1.61 1.04 -1.23 -4.97 113.70 109.28 1xn2 s SER 35 Ca 0.34 -1.35 0.02 0.00 0.48 0.00 0.00 55.95 55.43 1xn2 s SER 35 Cb 0.19 0.54 0.03 0.00 0.10 0.00 0.00 66.02 66.88 1xn2 s SER 35 CO 0.26 -1.09 0.82 -1.20 0.98 0.00 0.00 173.24 173.02 1xn2 n SER 36 N -0.82 1.04 -4.59 7.02 7.64 -1.26 -0.46 113.62 122.19 1xn2 n SER 36 Ca 0.02 -1.71 -0.34 0.00 1.01 0.00 0.00 58.87 57.84 1xn2 n SER 36 Cb 0.63 -0.06 -0.11 0.00 -1.01 0.00 0.00 64.21 63.66 1xn2 n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1xn2 s ASN 37 N -0.80 4.94 -0.26 6.43 -0.87 -1.26 -4.50 114.94 118.63 1xn2 s ASN 37 Ca 0.03 0.00 -0.16 0.00 -1.57 0.00 0.00 52.86 51.17 1xn2 s ASN 37 Cb 0.03 -1.52 -0.03 0.00 -0.02 0.00 0.00 41.25 39.70 1xn2 s ASN 37 CO 0.00 0.29 0.41 0.12 -2.57 0.00 0.00 177.10 175.36 1xn2 s PHE 38 N -0.37 3.26 -0.02 2.20 5.99 -1.26 -1.97 117.98 125.82 1xn2 s PHE 38 Ca 0.06 0.49 -0.05 0.00 0.00 0.00 0.00 56.93 57.44 1xn2 s PHE 38 Cb -0.12 -2.61 0.00 0.00 0.00 0.00 0.00 43.02 40.29 1xn2 s PHE 38 CO 0.02 -0.22 0.11 0.00 -0.00 0.00 0.00 175.22 175.13 1xn2 s ALA 39 N 2.06 -0.26 0.01 11.12 0.00 -0.36 -1.34 121.76 132.98 1xn2 s ALA 39 Ca 0.17 0.06 0.01 0.00 0.00 0.00 0.00 51.96 52.20 1xn2 s ALA 39 Cb -0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 22.90 1xn2 s ALA 39 CO 0.09 -0.12 -0.04 0.14 0.00 0.00 0.00 175.76 175.84 1xn2 s VAL 40 N -0.63 0.24 0.25 0.00 -7.23 -0.39 0.65 120.40 113.28 1xn2 s VAL 40 Ca -0.07 -0.47 -0.31 0.00 -1.81 0.00 0.00 61.98 59.32 1xn2 s VAL 40 Cb -0.04 -0.27 -0.13 0.00 0.56 0.00 0.00 36.38 36.50 1xn2 s VAL 40 CO 0.01 -0.16 1.53 0.61 -0.31 0.00 0.00 175.10 176.78 1xn2 n GLY 41 N 2.40 1.10 0.08 2.32 0.00 0.95 -0.76 105.19 111.30 1xn2 n GLY 41 Ca -0.17 0.52 0.03 0.00 0.00 0.00 0.00 46.02 46.40 1xn2 n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xn2 n ALA 42 N 2.39 1.92 -2.94 4.61 0.00 -0.49 -0.71 120.51 125.30 1xn2 n ALA 42 Ca 0.12 -1.43 -0.09 0.00 0.00 0.00 0.00 53.44 52.03 1xn2 n ALA 42 Cb 0.33 -0.18 -0.06 0.00 0.00 0.00 0.00 19.45 19.55 1xn2 n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xn2 s ALA 43 N -1.30 -0.35 0.60 0.00 0.00 -1.25 -4.73 121.76 114.73 1xn2 s ALA 43 Ca 0.10 -0.64 -0.18 0.00 0.00 0.00 0.00 51.96 51.24 1xn2 s ALA 43 Cb 0.09 0.86 -0.03 0.00 0.00 0.00 0.00 23.12 24.03 1xn2 s ALA 43 CO 0.01 -0.71 1.17 -1.25 0.00 0.00 0.00 175.76 174.99 1xn2 s PRO 44 N -3.93 2.98 -0.06 0.00 0.04 -1.26 -4.89 135.00 127.88 1xn2 s PRO 44 Ca 0.14 1.71 -0.16 0.00 0.04 0.00 0.00 61.00 62.73 1xn2 s PRO 44 Cb 0.02 -1.94 0.03 0.00 0.04 0.00 0.00 34.50 32.64 1xn2 s PRO 44 CO -0.01 -1.17 0.37 -1.58 0.04 0.00 0.00 177.00 174.65 1xn2 s HIS 45 N -1.77 -0.30 0.52 0.56 2.46 -1.26 -5.04 115.29 110.46 1xn2 s HIS 45 Ca 0.75 0.59 0.26 0.00 0.47 0.00 0.00 55.06 57.13 1xn2 s HIS 45 Cb -0.27 0.14 1.39 0.00 -0.13 0.00 0.00 32.58 33.71 1xn2 s HIS 45 CO 0.33 -0.35 1.96 -1.35 -2.47 0.00 0.00 174.74 172.87 1xn2 h PRO 46 N 4.34 0.04 -0.02 2.88 0.11 -2.03 -2.19 132.00 135.12 1xn2 h PRO 46 Ca -0.28 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1xn2 h PRO 46 Cb 1.18 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1xn2 h PRO 46 CO 0.35 0.02 -0.08 1.19 -0.21 0.00 0.00 178.00 179.28 1xn2 n PHE 47 N -4.36 0.00 -4.00 0.65 0.99 -1.26 -4.91 117.46 104.57 1xn2 n PHE 47 Ca 0.13 0.00 -0.35 0.00 -0.00 0.00 0.00 57.45 57.23 1xn2 n PHE 47 Cb 0.70 -0.01 -0.10 0.00 -1.00 0.00 0.00 39.48 39.06 1xn2 n PHE 47 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1xn2 s LEU 48 N -2.09 3.73 0.09 4.37 1.43 -0.82 -4.63 118.68 120.75 1xn2 s LEU 48 Ca 0.30 0.03 0.11 0.00 -1.03 0.00 0.00 54.13 53.54 1xn2 s LEU 48 Cb 0.20 -1.95 -0.16 0.00 0.03 0.00 0.00 46.19 44.31 1xn2 s LEU 48 CO 0.36 0.15 1.07 0.45 0.23 0.00 0.00 176.35 178.60 1xn2 h HIS 49 N 6.90 0.00 -4.10 0.29 3.86 -1.91 -3.42 115.15 116.77 1xn2 h HIS 49 Ca -0.36 0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 58.70 1xn2 h HIS 49 Cb 1.17 0.00 -0.12 0.00 1.06 0.00 0.00 27.41 29.52 1xn2 h HIS 49 CO 0.58 0.87 -0.39 -0.98 0.86 0.00 0.00 177.93 178.87 1xn2 s ARG 50 N -2.74 1.28 0.20 2.45 1.70 -1.26 -5.12 118.95 115.45 1xn2 s ARG 50 Ca -0.01 -1.38 -0.23 0.00 -0.47 0.00 0.00 55.73 53.64 1xn2 s ARG 50 Cb 0.09 0.36 0.05 0.00 -0.57 0.00 0.00 34.95 34.88 1xn2 s ARG 50 CO 0.81 -0.47 0.72 1.52 -1.08 0.00 0.00 175.30 176.80 1xn2 s TYR 51 N -4.06 -0.33 -0.13 5.89 -0.85 -1.26 -4.91 117.35 111.71 1xn2 s TYR 51 Ca 0.27 0.01 -0.29 0.00 -0.52 0.00 0.00 57.07 56.53 1xn2 s TYR 51 Cb 0.04 0.63 -0.04 0.00 0.38 0.00 0.00 41.96 42.97 1xn2 s TYR 51 CO 0.07 -0.99 1.55 -0.47 -1.52 0.00 0.00 175.55 174.19 1xn2 s TYR 52 N -3.72 2.23 -0.68 -3.49 5.04 0.11 -4.95 117.35 111.89 1xn2 s TYR 52 Ca 0.07 0.49 -0.11 0.00 -2.44 0.00 0.00 57.07 55.08 1xn2 s TYR 52 Cb -0.03 -3.83 0.18 0.00 0.35 0.00 0.00 41.96 38.62 1xn2 s TYR 52 CO -0.02 -3.06 0.59 -0.65 -1.34 0.00 0.00 175.55 171.06 1xn2 s GLN 53 N 4.08 3.11 0.31 4.97 -0.21 -1.26 -4.43 119.66 126.23 1xn2 s GLN 53 Ca 0.68 -2.23 0.01 0.00 0.02 0.00 0.00 55.36 53.84 1xn2 s GLN 53 Cb -0.28 -4.19 0.55 0.00 1.00 0.00 0.00 33.01 30.09 1xn2 s GLN 53 CO 0.26 -1.26 1.91 0.00 -2.12 0.00 0.00 175.29 174.08 1xn2 h ARG 54 N 7.94 0.97 0.00 2.91 3.08 -1.93 -1.89 114.38 125.47 1xn2 h ARG 54 Ca -0.04 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 59.95 1xn2 h ARG 54 Cb 1.04 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 30.87 1xn2 h ARG 54 CO 0.81 0.64 0.00 1.96 -1.07 0.00 0.00 179.97 182.32 1xn2 h GLN 55 N 1.00 0.00 -0.12 0.04 4.20 -2.00 -1.62 115.11 116.62 1xn2 h GLN 55 Ca 0.39 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.10 1xn2 h GLN 55 Cb 0.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.00 1xn2 h GLN 55 CO -0.15 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.29 1xn2 n LEU 56 N -3.01 2.69 -4.46 1.46 4.77 -0.71 -4.85 117.00 112.89 1xn2 n LEU 56 Ca -0.02 -0.98 -0.36 0.00 -0.03 0.00 0.00 56.01 54.62 1xn2 n LEU 56 Cb 0.12 -0.06 -0.12 0.00 -2.33 0.00 0.00 43.42 41.02 1xn2 n LEU 56 CO 0.21 0.49 -0.28 -0.55 -1.33 0.00 0.00 177.39 175.92 1xn2 s SER 57 N -1.85 5.12 0.30 -1.43 0.15 -0.61 -4.32 113.70 111.06 1xn2 s SER 57 Ca 0.33 -0.19 0.26 0.00 0.70 0.00 0.00 55.95 57.04 1xn2 s SER 57 Cb 0.21 -1.91 0.97 0.00 -1.71 0.00 0.00 66.02 63.57 1xn2 s SER 57 CO 0.31 -0.01 1.76 0.77 1.20 0.00 0.00 173.24 177.27 1xn2 h SER 58 N 8.07 0.00 -0.21 5.45 4.64 -1.42 -3.06 113.55 127.02 1xn2 h SER 58 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 1xn2 h SER 58 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1xn2 h SER 58 CO 0.59 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.90 1xn2 n THR 59 N -2.42 0.33 -2.00 2.95 -2.24 -1.26 -4.98 114.28 104.66 1xn2 n THR 59 Ca 0.03 -0.67 -0.41 0.00 -2.27 0.00 0.00 64.05 60.73 1xn2 n THR 59 Cb 0.30 1.10 -0.02 0.00 -2.10 0.00 0.00 70.33 69.62 1xn2 n THR 59 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1xn2 s TYR 60 N -1.39 2.93 -0.13 4.78 5.04 -1.16 -4.47 117.35 122.95 1xn2 s TYR 60 Ca 0.28 1.20 -0.00 0.00 -2.44 0.00 0.00 57.07 56.10 1xn2 s TYR 60 Cb 0.17 -3.82 0.03 0.00 0.35 0.00 0.00 41.96 38.69 1xn2 s TYR 60 CO 0.25 -2.46 -0.09 1.03 -1.34 0.00 0.00 175.55 172.93 1xn2 s ARG 61 N -1.30 1.73 -0.29 4.97 0.52 0.01 -4.98 118.95 119.63 1xn2 s ARG 61 Ca 0.54 -0.39 -0.26 0.00 -0.52 0.00 0.00 55.73 55.10 1xn2 s ARG 61 Cb -0.42 -1.81 0.01 0.00 0.52 0.00 0.00 34.95 33.24 1xn2 s ARG 61 CO 0.51 -0.29 0.90 0.34 0.02 0.00 0.00 175.30 176.79 1xn2 s ASP 62 N 1.63 6.81 0.00 0.23 -1.08 -1.26 -0.52 116.67 122.48 1xn2 s ASP 62 Ca 0.04 0.91 0.30 0.00 -0.52 0.00 0.00 52.55 53.28 1xn2 s ASP 62 Cb -0.13 -2.46 1.47 0.00 -1.46 0.00 0.00 42.92 40.33 1xn2 s ASP 62 CO -0.09 -0.68 1.99 0.18 0.52 0.00 0.00 175.17 177.10 1xn2 n LEU 63 N 6.36 0.44 -3.98 -1.34 4.77 -0.69 -4.95 117.00 117.62 1xn2 n LEU 63 Ca 0.07 -0.06 -0.28 0.00 -0.03 0.00 0.00 56.01 55.71 1xn2 n LEU 63 Cb 0.47 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.46 1xn2 n LEU 63 CO 0.52 0.08 -0.11 0.54 -1.33 0.00 0.00 177.39 177.09 1xn2 n ARG 64 N -0.79 -3.85 -3.77 3.23 1.74 -1.25 -4.98 116.66 106.99 1xn2 n ARG 64 Ca 0.19 0.46 -0.13 0.00 -0.77 0.00 0.00 57.85 57.60 1xn2 n ARG 64 Cb 0.23 -4.91 -0.13 0.00 -1.02 0.00 0.00 32.46 26.63 1xn2 n ARG 64 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 1xn2 s LYS 65 N -6.58 0.18 0.70 5.56 2.20 -1.26 -5.05 119.74 115.49 1xn2 s LYS 65 Ca 0.28 0.38 -0.09 0.00 -0.36 0.00 0.00 55.97 56.18 1xn2 s LYS 65 Cb -0.15 -0.05 0.04 0.00 -1.51 0.00 0.00 37.83 36.16 1xn2 s LYS 65 CO 0.88 -0.11 1.05 0.20 -0.36 0.00 0.00 175.35 177.01 1xn2 s GLY 66 N 0.77 1.62 -0.13 5.54 0.00 -1.26 -1.05 107.32 112.81 1xn2 s GLY 66 Ca -0.06 -0.60 -0.19 0.00 0.00 0.00 0.00 44.72 43.88 1xn2 s GLY 66 CO -0.04 -0.22 0.49 0.54 0.00 0.00 0.00 173.10 173.87 1xn2 s VAL 67 N -3.30 0.01 -0.03 1.40 0.11 -0.65 -4.79 120.40 113.15 1xn2 s VAL 67 Ca 0.58 -0.10 0.01 0.00 -2.93 0.00 0.00 61.98 59.54 1xn2 s VAL 67 Cb -0.11 -0.73 0.02 0.00 -1.53 0.00 0.00 36.38 34.03 1xn2 s VAL 67 CO 0.48 -0.06 -0.01 -0.47 -3.33 0.00 0.00 175.10 171.72 1xn2 s TYR 68 N -0.31 0.38 -0.17 1.54 5.04 -1.26 -0.77 117.35 121.80 1xn2 s TYR 68 Ca -0.05 -0.04 -0.01 0.00 -2.44 0.00 0.00 57.07 54.54 1xn2 s TYR 68 Cb -0.03 -0.43 0.04 0.00 0.35 0.00 0.00 41.96 41.89 1xn2 s TYR 68 CO 0.03 -0.12 -0.04 0.08 -1.34 0.00 0.00 175.55 174.16 1xn2 s VAL 69 N 0.88 1.04 -0.11 3.14 1.01 -0.53 -4.87 120.40 120.96 1xn2 s VAL 69 Ca -0.09 -0.64 -0.06 0.00 0.00 0.00 0.00 61.98 61.19 1xn2 s VAL 69 Cb -0.13 -1.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1xn2 s VAL 69 CO -0.01 0.08 0.12 -2.16 0.00 0.00 0.00 175.10 173.12 1xn2 s PRO 70 N 1.65 3.37 0.51 2.72 0.04 -1.26 -2.18 135.00 139.85 1xn2 s PRO 70 Ca 0.00 -0.18 0.02 0.00 0.04 0.00 0.00 61.00 60.89 1xn2 s PRO 70 Cb -0.16 -3.13 -0.01 0.00 0.04 0.00 0.00 34.50 31.25 1xn2 s PRO 70 CO -0.07 0.76 0.08 0.71 0.04 0.00 0.00 177.00 178.52 1xn2 s TYR 71 N -1.02 1.88 0.21 0.56 2.02 0.21 -5.00 117.35 116.20 1xn2 s TYR 71 Ca 0.15 -0.91 -0.09 0.00 -0.37 0.00 0.00 57.07 55.85 1xn2 s TYR 71 Cb -0.12 -1.68 0.30 0.00 -0.40 0.00 0.00 41.96 40.05 1xn2 s TYR 71 CO 0.04 0.12 1.72 1.15 -1.57 0.00 0.00 175.55 177.01 1xn2 h THR 72 N 1.27 0.70 -3.26 -0.71 2.02 -2.00 -3.37 112.91 107.56 1xn2 h THR 72 Ca -0.43 -0.12 -0.44 0.00 0.77 0.00 0.00 66.41 66.20 1xn2 h THR 72 Cb 1.31 0.34 -0.38 0.00 -1.74 0.00 0.00 68.15 67.67 1xn2 h THR 72 CO 0.71 0.06 -0.77 -1.10 0.37 0.00 0.00 175.52 174.80 1xn2 s GLN 73 N -6.09 0.65 0.00 6.66 -1.52 -1.26 -5.09 119.66 113.00 1xn2 s GLN 73 Ca -0.13 0.09 0.00 0.00 -1.95 0.00 0.00 55.36 53.37 1xn2 s GLN 73 Cb 0.18 -0.99 0.00 0.00 -0.22 0.00 0.00 33.01 31.98 1xn2 s GLN 73 CO 0.74 -0.29 0.00 0.41 -0.25 0.00 0.00 175.29 175.90 1xn2 n GLY 74 N 5.10 2.53 3.45 3.09 0.00 -1.25 -4.85 105.19 113.26 1xn2 n GLY 74 Ca -0.08 -1.77 -0.11 0.00 0.00 0.00 0.00 46.02 44.06 1xn2 n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xn2 s LYS 75 N -3.83 1.16 0.15 1.61 -2.85 -0.41 -0.62 119.74 114.95 1xn2 s LYS 75 Ca 0.00 -0.43 -0.18 0.00 -1.00 0.00 0.00 55.97 54.36 1xn2 s LYS 75 Cb 0.00 0.53 0.04 0.00 -2.06 0.00 0.00 37.83 36.34 1xn2 s LYS 75 CO 0.00 -0.51 0.47 1.67 0.10 0.00 0.00 175.35 177.08 1xn2 s TRP 76 N -3.58 -0.27 0.06 1.78 1.48 -0.93 -0.59 118.94 116.89 1xn2 s TRP 76 Ca 0.02 -0.03 0.05 0.00 -1.06 0.00 0.00 56.10 55.08 1xn2 s TRP 76 Cb -0.01 0.35 -0.03 0.00 -1.16 0.00 0.00 33.47 32.62 1xn2 s TRP 76 CO -0.12 -0.77 -0.15 -1.21 -4.06 0.00 0.00 176.95 170.64 1xn2 s GLU 77 N -3.80 0.91 0.00 3.25 2.02 -0.10 -1.45 118.70 119.52 1xn2 s GLU 77 Ca 0.04 -0.88 0.00 0.00 0.02 0.00 0.00 54.97 54.14 1xn2 s GLU 77 Cb 0.01 -0.94 0.00 0.00 0.10 0.00 0.00 34.13 33.30 1xn2 s GLU 77 CO -0.11 0.22 0.00 0.41 0.02 0.00 0.00 175.26 175.80 1xn2 n GLY 78 N 1.56 2.18 3.12 -1.39 0.00 0.05 -1.17 105.19 109.53 1xn2 n GLY 78 Ca -0.20 -0.88 -0.29 0.00 0.00 0.00 0.00 46.02 44.66 1xn2 n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xn2 s GLU 79 N -0.75 2.41 0.35 1.61 2.02 -0.49 -1.64 118.70 122.21 1xn2 s GLU 79 Ca 0.00 -0.65 -0.25 0.00 0.02 0.00 0.00 54.97 54.08 1xn2 s GLU 79 Cb 0.00 -1.90 -0.10 0.00 0.10 0.00 0.00 34.13 32.23 1xn2 s GLU 79 CO 0.00 0.07 1.00 -0.51 0.02 0.00 0.00 175.26 175.84 1xn2 s LEU 80 N 0.59 4.27 0.27 1.80 1.43 -0.22 -0.78 118.68 126.04 1xn2 s LEU 80 Ca -0.15 1.94 -0.19 0.00 -1.03 0.00 0.00 54.13 54.70 1xn2 s LEU 80 Cb -0.17 -4.07 0.07 0.00 0.03 0.00 0.00 46.19 42.06 1xn2 s LEU 80 CO 0.05 -0.25 0.94 -0.83 0.23 0.00 0.00 176.35 176.49 1xn2 s GLY 81 N -1.56 0.24 0.14 -3.19 0.00 -0.60 -1.71 107.32 100.64 1xn2 s GLY 81 Ca 0.53 -0.53 0.04 0.00 0.00 0.00 0.00 44.72 44.77 1xn2 s GLY 81 CO 0.26 1.40 -0.10 -0.51 0.00 0.00 0.00 173.10 174.15 1xn2 s THR 82 N -2.17 1.16 0.13 0.90 -4.23 0.32 -0.62 115.64 111.13 1xn2 s THR 82 Ca 0.20 -2.00 -0.26 0.00 -1.18 0.00 0.00 61.69 58.45 1xn2 s THR 82 Cb -0.04 -1.78 0.07 0.00 1.34 0.00 0.00 72.50 72.09 1xn2 s THR 82 CO 0.08 -0.71 0.97 -0.62 -0.54 0.00 0.00 174.62 173.80 1xn2 s ASP 83 N -3.05 -0.19 0.18 3.99 -1.08 -1.04 -0.81 116.67 114.68 1xn2 s ASP 83 Ca 0.15 -0.36 -0.29 0.00 -0.52 0.00 0.00 52.55 51.53 1xn2 s ASP 83 Cb 0.01 0.47 -0.08 0.00 -1.46 0.00 0.00 42.92 41.86 1xn2 s ASP 83 CO 0.01 -0.85 0.92 -0.76 0.52 0.00 0.00 175.17 175.01 1xn2 s LEU 84 N -2.90 4.59 0.00 -1.34 1.43 -1.26 -1.97 118.68 117.23 1xn2 s LEU 84 Ca 0.12 1.85 0.02 0.00 -1.03 0.00 0.00 54.13 55.09 1xn2 s LEU 84 Cb -0.01 -3.55 -0.01 0.00 0.03 0.00 0.00 46.19 42.65 1xn2 s LEU 84 CO 0.01 0.09 -0.08 -0.69 0.23 0.00 0.00 176.35 175.91 1xn2 s VAL 85 N -0.76 0.63 0.12 -1.59 1.01 -0.16 -1.05 120.40 118.60 1xn2 s VAL 85 Ca 0.42 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.99 1xn2 s VAL 85 Cb -0.25 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.54 1xn2 s VAL 85 CO 0.30 0.11 -0.06 -0.44 0.00 0.00 0.00 175.10 175.01 1xn2 s SER 86 N -0.36 1.31 -0.33 3.32 0.01 -0.48 -1.58 113.70 115.59 1xn2 s SER 86 Ca 0.02 -1.04 0.01 0.00 1.31 0.00 0.00 55.95 56.25 1xn2 s SER 86 Cb -0.04 0.08 0.10 0.00 0.21 0.00 0.00 66.02 66.37 1xn2 s SER 86 CO -0.00 -0.46 0.09 -0.63 0.41 0.00 0.00 173.24 172.65 1xn2 s ILE 87 N -3.56 1.43 0.29 1.44 1.01 -1.26 -1.05 121.20 119.50 1xn2 s ILE 87 Ca 0.15 -1.82 0.02 0.00 0.00 0.00 0.00 60.65 59.01 1xn2 s ILE 87 Cb 0.05 -2.07 0.31 0.00 0.01 0.00 0.00 42.46 40.76 1xn2 s ILE 87 CO -0.02 -0.66 1.65 -0.65 0.00 0.00 0.00 174.94 175.26 1xn2 h PRO 88 N 7.84 0.21 -1.58 2.79 0.11 -1.89 -0.60 132.00 138.87 1xn2 h PRO 88 Ca -0.10 -0.01 -0.68 0.00 0.11 0.00 0.00 66.00 65.32 1xn2 h PRO 88 Cb 1.01 -0.05 -0.34 0.00 0.11 0.00 0.00 31.00 31.74 1xn2 h PRO 88 CO 0.49 0.14 0.30 0.72 -0.21 0.00 0.00 178.00 179.44 1xn2 n HIS 89 N -5.22 3.13 -3.10 0.65 8.25 -1.26 -4.94 115.22 112.73 1xn2 n HIS 89 Ca 0.21 -2.66 0.00 0.00 -0.26 0.00 0.00 57.72 55.01 1xn2 n HIS 89 Cb 0.68 -0.80 0.00 0.00 1.12 0.00 0.00 29.99 30.99 1xn2 n HIS 89 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xn2 n GLY 90 N -0.59 4.94 3.62 -1.41 0.00 -0.23 -4.35 105.19 107.16 1xn2 n GLY 90 Ca 0.50 -1.43 -0.33 0.00 0.00 0.00 0.00 46.02 44.76 1xn2 n GLY 90 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1xn2 n PRO 91 N 0.00 -0.14 -2.60 1.61 -0.04 -1.26 -4.84 135.00 127.72 1xn2 n PRO 91 Ca 0.00 0.03 -0.43 0.00 -0.04 0.00 0.00 63.50 63.05 1xn2 n PRO 91 Cb 0.00 -2.26 0.00 0.00 -0.04 0.00 0.00 33.50 31.20 1xn2 n PRO 91 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1xn2 n ASN 92 N -3.07 5.11 -4.00 3.54 5.15 -1.26 -4.63 115.26 116.10 1xn2 n ASN 92 Ca 0.11 -3.04 -0.09 0.00 -0.60 0.00 0.00 54.58 50.96 1xn2 n ASN 92 Cb 0.52 -1.53 -0.08 0.00 -0.53 0.00 0.00 39.78 38.15 1xn2 n ASN 92 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1xn2 s VAL 93 N 1.11 0.09 -0.04 3.44 -7.23 -1.26 -5.15 120.40 111.36 1xn2 s VAL 93 Ca 0.42 -1.52 0.02 0.00 -1.81 0.00 0.00 61.98 59.09 1xn2 s VAL 93 Cb 0.04 -1.82 0.01 0.00 0.56 0.00 0.00 36.38 35.17 1xn2 s VAL 93 CO 0.00 -0.42 -0.10 -0.89 -0.31 0.00 0.00 175.10 173.39 1xn2 s THR 94 N -3.97 0.90 0.07 5.32 2.01 -1.26 -4.44 115.64 114.26 1xn2 s THR 94 Ca 0.17 -0.39 0.04 0.00 0.31 0.00 0.00 61.69 61.82 1xn2 s THR 94 Cb 0.05 -0.81 -0.03 0.00 0.01 0.00 0.00 72.50 71.72 1xn2 s THR 94 CO -0.01 0.28 -0.11 0.68 -0.69 0.00 0.00 174.62 174.77 1xn2 s VAL 95 N 0.37 0.92 -0.30 3.82 -7.23 -0.61 -4.93 120.40 112.44 1xn2 s VAL 95 Ca -0.07 -1.33 -0.17 0.00 -1.81 0.00 0.00 61.98 58.60 1xn2 s VAL 95 Cb -0.11 -1.03 -0.02 0.00 0.56 0.00 0.00 36.38 35.78 1xn2 s VAL 95 CO 0.01 -0.35 0.47 -0.60 -0.31 0.00 0.00 175.10 174.32 1xn2 s ARG 96 N -1.97 3.85 0.21 4.82 3.52 -1.26 -0.99 118.95 127.12 1xn2 s ARG 96 Ca -0.02 0.03 0.08 0.00 -0.13 0.00 0.00 55.73 55.69 1xn2 s ARG 96 Cb -0.08 -3.72 -0.05 0.00 -1.56 0.00 0.00 34.95 29.54 1xn2 s ARG 96 CO 0.01 -0.46 -0.15 0.00 -0.81 0.00 0.00 175.30 173.89 1xn2 s ALA 97 N 2.27 2.07 0.25 6.12 0.00 -0.83 -4.93 121.76 126.70 1xn2 s ALA 97 Ca 0.18 -1.66 -0.30 0.00 0.00 0.00 0.00 51.96 50.19 1xn2 s ALA 97 Cb -0.16 -0.11 -0.09 0.00 0.00 0.00 0.00 23.12 22.76 1xn2 s ALA 97 CO 0.11 0.10 1.10 -0.80 0.00 0.00 0.00 175.76 176.27 1xn2 s ASN 98 N -3.26 7.27 -0.03 0.00 0.01 -1.26 -2.48 114.94 115.19 1xn2 s ASN 98 Ca 0.22 2.21 -0.00 0.00 -0.71 0.00 0.00 52.86 54.58 1xn2 s ASN 98 Cb -0.02 -2.62 0.03 0.00 0.41 0.00 0.00 41.25 39.05 1xn2 s ASN 98 CO 0.07 -0.17 0.01 -0.63 -1.51 0.00 0.00 177.10 174.88 1xn2 s ILE 99 N -0.87 0.13 -0.27 0.60 1.01 0.21 -4.61 121.20 117.40 1xn2 s ILE 99 Ca 0.46 0.15 -0.14 0.00 0.00 0.00 0.00 60.65 61.12 1xn2 s ILE 99 Cb -0.31 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 41.86 1xn2 s ILE 99 CO 0.39 0.15 0.35 0.00 0.00 0.00 0.00 174.94 175.83 1xn2 s ALA 100 N 1.26 3.56 -0.57 9.38 0.00 -0.45 -1.56 121.76 133.39 1xn2 s ALA 100 Ca -0.06 -0.84 -0.24 0.00 0.00 0.00 0.00 51.96 50.82 1xn2 s ALA 100 Cb -0.13 -2.67 0.04 0.00 0.00 0.00 0.00 23.12 20.36 1xn2 s ALA 100 CO -0.02 -0.62 0.95 0.00 0.00 0.00 0.00 175.76 176.06 1xn2 s ALA 101 N 1.99 3.15 -0.11 0.00 0.00 0.04 -1.26 121.76 125.57 1xn2 s ALA 101 Ca 0.14 -1.32 -0.29 0.00 0.00 0.00 0.00 51.96 50.49 1xn2 s ALA 101 Cb -0.16 -3.75 -0.04 0.00 0.00 0.00 0.00 23.12 19.17 1xn2 s ALA 101 CO 0.10 -2.44 1.53 0.42 0.00 0.00 0.00 175.76 175.37 1xn2 s ILE 102 N 3.97 3.81 -0.11 0.00 1.01 0.06 -1.39 121.20 128.56 1xn2 s ILE 102 Ca 0.29 0.98 0.12 0.00 0.00 0.00 0.00 60.65 62.04 1xn2 s ILE 102 Cb -0.13 -3.65 -0.16 0.00 0.01 0.00 0.00 42.46 38.52 1xn2 s ILE 102 CO 0.18 -0.11 0.09 0.35 0.00 0.00 0.00 174.94 175.45 1xn2 n THR 103 N 5.54 0.71 -3.95 2.92 -2.24 -0.32 -1.39 114.28 115.55 1xn2 n THR 103 Ca 0.16 -0.49 -0.10 0.00 -2.27 0.00 0.00 64.05 61.35 1xn2 n THR 103 Cb 0.44 -0.52 -0.11 0.00 -2.10 0.00 0.00 70.33 68.04 1xn2 n THR 103 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1xn2 s GLU 104 N -2.42 0.27 0.14 -0.78 0.41 -0.96 -4.93 118.70 110.43 1xn2 s GLU 104 Ca -0.06 -0.49 -0.20 0.00 -0.41 0.00 0.00 54.97 53.81 1xn2 s GLU 104 Cb 0.05 0.10 0.05 0.00 -1.78 0.00 0.00 34.13 32.55 1xn2 s GLU 104 CO 0.52 -0.05 0.51 -1.54 -0.49 0.00 0.00 175.26 174.22 1xn2 s SER 105 N -1.21 -0.42 -0.11 -0.19 1.04 -1.26 -0.92 113.70 110.63 1xn2 s SER 105 Ca -0.13 -0.13 -0.03 0.00 0.48 0.00 0.00 55.95 56.14 1xn2 s SER 105 Cb -0.08 0.54 0.05 0.00 0.10 0.00 0.00 66.02 66.63 1xn2 s SER 105 CO -0.01 -0.91 0.14 -0.62 0.98 0.00 0.00 173.24 172.82 1xn2 s ASP 106 N -2.74 1.14 -1.39 7.02 2.15 0.24 -4.88 116.67 118.21 1xn2 s ASP 106 Ca 0.02 0.07 -0.05 0.00 0.43 0.00 0.00 52.55 53.02 1xn2 s ASP 106 Cb 0.00 0.15 0.02 0.00 -0.30 0.00 0.00 42.92 42.79 1xn2 s ASP 106 CO -0.12 -0.27 0.37 0.29 -0.17 0.00 0.00 175.17 175.26 1xn2 n LYS 107 N 5.31 -3.49 -0.07 4.34 5.02 -1.26 -1.29 118.16 126.73 1xn2 n LYS 107 Ca -0.05 0.72 -0.07 0.00 -2.02 0.00 0.00 58.31 56.89 1xn2 n LYS 107 Cb 0.50 -5.46 -0.02 0.00 -0.02 0.00 0.00 35.03 30.03 1xn2 n LYS 107 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1xn2 n PHE 108 N -4.04 0.00 -2.21 2.13 7.35 -1.26 -3.91 117.46 115.52 1xn2 n PHE 108 Ca -0.11 0.00 -0.37 0.00 -0.76 0.00 0.00 57.45 56.22 1xn2 n PHE 108 Cb 0.60 -0.38 -0.00 0.00 0.35 0.00 0.00 39.48 40.05 1xn2 n PHE 108 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 1xn2 s PHE 109 N -2.51 2.78 -0.11 -5.13 0.40 -1.26 -5.02 117.98 107.13 1xn2 s PHE 109 Ca -0.22 1.52 0.02 0.00 -0.60 0.00 0.00 56.93 57.66 1xn2 s PHE 109 Cb 0.03 -3.40 -0.01 0.00 0.51 0.00 0.00 43.02 40.16 1xn2 s PHE 109 CO 0.33 -1.64 -0.20 0.42 0.70 0.00 0.00 175.22 174.82 1xn2 s ILE 110 N -1.57 2.41 0.04 0.64 1.01 -1.26 -5.04 121.20 117.43 1xn2 s ILE 110 Ca 0.66 -0.89 -0.31 0.00 0.00 0.00 0.00 60.65 60.11 1xn2 s ILE 110 Cb -0.29 -1.96 -0.10 0.00 0.01 0.00 0.00 42.46 40.12 1xn2 s ILE 110 CO 0.34 0.55 1.91 -3.20 0.00 0.00 0.00 174.94 174.54 1xn2 n ASN 111 N 3.54 3.96 0.00 3.58 4.05 -1.26 -2.11 115.26 127.02 1xn2 n ASN 111 Ca -0.19 0.94 0.00 0.00 0.45 0.00 0.00 54.58 55.79 1xn2 n ASN 111 Cb 0.53 -1.50 0.00 0.00 1.23 0.00 0.00 39.78 40.04 1xn2 n ASN 111 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1xn2 n GLY 112 N 4.41 0.54 0.23 8.20 0.00 -1.26 -4.91 105.19 112.40 1xn2 n GLY 112 Ca 0.20 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.35 1xn2 n GLY 112 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xn2 h SER 113 N 0.00 0.00 -0.08 1.61 4.64 -1.77 -3.47 113.55 114.48 1xn2 h SER 113 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1xn2 h SER 113 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1xn2 h SER 113 CO 0.00 0.07 -0.03 -3.20 -0.87 0.00 0.00 176.83 172.80 1xn2 n ASN 114 N -3.14 -4.32 -4.45 4.97 5.15 -1.26 -4.95 115.26 107.26 1xn2 n ASN 114 Ca 0.02 0.04 -0.29 0.00 -0.60 0.00 0.00 54.58 53.76 1xn2 n ASN 114 Cb 0.47 -1.97 -0.12 0.00 -0.53 0.00 0.00 39.78 37.63 1xn2 n ASN 114 CO 0.00 0.00 0.00 -1.66 1.40 0.00 0.00 177.26 177.00 1xn2 s TRP 115 N -1.69 2.42 0.00 1.20 1.48 -1.26 -4.65 118.94 116.44 1xn2 s TRP 115 Ca 0.00 -0.32 0.00 0.00 -1.06 0.00 0.00 56.10 54.72 1xn2 s TRP 115 Cb 0.00 -1.27 0.00 0.00 -1.16 0.00 0.00 33.47 31.04 1xn2 s TRP 115 CO 0.00 0.40 0.32 0.39 -4.06 0.00 0.00 176.95 174.00 1xn2 n GLU 116 N 0.67 1.01 -3.95 3.25 4.71 0.49 -4.84 120.64 121.97 1xn2 n GLU 116 Ca -0.15 -0.32 -0.12 0.00 -0.01 0.00 0.00 57.16 56.56 1xn2 n GLU 116 Cb 0.54 -0.80 -0.01 0.00 -1.01 0.00 0.00 31.44 30.16 1xn2 n GLU 116 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 1xn2 s GLY 117 N -0.23 1.01 -0.01 0.62 0.00 -1.11 -0.03 107.32 107.57 1xn2 s GLY 117 Ca 0.00 -1.19 0.02 0.00 0.00 0.00 0.00 44.72 43.55 1xn2 s GLY 117 CO 0.00 -0.69 -0.06 -1.50 0.00 0.00 0.00 173.10 170.85 1xn2 s ILE 118 N -2.58 0.48 -0.41 0.90 2.07 0.21 -1.12 121.20 120.76 1xn2 s ILE 118 Ca 0.24 -0.25 -0.03 0.00 -1.41 0.00 0.00 60.65 59.20 1xn2 s ILE 118 Cb -0.03 -0.42 0.11 0.00 0.13 0.00 0.00 42.46 42.25 1xn2 s ILE 118 CO 0.17 0.14 0.20 -0.22 -1.91 0.00 0.00 174.94 173.32 1xn2 s LEU 119 N -0.06 5.20 -0.28 8.50 2.96 0.49 -1.22 118.68 134.27 1xn2 s LEU 119 Ca 0.01 -1.97 -0.29 0.00 -0.22 0.00 0.00 54.13 51.66 1xn2 s LEU 119 Cb -0.03 -1.84 0.00 0.00 0.50 0.00 0.00 46.19 44.82 1xn2 s LEU 119 CO -0.00 -0.54 1.23 -0.83 -1.32 0.00 0.00 176.35 174.89 1xn2 s GLY 120 N 1.84 1.49 0.00 7.98 0.00 -0.83 -1.72 107.32 116.07 1xn2 s GLY 120 Ca 0.07 0.13 0.24 0.00 0.00 0.00 0.00 44.72 45.16 1xn2 s GLY 120 CO -0.04 2.48 1.29 1.04 0.00 0.00 0.00 173.10 177.87 1xn2 n LEU 121 N 7.20 3.01 0.00 0.66 4.77 0.22 -4.28 117.00 128.58 1xn2 n LEU 121 Ca 0.14 -1.04 -0.03 0.00 -0.03 0.00 0.00 56.01 55.05 1xn2 n LEU 121 Cb 0.46 -0.03 0.02 0.00 -2.33 0.00 0.00 43.42 41.55 1xn2 n LEU 121 CO 0.60 0.52 0.08 0.00 -1.33 0.00 0.00 177.39 177.26 1xn2 n ALA 122 N 1.34 -0.14 -2.26 -1.18 0.00 0.39 -4.95 120.51 113.70 1xn2 n ALA 122 Ca 0.15 -0.15 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 1xn2 n ALA 122 Cb 0.59 -0.01 -0.00 0.00 0.00 0.00 0.00 19.45 20.03 1xn2 n ALA 122 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1xn2 s TYR 123 N -1.25 3.56 0.48 0.00 1.51 -0.84 -4.65 117.35 116.15 1xn2 s TYR 123 Ca 0.07 0.84 0.21 0.00 -1.01 0.00 0.00 57.07 57.17 1xn2 s TYR 123 Cb -0.00 -2.32 1.24 0.00 -0.11 0.00 0.00 41.96 40.77 1xn2 s TYR 123 CO 0.05 -0.26 1.96 0.00 -1.11 0.00 0.00 175.55 176.18 1xn2 h ALA 124 N 0.32 2.33 -0.96 3.71 0.00 -1.86 -2.67 119.26 120.13 1xn2 h ALA 124 Ca -0.47 -0.01 0.24 0.00 0.00 0.00 0.00 54.91 54.67 1xn2 h ALA 124 Cb 1.20 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.92 1xn2 h ALA 124 CO 0.62 -0.51 0.65 1.49 0.00 0.00 0.00 179.25 181.49 1xn2 h GLU 125 N 0.20 0.28 -0.64 0.00 4.81 -1.87 0.77 114.58 118.13 1xn2 h GLU 125 Ca 0.31 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.53 1xn2 h GLU 125 Cb 0.96 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.28 1xn2 h GLU 125 CO -0.06 0.19 0.00 0.44 -0.73 0.00 0.00 179.01 178.85 1xn2 n ILE 126 N -4.47 0.98 -2.45 2.32 -5.35 -1.00 -4.62 119.36 104.76 1xn2 n ILE 126 Ca 0.21 -0.99 -0.35 0.00 -0.27 0.00 0.00 62.75 61.36 1xn2 n ILE 126 Cb 0.84 0.52 -0.02 0.00 -1.74 0.00 0.00 39.64 39.23 1xn2 n ILE 126 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1xn2 s ALA 127 N -1.01 2.84 0.07 -1.28 0.00 0.27 -4.64 121.76 118.00 1xn2 s ALA 127 Ca 0.43 0.69 0.04 0.00 0.00 0.00 0.00 51.96 53.13 1xn2 s ALA 127 Cb 0.23 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 20.02 1xn2 s ALA 127 CO 0.30 -0.45 0.01 1.03 0.00 0.00 0.00 175.76 176.64 1xn2 s ARG 128 N -3.17 2.62 0.38 0.00 1.81 -1.26 -3.08 118.95 116.26 1xn2 s ARG 128 Ca 0.68 -0.78 0.17 0.00 -1.72 0.00 0.00 55.73 54.08 1xn2 s ARG 128 Cb -0.19 -2.58 0.77 0.00 -0.45 0.00 0.00 34.95 32.50 1xn2 s ARG 128 CO 0.23 0.56 1.80 -1.35 -0.68 0.00 0.00 175.30 175.86 1xn2 h PRO 129 N 3.62 0.00 -3.29 3.54 0.11 -1.89 -3.47 132.00 130.62 1xn2 h PRO 129 Ca -0.48 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 1xn2 h PRO 129 Cb 1.17 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1xn2 h PRO 129 CO 0.60 0.37 0.15 0.16 -0.21 0.00 0.00 178.00 179.07 1xn2 s ASP 130 N -6.62 0.22 0.00 -2.05 -4.77 -1.18 -5.03 116.67 97.25 1xn2 s ASP 130 Ca -0.02 -1.21 0.07 0.00 -3.30 0.00 0.00 52.55 48.10 1xn2 s ASP 130 Cb 0.13 0.80 0.43 0.00 -1.09 0.00 0.00 42.92 43.19 1xn2 s ASP 130 CO 0.69 -1.58 0.85 -0.90 0.70 0.00 0.00 175.17 174.94 1xn2 n ASP 131 N -1.37 0.00 0.04 2.11 5.68 -1.26 -2.41 116.55 119.35 1xn2 n ASP 131 Ca -0.06 -0.60 0.12 0.00 -0.50 0.00 0.00 54.79 53.75 1xn2 n ASP 131 Cb 0.60 0.00 0.28 0.00 -1.14 0.00 0.00 41.12 40.87 1xn2 n ASP 131 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1xn2 n SER 132 N -0.77 0.58 -4.51 -1.12 3.41 -1.26 -4.67 113.62 105.27 1xn2 n SER 132 Ca 0.05 0.15 -0.42 0.00 -0.26 0.00 0.00 58.87 58.39 1xn2 n SER 132 Cb 0.02 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 63.90 1xn2 n SER 132 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1xn2 s LEU 133 N -3.81 3.84 -0.13 1.04 2.96 -1.01 -4.98 118.68 116.59 1xn2 s LEU 133 Ca 0.09 -0.94 -0.36 0.00 -0.22 0.00 0.00 54.13 52.71 1xn2 s LEU 133 Cb 0.15 -2.49 -0.13 0.00 0.50 0.00 0.00 46.19 44.22 1xn2 s LEU 133 CO 0.67 -1.58 1.83 1.21 -1.32 0.00 0.00 176.35 177.16 1xn2 n GLU 134 N 8.43 1.89 -1.30 1.98 2.13 -1.26 -4.91 120.64 127.60 1xn2 n GLU 134 Ca 0.07 0.69 -0.31 0.00 0.66 0.00 0.00 57.16 58.26 1xn2 n GLU 134 Cb 0.48 -2.49 0.09 0.00 0.27 0.00 0.00 31.44 29.79 1xn2 n GLU 134 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 1xn2 s PRO 135 N 3.75 2.24 0.17 5.31 0.02 -1.26 -4.51 135.00 140.72 1xn2 s PRO 135 Ca 0.94 1.25 -0.18 0.00 0.02 0.00 0.00 61.00 63.02 1xn2 s PRO 135 Cb -0.80 -1.89 0.10 0.00 0.02 0.00 0.00 34.50 31.93 1xn2 s PRO 135 CO 0.55 -1.67 1.65 0.35 -0.33 0.00 0.00 177.00 177.55 1xn2 h PHE 136 N -0.99 -0.39 -0.81 6.54 3.57 -1.81 -2.45 116.94 120.60 1xn2 h PHE 136 Ca -0.44 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.11 1xn2 h PHE 136 Cb 1.24 0.23 -0.04 0.00 2.79 0.00 0.00 35.95 40.17 1xn2 h PHE 136 CO 0.56 -0.24 0.54 0.35 -2.23 0.00 0.00 178.31 177.29 1xn2 h PHE 137 N -0.08 1.02 -0.81 0.41 3.57 -1.92 -0.28 116.94 118.85 1xn2 h PHE 137 Ca 0.20 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.68 1xn2 h PHE 137 Cb 0.38 -0.35 -0.04 0.00 2.79 0.00 0.00 35.95 38.74 1xn2 h PHE 137 CO -0.41 0.64 0.37 -0.44 -2.23 0.00 0.00 178.31 176.24 1xn2 h ASP 138 N 1.10 1.08 -0.46 0.41 3.32 -1.83 -1.24 116.42 118.81 1xn2 h ASP 138 Ca 0.30 -0.15 -0.06 0.00 0.02 0.00 0.00 57.03 57.14 1xn2 h ASP 138 Cb -0.12 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.13 1xn2 h ASP 138 CO -0.07 0.93 0.07 0.28 -1.72 0.00 0.00 179.24 178.73 1xn2 h SER 139 N 1.16 0.73 -0.23 6.45 0.02 -0.81 -1.03 113.55 119.85 1xn2 h SER 139 Ca 0.28 -0.26 0.03 0.00 -0.84 0.00 0.00 61.79 60.99 1xn2 h SER 139 Cb 0.16 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.47 1xn2 h SER 139 CO -0.03 0.81 0.04 0.25 -1.14 0.00 0.00 176.83 176.76 1xn2 h LEU 140 N 0.63 -0.01 -0.44 5.07 5.85 -0.76 0.06 115.31 125.70 1xn2 h LEU 140 Ca 0.14 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.84 1xn2 h LEU 140 Cb 0.39 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.46 1xn2 h LEU 140 CO 0.01 0.03 0.07 0.58 -0.34 0.00 0.00 178.44 178.79 1xn2 h VAL 141 N 0.12 1.25 -0.11 1.05 2.07 -1.10 -2.07 116.25 117.46 1xn2 h VAL 141 Ca 0.11 -0.90 -0.08 0.00 0.82 0.00 0.00 66.70 66.64 1xn2 h VAL 141 Cb 0.11 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 1xn2 h VAL 141 CO -0.15 0.32 -0.31 0.11 0.02 0.00 0.00 177.57 177.56 1xn2 h LYS 142 N 0.60 0.20 -0.01 1.57 1.57 -0.94 -3.19 116.57 116.37 1xn2 h LYS 142 Ca 0.13 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1xn2 h LYS 142 Cb 0.39 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1xn2 h LYS 142 CO 0.01 0.50 -0.56 1.04 -0.57 0.00 0.00 179.45 179.87 1xn2 n GLN 143 N -4.12 0.71 -3.81 3.15 6.02 -0.01 -4.99 117.38 114.32 1xn2 n GLN 143 Ca -0.01 -0.54 -0.17 0.00 -0.01 0.00 0.00 57.00 56.27 1xn2 n GLN 143 Cb 0.39 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 30.11 1xn2 n GLN 143 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1xn2 n THR 144 N -0.68 0.00 -0.34 5.09 -2.24 -0.79 -5.03 114.28 110.30 1xn2 n THR 144 Ca 0.08 -1.93 0.08 0.00 -2.27 0.00 0.00 64.05 60.02 1xn2 n THR 144 Cb 0.39 0.90 0.32 0.00 -2.10 0.00 0.00 70.33 69.85 1xn2 n THR 144 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1xn2 n HIS 145 N -0.55 1.31 -1.83 4.78 8.25 -1.26 -4.77 115.22 121.15 1xn2 n HIS 145 Ca 0.04 -0.53 -0.42 0.00 -0.26 0.00 0.00 57.72 56.55 1xn2 n HIS 145 Cb 0.48 -0.22 -0.03 0.00 1.12 0.00 0.00 29.99 31.35 1xn2 n HIS 145 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1xn2 s VAL 146 N -1.79 2.86 0.69 1.59 1.01 -1.26 -4.94 120.40 118.56 1xn2 s VAL 146 Ca 0.45 0.29 -0.17 0.00 0.00 0.00 0.00 61.98 62.55 1xn2 s VAL 146 Cb 0.29 -3.18 0.02 0.00 0.00 0.00 0.00 36.38 33.50 1xn2 s VAL 146 CO 0.22 -0.00 1.27 -2.84 0.00 0.00 0.00 175.10 173.75 1xn2 s PRO 147 N 2.86 2.28 -1.31 2.72 0.02 -1.26 -4.66 135.00 135.65 1xn2 s PRO 147 Ca 0.78 1.99 -0.17 0.00 0.02 0.00 0.00 61.00 63.62 1xn2 s PRO 147 Cb -0.42 -1.82 0.02 0.00 0.02 0.00 0.00 34.50 32.29 1xn2 s PRO 147 CO 0.34 -1.78 2.04 -1.71 -0.33 0.00 0.00 177.00 175.56 1xn2 n ASN 148 N -2.30 3.94 0.00 2.53 5.15 -1.26 -4.29 115.26 119.03 1xn2 n ASN 148 Ca 0.15 -2.83 0.00 0.00 -0.60 0.00 0.00 54.58 51.30 1xn2 n ASN 148 Cb 0.49 -1.62 0.00 0.00 -0.53 0.00 0.00 39.78 38.12 1xn2 n ASN 148 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1xn2 n LEU 149 N 7.38 0.00 -3.94 1.20 -0.00 -1.26 -1.24 117.00 119.14 1xn2 n LEU 149 Ca 0.50 0.00 -0.09 0.00 -0.00 0.00 0.00 56.01 56.42 1xn2 n LEU 149 Cb 0.42 0.00 -0.07 0.00 -0.00 0.00 0.00 43.42 43.77 1xn2 n LEU 149 CO 0.87 0.00 -0.00 0.72 -0.00 0.00 0.00 177.39 178.98 1xn2 s PHE 150 N -2.00 0.34 0.03 1.47 -0.71 -1.09 -0.51 117.98 115.51 1xn2 s PHE 150 Ca 0.00 -0.71 0.01 0.00 -1.04 0.00 0.00 56.93 55.19 1xn2 s PHE 150 Cb 0.00 -0.02 -0.02 0.00 -1.21 0.00 0.00 43.02 41.76 1xn2 s PHE 150 CO 0.00 -0.72 -0.05 -1.54 -1.34 0.00 0.00 175.22 171.57 1xn2 s SER 151 N -2.95 0.48 -0.05 1.98 1.04 -0.48 -0.27 113.70 113.45 1xn2 s SER 151 Ca 0.16 -0.56 0.03 0.00 0.48 0.00 0.00 55.95 56.06 1xn2 s SER 151 Cb 0.03 0.08 0.00 0.00 0.10 0.00 0.00 66.02 66.24 1xn2 s SER 151 CO -0.01 -0.29 -0.14 -0.76 0.98 0.00 0.00 173.24 173.02 1xn2 s LEU 152 N -1.62 1.82 -0.32 2.42 1.43 0.21 -0.84 118.68 121.77 1xn2 s LEU 152 Ca -0.12 -0.30 0.03 0.00 -1.03 0.00 0.00 54.13 52.70 1xn2 s LEU 152 Cb -0.09 -0.84 0.09 0.00 0.03 0.00 0.00 46.19 45.38 1xn2 s LEU 152 CO -0.01 0.10 0.04 -1.58 0.23 0.00 0.00 176.35 175.13 1xn2 s GLN 153 N 0.25 1.36 -0.14 1.70 0.74 0.11 -1.58 119.66 122.11 1xn2 s GLN 153 Ca -0.07 -1.58 -0.18 0.00 0.05 0.00 0.00 55.36 53.58 1xn2 s GLN 153 Cb -0.12 -2.85 -0.04 0.00 1.10 0.00 0.00 33.01 31.10 1xn2 s GLN 153 CO 0.02 -0.90 0.49 -0.51 -0.55 0.00 0.00 175.29 173.85 1xn2 s LEU 154 N 1.12 4.25 -0.33 3.68 1.43 -1.26 -0.63 118.68 126.94 1xn2 s LEU 154 Ca 0.08 0.79 -0.05 0.00 -1.03 0.00 0.00 54.13 53.91 1xn2 s LEU 154 Cb -0.19 -2.70 0.04 0.00 0.03 0.00 0.00 46.19 43.37 1xn2 s LEU 154 CO -0.12 -0.04 0.08 0.00 0.23 0.00 0.00 176.35 176.50 1xn2 s GLY 156 N 1.37 2.49 0.08 0.00 0.00 -1.26 -4.73 107.32 105.27 1xn2 s GLY 156 Ca -0.03 0.13 0.07 0.00 0.00 0.00 0.00 44.72 44.88 1xn2 s GLY 156 CO 0.02 0.42 1.14 0.00 0.00 0.00 0.00 173.10 174.68 1xn2 h ALA 157 N 2.88 0.40 0.00 3.20 0.00 -1.95 -3.44 119.26 120.36 1xn2 h ALA 157 Ca -0.48 -1.02 0.00 0.00 0.00 0.00 0.00 54.91 53.42 1xn2 h ALA 157 Cb 1.18 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1xn2 h ALA 157 CO 0.65 1.28 0.00 0.41 0.00 0.00 0.00 179.25 181.59 1xn2 n GLY 158 N 1.42 0.75 3.50 0.00 0.00 -1.26 -4.99 105.19 104.61 1xn2 n GLY 158 Ca -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.87 1xn2 n GLY 158 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1xn2 s PHE 159 N -2.73 -0.24 0.26 1.61 -0.71 -1.26 -4.87 117.98 110.04 1xn2 s PHE 159 Ca 0.00 -0.08 -0.29 0.00 -1.04 0.00 0.00 56.93 55.52 1xn2 s PHE 159 Cb 0.00 0.44 -0.09 0.00 -1.21 0.00 0.00 43.02 42.16 1xn2 s PHE 159 CO 0.00 -0.90 1.27 -1.25 -1.34 0.00 0.00 175.22 173.00 1xn2 s PRO 160 N -3.84 4.42 -0.17 1.99 0.04 -1.26 -4.91 135.00 131.28 1xn2 s PRO 160 Ca 0.06 2.07 -0.06 0.00 0.04 0.00 0.00 61.00 63.12 1xn2 s PRO 160 Cb -0.01 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.35 1xn2 s PRO 160 CO -0.06 -0.15 0.04 -0.51 0.04 0.00 0.00 177.00 176.36 1xn2 s LEU 161 N -0.97 3.69 0.92 -3.56 1.43 -1.26 -4.97 118.68 113.95 1xn2 s LEU 161 Ca 0.52 0.05 -0.15 0.00 -1.03 0.00 0.00 54.13 53.52 1xn2 s LEU 161 Cb -0.37 -1.91 0.16 0.00 0.03 0.00 0.00 46.19 44.10 1xn2 s LEU 161 CO 0.44 0.20 1.28 0.54 0.23 0.00 0.00 176.35 179.04 1xn2 s ASN 162 N 0.21 3.53 0.22 2.29 6.03 -1.26 -4.70 114.94 121.26 1xn2 s ASN 162 Ca 0.03 0.42 -0.09 0.00 -1.03 0.00 0.00 52.86 52.19 1xn2 s ASN 162 Cb -0.13 -0.60 0.34 0.00 -3.03 0.00 0.00 41.25 37.84 1xn2 s ASN 162 CO 0.01 -2.49 1.69 -0.61 -2.03 0.00 0.00 177.10 173.67 1xn2 h GLN 163 N -1.47 0.22 -0.00 3.55 5.75 -1.99 -0.39 115.11 120.77 1xn2 h GLN 163 Ca -0.45 -0.01 -0.14 0.00 -0.15 0.00 0.00 58.65 57.90 1xn2 h GLN 163 Cb 1.26 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 29.74 1xn2 h GLN 163 CO 0.46 0.14 -0.65 0.66 -2.65 0.00 0.00 178.83 176.79 1xn2 h SER 164 N 0.22 0.00 -0.30 -0.69 4.64 -1.99 -2.87 113.55 112.57 1xn2 h SER 164 Ca 0.34 -0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.49 1xn2 h SER 164 Cb 0.55 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.64 1xn2 h SER 164 CO -0.47 0.65 -0.47 -0.33 -0.87 0.00 0.00 176.83 175.35 1xn2 h GLU 165 N 0.00 0.85 0.00 4.77 5.08 -1.67 0.81 114.58 124.43 1xn2 h GLU 165 Ca -0.01 -0.51 -0.02 0.00 -1.00 0.00 0.00 59.36 57.82 1xn2 h GLU 165 Cb 1.16 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 1xn2 h GLU 165 CO 0.09 1.15 -0.10 0.28 -1.00 0.00 0.00 179.01 179.43 1xn2 h VAL 166 N 0.63 0.30 0.10 3.13 2.07 -1.09 0.32 116.25 121.71 1xn2 h VAL 166 Ca 0.03 -0.69 -0.34 0.00 0.82 0.00 0.00 66.70 66.51 1xn2 h VAL 166 Cb 1.08 1.54 -0.02 0.00 -1.52 0.00 0.00 31.29 32.36 1xn2 h VAL 166 CO 0.11 0.10 -1.88 0.18 0.02 0.00 0.00 177.57 176.10 1xn2 n LEU 167 N -3.29 2.49 -0.28 2.57 4.77 -1.09 -4.18 117.00 117.99 1xn2 n LEU 167 Ca -0.00 0.24 0.09 0.00 -0.03 0.00 0.00 56.01 56.31 1xn2 n LEU 167 Cb 0.32 -1.09 0.39 0.00 -2.33 0.00 0.00 43.42 40.71 1xn2 n LEU 167 CO 0.29 0.74 0.77 0.00 -1.33 0.00 0.00 177.39 177.86 1xn2 n ALA 168 N -3.10 2.55 -2.55 -1.18 0.00 0.28 -4.88 120.51 111.62 1xn2 n ALA 168 Ca -0.33 -0.31 -0.24 0.00 0.00 0.00 0.00 53.44 52.56 1xn2 n ALA 168 Cb 0.98 -1.16 -0.09 0.00 0.00 0.00 0.00 19.45 19.18 1xn2 n ALA 168 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1xn2 s SER 169 N -1.46 4.10 -0.38 0.00 1.04 0.11 -4.96 113.70 112.15 1xn2 s SER 169 Ca 0.26 -0.89 -0.18 0.00 0.48 0.00 0.00 55.95 55.63 1xn2 s SER 169 Cb 0.13 -0.56 0.00 0.00 0.10 0.00 0.00 66.02 65.70 1xn2 s SER 169 CO 0.21 -0.06 0.48 -0.69 0.98 0.00 0.00 173.24 174.15 1xn2 s VAL 170 N -2.45 5.04 -2.10 5.02 1.01 -1.26 -4.76 120.40 120.89 1xn2 s VAL 170 Ca 0.32 0.07 0.30 0.00 0.00 0.00 0.00 61.98 62.67 1xn2 s VAL 170 Cb -0.04 -3.99 0.72 0.00 0.00 0.00 0.00 36.38 33.08 1xn2 s VAL 170 CO 0.18 -0.30 2.02 0.61 0.00 0.00 0.00 175.10 177.61 1xn2 n GLY 171 N 4.94 -0.67 0.00 4.51 0.00 0.19 -4.88 105.19 109.29 1xn2 n GLY 171 Ca -0.06 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.67 1xn2 n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xn2 n GLY 172 N 1.10 0.94 2.93 -0.02 0.00 -1.16 -0.57 105.19 108.42 1xn2 n GLY 172 Ca 0.21 -1.93 -0.12 0.00 0.00 0.00 0.00 46.02 44.19 1xn2 n GLY 172 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xn2 s SER 173 N -4.00 0.01 -0.28 1.61 0.01 0.20 -1.50 113.70 109.75 1xn2 s SER 173 Ca 0.00 -0.03 0.03 0.00 1.31 0.00 0.00 55.95 57.25 1xn2 s SER 173 Cb 0.00 0.09 0.07 0.00 0.21 0.00 0.00 66.02 66.40 1xn2 s SER 173 CO 0.00 -0.08 -0.04 -0.32 0.41 0.00 0.00 173.24 173.21 1xn2 s MET 174 N -0.31 1.85 -0.34 12.44 0.00 -1.26 0.07 119.30 131.75 1xn2 s MET 174 Ca -0.04 -1.46 -0.20 0.00 0.00 0.00 0.00 55.69 54.00 1xn2 s MET 174 Cb -0.02 -2.91 -0.00 0.00 0.00 0.00 0.00 34.83 31.89 1xn2 s MET 174 CO -0.00 -0.71 0.60 0.42 0.00 0.00 0.00 175.02 175.33 1xn2 s ILE 175 N 1.10 4.94 -0.30 10.11 -1.09 -0.02 -4.87 121.20 131.07 1xn2 s ILE 175 Ca -0.01 0.61 -0.17 0.00 -2.23 0.00 0.00 60.65 58.85 1xn2 s ILE 175 Cb -0.19 -4.02 -0.02 0.00 -1.58 0.00 0.00 42.46 36.64 1xn2 s ILE 175 CO -0.07 -0.23 0.45 -0.63 -1.23 0.00 0.00 174.94 173.23 1xn2 s ILE 176 N 2.60 5.10 0.00 2.92 1.01 -1.26 -1.39 121.20 130.17 1xn2 s ILE 176 Ca 0.23 0.53 0.00 0.00 0.00 0.00 0.00 60.65 61.41 1xn2 s ILE 176 Cb -0.15 -3.83 0.00 0.00 0.01 0.00 0.00 42.46 38.50 1xn2 s ILE 176 CO 0.13 0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.68 1xn2 n GLY 177 N 4.67 0.67 0.00 6.18 0.00 0.33 -4.77 105.19 112.27 1xn2 n GLY 177 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1xn2 n GLY 177 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xn2 n GLY 178 N -2.05 1.22 3.01 -0.02 0.00 -1.25 -4.36 105.19 101.75 1xn2 n GLY 178 Ca 0.00 -0.86 -0.27 0.00 0.00 0.00 0.00 46.02 44.89 1xn2 n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xn2 s ILE 179 N -2.46 1.28 -0.35 -0.61 1.01 -1.26 -4.03 121.20 114.78 1xn2 s ILE 179 Ca 0.00 -0.51 -0.11 0.00 0.00 0.00 0.00 60.65 60.03 1xn2 s ILE 179 Cb 0.00 -1.20 0.01 0.00 0.01 0.00 0.00 42.46 41.28 1xn2 s ILE 179 CO 0.00 0.40 0.20 -0.62 0.00 0.00 0.00 174.94 174.92 1xn2 s ASP 180 N 1.11 5.72 0.52 3.58 2.15 -1.26 -0.93 116.67 127.56 1xn2 s ASP 180 Ca -0.05 -0.81 0.33 0.00 0.43 0.00 0.00 52.55 52.46 1xn2 s ASP 180 Cb -0.14 -2.03 1.82 0.00 -0.30 0.00 0.00 42.92 42.26 1xn2 s ASP 180 CO -0.02 -0.32 2.02 0.45 -0.17 0.00 0.00 175.17 177.13 1xn2 h HIS 181 N 8.42 0.00 0.00 -5.34 3.86 -1.84 -1.53 115.15 118.72 1xn2 h HIS 181 Ca -0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.93 1xn2 h HIS 181 Cb 1.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.59 1xn2 h HIS 181 CO 0.60 0.00 0.00 -1.13 0.86 0.00 0.00 177.93 178.26 1xn2 n SER 182 N -2.70 0.00 -0.24 2.45 3.41 -1.26 -3.49 113.62 111.79 1xn2 n SER 182 Ca -0.02 0.43 0.13 0.00 -0.26 0.00 0.00 58.87 59.14 1xn2 n SER 182 Cb 0.09 -0.47 0.35 0.00 -0.26 0.00 0.00 64.21 63.92 1xn2 n SER 182 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1xn2 n LEU 183 N -1.47 1.03 -4.07 1.04 4.77 -0.58 -4.80 117.00 112.91 1xn2 n LEU 183 Ca 0.07 -0.27 -0.10 0.00 -0.03 0.00 0.00 56.01 55.68 1xn2 n LEU 183 Cb 0.27 -0.13 -0.08 0.00 -2.33 0.00 0.00 43.42 41.16 1xn2 n LEU 183 CO 0.22 0.20 -0.06 -0.72 -1.33 0.00 0.00 177.39 175.70 1xn2 s TYR 184 N -2.54 0.70 0.25 -1.77 1.13 -1.23 -1.14 117.35 112.75 1xn2 s TYR 184 Ca 0.23 -1.01 0.05 0.00 -1.41 0.00 0.00 57.07 54.93 1xn2 s TYR 184 Cb 0.19 -0.19 -0.05 0.00 -1.10 0.00 0.00 41.96 40.81 1xn2 s TYR 184 CO 0.54 -0.77 -0.04 0.95 -2.51 0.00 0.00 175.55 173.72 1xn2 s THR 185 N -4.06 1.38 0.00 -3.49 -4.23 -0.78 -4.77 115.64 99.69 1xn2 s THR 185 Ca 0.27 -2.09 0.00 0.00 -1.18 0.00 0.00 61.69 58.70 1xn2 s THR 185 Cb 0.04 -2.38 0.00 0.00 1.34 0.00 0.00 72.50 71.50 1xn2 s THR 185 CO 0.07 -0.33 0.00 0.61 -0.54 0.00 0.00 174.62 174.43 1xn2 n GLY 186 N -0.50 0.14 3.86 3.99 0.00 -1.26 -3.82 105.19 107.60 1xn2 n GLY 186 Ca -0.06 -0.98 -0.22 0.00 0.00 0.00 0.00 46.02 44.77 1xn2 n GLY 186 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xn2 s SER 187 N -4.00 5.75 -0.16 1.61 1.04 -1.26 -4.97 113.70 111.70 1xn2 s SER 187 Ca 0.00 -0.15 -0.19 0.00 0.48 0.00 0.00 55.95 56.08 1xn2 s SER 187 Cb 0.00 -1.53 -0.03 0.00 0.10 0.00 0.00 66.02 64.55 1xn2 s SER 187 CO 0.00 -0.04 0.56 -0.76 0.98 0.00 0.00 173.24 173.98 1xn2 s LEU 188 N -3.83 4.20 -0.12 2.42 1.43 -1.26 -4.47 118.68 117.05 1xn2 s LEU 188 Ca 0.33 0.81 -0.00 0.00 -1.03 0.00 0.00 54.13 54.24 1xn2 s LEU 188 Cb -0.08 -2.79 -0.02 0.00 0.03 0.00 0.00 46.19 43.33 1xn2 s LEU 188 CO 0.26 -0.15 -0.12 0.26 0.23 0.00 0.00 176.35 176.84 1xn2 s TRP 189 N 1.34 2.84 -0.04 0.29 0.52 -0.38 -4.89 118.94 118.61 1xn2 s TRP 189 Ca 0.27 -0.50 -0.01 0.00 0.02 0.00 0.00 56.10 55.88 1xn2 s TRP 189 Cb -0.16 -1.83 -0.04 0.00 -1.15 0.00 0.00 33.47 30.30 1xn2 s TRP 189 CO 0.11 -0.11 0.03 0.71 0.02 0.00 0.00 176.95 177.70 1xn2 s TYR 190 N 0.17 3.18 0.03 -1.98 1.51 -1.26 -0.54 117.35 118.46 1xn2 s TYR 190 Ca -0.06 0.18 0.08 0.00 -1.01 0.00 0.00 57.07 56.26 1xn2 s TYR 190 Cb -0.15 -1.75 -0.03 0.00 -0.11 0.00 0.00 41.96 39.93 1xn2 s TYR 190 CO 0.05 0.50 -0.24 -0.08 -1.11 0.00 0.00 175.55 174.67 1xn2 s THR 191 N -1.03 2.33 0.50 -0.71 -1.32 0.20 -3.40 115.64 112.22 1xn2 s THR 191 Ca 0.17 -1.26 -0.22 0.00 -1.21 0.00 0.00 61.69 59.17 1xn2 s THR 191 Cb -0.12 -1.91 -0.06 0.00 -1.51 0.00 0.00 72.50 68.90 1xn2 s THR 191 CO 0.07 0.41 1.27 -2.84 -2.21 0.00 0.00 174.62 171.32 1xn2 s PRO 192 N -1.16 3.47 -0.24 7.08 0.02 -1.26 -0.89 135.00 142.02 1xn2 s PRO 192 Ca 0.12 2.02 -0.23 0.00 0.02 0.00 0.00 61.00 62.93 1xn2 s PRO 192 Cb -0.10 -2.35 -0.01 0.00 0.02 0.00 0.00 34.50 32.06 1xn2 s PRO 192 CO 0.02 -0.86 0.75 0.42 -0.33 0.00 0.00 177.00 177.00 1xn2 s ILE 193 N -1.41 4.90 0.12 2.83 1.01 -0.24 -4.60 121.20 123.80 1xn2 s ILE 193 Ca 0.67 1.40 -0.14 0.00 0.00 0.00 0.00 60.65 62.58 1xn2 s ILE 193 Cb -0.35 -4.04 -0.03 0.00 0.01 0.00 0.00 42.46 38.04 1xn2 s ILE 193 CO 0.42 -0.03 1.53 -0.09 0.00 0.00 0.00 174.94 176.77 1xn2 h ARG 194 N 7.74 0.74 -3.16 2.79 2.43 -1.34 -3.45 114.38 120.13 1xn2 h ARG 194 Ca -0.25 -0.28 -0.15 0.00 -0.81 0.00 0.00 59.98 58.49 1xn2 h ARG 194 Cb 1.11 -0.04 -0.24 0.00 -0.42 0.00 0.00 29.97 30.37 1xn2 h ARG 194 CO 0.83 0.88 -0.41 0.50 -1.51 0.00 0.00 179.97 180.26 1xn2 s ARG 195 N -4.79 0.37 -1.18 0.20 3.52 -1.26 -5.08 118.95 110.72 1xn2 s ARG 195 Ca -0.13 0.18 -0.16 0.00 -0.13 0.00 0.00 55.73 55.50 1xn2 s ARG 195 Cb 0.10 0.17 0.14 0.00 -1.56 0.00 0.00 34.95 33.80 1xn2 s ARG 195 CO 0.81 -0.07 1.46 -1.21 -0.81 0.00 0.00 175.30 175.48 1xn2 s GLU 196 N -0.26 3.99 0.00 5.12 2.02 -1.26 -4.10 118.70 124.21 1xn2 s GLU 196 Ca -0.04 -2.31 0.00 0.00 0.02 0.00 0.00 54.97 52.64 1xn2 s GLU 196 Cb -0.03 -5.15 0.00 0.00 0.10 0.00 0.00 34.13 29.05 1xn2 s GLU 196 CO 0.01 -1.88 0.00 -2.67 0.02 0.00 0.00 175.26 170.74 1xn2 n TRP 197 N 6.44 -0.00 -2.62 1.61 4.27 -1.26 -4.56 117.44 121.31 1xn2 n TRP 197 Ca 0.37 0.00 -0.23 0.00 -3.89 0.00 0.00 57.50 53.76 1xn2 n TRP 197 Cb 0.44 0.03 0.09 0.00 -1.36 0.00 0.00 31.31 30.52 1xn2 n TRP 197 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 1xn2 s TYR 198 N -0.05 1.77 -1.04 -2.67 2.02 -1.26 -1.99 117.35 114.13 1xn2 s TYR 198 Ca 0.00 -0.27 -0.18 0.00 -0.37 0.00 0.00 57.07 56.25 1xn2 s TYR 198 Cb 0.00 -2.90 0.13 0.00 -0.40 0.00 0.00 41.96 38.79 1xn2 s TYR 198 CO 0.00 -1.54 1.29 0.71 -1.57 0.00 0.00 175.55 174.44 1xn2 s TYR 199 N -3.05 3.11 -0.01 2.71 1.51 -1.26 -4.81 117.35 115.54 1xn2 s TYR 199 Ca 0.65 -1.52 -0.20 0.00 -1.01 0.00 0.00 57.07 54.98 1xn2 s TYR 199 Cb -0.06 -4.38 -0.05 0.00 -0.11 0.00 0.00 41.96 37.35 1xn2 s TYR 199 CO 0.43 -1.55 0.59 -2.00 -1.11 0.00 0.00 175.55 171.91 1xn2 s GLU 200 N 2.84 4.32 0.37 -0.62 2.12 -1.26 -1.91 118.70 124.56 1xn2 s GLU 200 Ca 0.39 0.73 0.04 0.00 0.36 0.00 0.00 54.97 56.48 1xn2 s GLU 200 Cb -0.03 -3.35 -0.03 0.00 0.26 0.00 0.00 34.13 30.98 1xn2 s GLU 200 CO -0.06 0.35 0.13 0.14 -0.54 0.00 0.00 175.26 175.28 1xn2 s VAL 201 N -0.11 0.59 -0.12 3.70 -7.23 -0.28 -0.88 120.40 116.05 1xn2 s VAL 201 Ca 0.31 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.49 1xn2 s VAL 201 Cb -0.18 -2.44 0.02 0.00 0.56 0.00 0.00 36.38 34.33 1xn2 s VAL 201 CO 0.17 0.00 -0.16 -0.63 -0.31 0.00 0.00 175.10 174.17 1xn2 s ILE 202 N -3.31 1.57 -0.15 -0.62 1.01 -1.26 -4.13 121.20 114.31 1xn2 s ILE 202 Ca 0.28 -0.67 -0.15 0.00 0.00 0.00 0.00 60.65 60.11 1xn2 s ILE 202 Cb 0.04 -1.44 -0.05 0.00 0.01 0.00 0.00 42.46 41.02 1xn2 s ILE 202 CO 0.16 0.46 0.34 -0.63 0.00 0.00 0.00 174.94 175.27 1xn2 s ILE 203 N 1.12 5.27 -0.67 2.92 1.01 -1.26 -2.36 121.20 127.24 1xn2 s ILE 203 Ca -0.03 0.66 0.12 0.00 0.00 0.00 0.00 60.65 61.39 1xn2 s ILE 203 Cb -0.14 -3.68 -0.10 0.00 0.01 0.00 0.00 42.46 38.55 1xn2 s ILE 203 CO -0.04 0.37 0.54 1.33 0.00 0.00 0.00 174.94 177.14 1xn2 n VAL 204 N 3.61 0.00 -3.59 2.92 0.24 0.12 -4.73 118.33 116.89 1xn2 n VAL 204 Ca -0.11 -0.26 -0.10 0.00 -2.04 0.00 0.00 64.34 61.83 1xn2 n VAL 204 Cb 0.52 1.03 -0.06 0.00 -1.47 0.00 0.00 33.84 33.86 1xn2 n VAL 204 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1xn2 s ARG 205 N -1.96 0.56 -0.04 7.34 3.52 -1.24 -4.83 118.95 122.29 1xn2 s ARG 205 Ca 0.06 0.24 0.01 0.00 -0.13 0.00 0.00 55.73 55.90 1xn2 s ARG 205 Cb 0.09 0.26 0.02 0.00 -1.56 0.00 0.00 34.95 33.76 1xn2 s ARG 205 CO 0.43 -0.15 -0.04 0.08 -0.81 0.00 0.00 175.30 174.81 1xn2 s VAL 206 N -0.81 0.50 0.12 7.11 1.01 -1.26 -0.30 120.40 126.78 1xn2 s VAL 206 Ca -0.00 -0.13 0.07 0.00 0.00 0.00 0.00 61.98 61.92 1xn2 s VAL 206 Cb -0.01 -0.52 -0.04 0.00 0.00 0.00 0.00 36.38 35.81 1xn2 s VAL 206 CO -0.00 0.20 -0.18 -1.61 0.00 0.00 0.00 175.10 173.51 1xn2 s GLU 207 N 0.73 1.11 -0.24 2.72 2.02 -0.51 -1.24 118.70 123.29 1xn2 s GLU 207 Ca -0.09 -1.23 0.01 0.00 0.02 0.00 0.00 54.97 53.68 1xn2 s GLU 207 Cb -0.13 -1.20 0.06 0.00 0.10 0.00 0.00 34.13 32.96 1xn2 s GLU 207 CO 0.00 0.26 -0.06 0.42 0.02 0.00 0.00 175.26 175.90 1xn2 s ILE 208 N -1.65 1.69 -1.36 -1.63 -1.09 -0.13 -1.69 121.20 115.34 1xn2 s ILE 208 Ca 0.09 -1.34 -0.03 0.00 -2.23 0.00 0.00 60.65 57.14 1xn2 s ILE 208 Cb -0.08 -1.92 0.02 0.00 -1.58 0.00 0.00 42.46 38.90 1xn2 s ILE 208 CO 0.04 -0.10 0.73 0.59 -1.23 0.00 0.00 174.94 174.97 1xn2 n ASN 209 N 4.61 -1.76 0.00 3.58 5.03 -0.29 -1.07 115.26 125.36 1xn2 n ASN 209 Ca -0.12 -0.83 0.00 0.00 0.87 0.00 0.00 54.58 54.50 1xn2 n ASN 209 Cb 0.43 -3.95 0.00 0.00 -1.02 0.00 0.00 39.78 35.25 1xn2 n ASN 209 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1xn2 n GLY 210 N -1.63 2.01 3.63 7.41 0.00 -1.26 -4.98 105.19 110.37 1xn2 n GLY 210 Ca -0.24 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 1xn2 n GLY 210 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1xn2 s GLN 211 N -0.02 4.14 0.16 1.61 0.74 -0.23 -4.96 119.66 121.10 1xn2 s GLN 211 Ca 0.00 0.70 -0.31 0.00 0.05 0.00 0.00 55.36 55.79 1xn2 s GLN 211 Cb 0.00 -3.65 -0.11 0.00 1.10 0.00 0.00 33.01 30.36 1xn2 s GLN 211 CO 0.00 -0.44 1.72 0.34 -0.55 0.00 0.00 175.29 176.35 1xn2 s ASP 212 N 1.41 6.46 0.55 6.67 2.15 -1.26 -0.95 116.67 131.70 1xn2 s ASP 212 Ca 0.29 2.74 0.32 0.00 0.43 0.00 0.00 52.55 56.34 1xn2 s ASP 212 Cb -0.15 -2.58 1.50 0.00 -0.30 0.00 0.00 42.92 41.38 1xn2 s ASP 212 CO 0.08 -0.94 2.05 0.25 -0.17 0.00 0.00 175.17 176.44 1xn2 h LEU 213 N 7.59 0.00 -1.41 -1.34 5.85 -1.54 -3.47 115.31 120.98 1xn2 h LEU 213 Ca -0.44 0.00 -0.43 0.00 0.84 0.00 0.00 57.88 57.85 1xn2 h LEU 213 Cb 1.21 0.00 0.04 0.00 0.37 0.00 0.00 40.66 42.28 1xn2 h LEU 213 CO 0.94 0.07 -0.79 1.17 -0.34 0.00 0.00 178.44 179.49 1xn2 n LYS 214 N -3.28 -5.53 -3.94 1.25 4.81 -1.26 -5.01 118.16 105.20 1xn2 n LYS 214 Ca -0.01 0.65 -0.21 0.00 -0.87 0.00 0.00 58.31 57.87 1xn2 n LYS 214 Cb 0.27 -5.40 -0.04 0.00 0.02 0.00 0.00 35.03 29.88 1xn2 n LYS 214 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 1xn2 s MET 215 N -6.19 2.89 0.16 1.64 -1.94 -1.26 -5.04 119.30 109.56 1xn2 s MET 215 Ca 0.28 -1.13 -0.31 0.00 -1.71 0.00 0.00 55.69 52.82 1xn2 s MET 215 Cb -0.14 -2.57 -0.11 0.00 2.01 0.00 0.00 34.83 34.02 1xn2 s MET 215 CO 0.81 0.25 1.78 0.34 -0.01 0.00 0.00 175.02 178.19 1xn2 s ASP 216 N -3.94 6.40 0.60 3.03 3.68 -1.26 -4.84 116.67 120.35 1xn2 s ASP 216 Ca 0.37 2.81 0.37 0.00 2.13 0.00 0.00 52.55 58.23 1xn2 s ASP 216 Cb -0.07 -2.58 2.04 0.00 -1.45 0.00 0.00 42.92 40.85 1xn2 s ASP 216 CO 0.26 -0.99 2.14 0.00 0.13 0.00 0.00 175.17 176.72 1xn2 h LYS 218 N 0.00 0.35 -0.33 0.00 1.79 -1.80 -2.36 116.57 114.23 1xn2 h LYS 218 Ca 0.00 -0.07 -0.00 0.00 -2.18 0.00 0.00 60.65 58.40 1xn2 h LYS 218 Cb 0.14 -0.05 -0.02 0.00 -1.58 0.00 0.00 32.23 30.72 1xn2 h LYS 218 CO 0.00 0.42 0.20 0.93 -1.08 0.00 0.00 179.45 179.92 1xn2 h GLU 219 N 0.34 0.45 0.00 3.15 4.39 -1.37 -0.96 114.58 120.57 1xn2 h GLU 219 Ca 0.07 -0.03 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 1xn2 h GLU 219 Cb 0.31 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.86 1xn2 h GLU 219 CO 0.01 0.32 -0.11 1.88 -1.16 0.00 0.00 179.01 179.95 1xn2 h TYR 220 N 0.46 0.00 0.00 4.33 0.99 -1.56 -2.78 116.97 118.41 1xn2 h TYR 220 Ca 0.12 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.84 1xn2 h TYR 220 Cb -0.01 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 37.71 1xn2 h TYR 220 CO 0.00 0.11 -0.30 0.09 -0.00 0.00 0.00 178.16 178.06 1xn2 n ASN 221 N -3.36 1.90 -4.58 3.88 3.02 -0.76 -4.44 115.26 110.92 1xn2 n ASN 221 Ca -0.01 -3.40 -0.41 0.00 -0.03 0.00 0.00 54.58 50.74 1xn2 n ASN 221 Cb 0.30 -0.46 -0.03 0.00 -0.61 0.00 0.00 39.78 38.98 1xn2 n ASN 221 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1xn2 s TYR 222 N -2.83 1.61 0.00 3.10 5.04 -0.44 -1.43 117.35 122.41 1xn2 s TYR 222 Ca 0.34 0.77 0.00 0.00 -2.44 0.00 0.00 57.07 55.74 1xn2 s TYR 222 Cb 0.32 -4.03 0.00 0.00 0.35 0.00 0.00 41.96 38.60 1xn2 s TYR 222 CO -0.03 -2.87 0.00 -3.47 -1.34 0.00 0.00 175.55 167.85 1xn2 n ASP 223 N 11.73 0.00 -3.63 4.32 4.64 -1.26 -3.37 116.55 128.98 1xn2 n ASP 223 Ca 0.25 0.00 -0.00 0.00 -1.38 0.00 0.00 54.79 53.65 1xn2 n ASP 223 Cb 0.49 0.00 -0.01 0.00 -1.04 0.00 0.00 41.12 40.56 1xn2 n ASP 223 CO 0.00 0.00 0.00 -1.59 -0.82 0.00 0.00 177.20 174.79 1xn2 s LYS 224 N 0.00 0.49 -0.07 -0.67 -2.85 -0.51 -4.73 119.74 111.40 1xn2 s LYS 224 Ca 0.00 -0.26 0.01 0.00 -1.00 0.00 0.00 55.97 54.72 1xn2 s LYS 224 Cb 0.00 0.18 0.02 0.00 -2.06 0.00 0.00 37.83 35.97 1xn2 s LYS 224 CO 0.00 -0.22 -0.09 -1.12 0.10 0.00 0.00 175.35 174.02 1xn2 s SER 225 N -2.82 1.62 0.16 0.03 0.01 -1.26 -0.12 113.70 111.31 1xn2 s SER 225 Ca 0.13 -0.24 0.03 0.00 1.31 0.00 0.00 55.95 57.17 1xn2 s SER 225 Cb 0.03 -0.71 -0.05 0.00 0.21 0.00 0.00 66.02 65.50 1xn2 s SER 225 CO -0.03 -0.03 -0.05 0.27 0.41 0.00 0.00 173.24 173.81 1xn2 s ILE 226 N 0.98 0.91 -0.24 1.44 -4.36 -0.33 -1.13 121.20 118.47 1xn2 s ILE 226 Ca -0.09 -2.01 -0.09 0.00 -0.26 0.00 0.00 60.65 58.20 1xn2 s ILE 226 Cb -0.15 -1.96 -0.04 0.00 1.25 0.00 0.00 42.46 41.56 1xn2 s ILE 226 CO 0.00 -0.64 0.12 -0.69 0.24 0.00 0.00 174.94 173.97 1xn2 s VAL 227 N -3.50 4.92 -0.25 8.37 1.01 -0.80 -0.50 120.40 129.65 1xn2 s VAL 227 Ca 0.19 0.03 -0.04 0.00 0.00 0.00 0.00 61.98 62.16 1xn2 s VAL 227 Cb 0.05 -3.29 0.08 0.00 0.00 0.00 0.00 36.38 33.22 1xn2 s VAL 227 CO 0.02 0.35 0.10 -0.62 0.00 0.00 0.00 175.10 174.94 1xn2 s ASP 228 N 1.23 3.19 0.48 3.32 2.15 -0.45 -4.42 116.67 122.17 1xn2 s ASP 228 Ca 0.06 -1.09 0.32 0.00 0.43 0.00 0.00 52.55 52.27 1xn2 s ASP 228 Cb -0.14 -0.43 1.44 0.00 -0.30 0.00 0.00 42.92 43.49 1xn2 s ASP 228 CO 0.05 -0.39 1.96 0.77 -0.17 0.00 0.00 175.17 177.39 1xn2 h SER 229 N 8.34 0.00 -0.37 -0.34 4.64 -1.85 -2.49 113.55 121.48 1xn2 h SER 229 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1xn2 h SER 229 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1xn2 h SER 229 CO 0.39 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.96 1xn2 n GLY 230 N -0.27 0.77 3.28 -0.77 0.00 -1.26 -4.54 105.19 102.40 1xn2 n GLY 230 Ca 0.00 -0.41 -0.32 0.00 0.00 0.00 0.00 46.02 45.29 1xn2 n GLY 230 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xn2 s THR 231 N -1.51 2.41 0.01 2.61 2.01 -0.94 -5.02 115.64 115.22 1xn2 s THR 231 Ca 0.25 -0.90 -0.25 0.00 0.31 0.00 0.00 61.69 61.09 1xn2 s THR 231 Cb 0.13 -1.95 -0.16 0.00 0.01 0.00 0.00 72.50 70.53 1xn2 s THR 231 CO 0.17 0.55 1.24 0.74 -0.69 0.00 0.00 174.62 176.63 1xn2 h THR 232 N 5.49 0.59 -3.69 -0.82 2.02 -1.87 0.27 112.91 114.90 1xn2 h THR 232 Ca -0.24 -0.51 -0.46 0.00 0.77 0.00 0.00 66.41 65.97 1xn2 h THR 232 Cb 1.22 0.82 0.09 0.00 -1.74 0.00 0.00 68.15 68.54 1xn2 h THR 232 CO 0.50 0.09 0.25 0.20 0.37 0.00 0.00 175.52 176.93 1xn2 s ASN 233 N -4.97 4.57 -0.29 4.18 0.01 -1.26 -1.26 114.94 115.92 1xn2 s ASN 233 Ca -0.14 0.38 -0.20 0.00 -0.71 0.00 0.00 52.86 52.19 1xn2 s ASN 233 Cb 0.02 -0.93 -0.01 0.00 0.41 0.00 0.00 41.25 40.74 1xn2 s ASN 233 CO 0.53 -1.76 0.60 -0.22 -1.51 0.00 0.00 177.10 174.74 1xn2 s LEU 234 N -5.33 4.13 -0.09 0.60 0.20 -0.65 -2.29 118.68 115.26 1xn2 s LEU 234 Ca 0.62 0.46 0.00 0.00 0.69 0.00 0.00 54.13 55.91 1xn2 s LEU 234 Cb -0.10 -2.78 -0.03 0.00 -0.43 0.00 0.00 46.19 42.85 1xn2 s LEU 234 CO 0.46 -0.43 -0.08 -0.13 -0.29 0.00 0.00 176.35 175.88 1xn2 s ARG 235 N 2.53 2.95 0.05 1.98 0.52 0.27 -1.50 118.95 125.75 1xn2 s ARG 235 Ca 0.24 -0.58 0.06 0.00 -0.52 0.00 0.00 55.73 54.94 1xn2 s ARG 235 Cb -0.15 -2.62 -0.02 0.00 0.52 0.00 0.00 34.95 32.67 1xn2 s ARG 235 CO 0.11 0.53 -0.18 -0.51 0.02 0.00 0.00 175.30 175.27 1xn2 s LEU 236 N -0.46 2.18 0.53 2.53 1.43 0.05 -0.44 118.68 124.51 1xn2 s LEU 236 Ca 0.07 -0.51 -0.21 0.00 -1.03 0.00 0.00 54.13 52.44 1xn2 s LEU 236 Cb -0.12 -0.80 -0.07 0.00 0.03 0.00 0.00 46.19 45.22 1xn2 s LEU 236 CO 0.02 0.09 0.95 -2.65 0.23 0.00 0.00 176.35 174.99 1xn2 n PRO 237 N 1.78 1.07 -0.37 1.29 -0.02 -1.26 -0.09 135.00 137.40 1xn2 n PRO 237 Ca -0.18 0.40 -0.09 0.00 -2.02 0.00 0.00 63.50 61.61 1xn2 n PRO 237 Cb 0.54 -2.09 -0.07 0.00 -0.02 0.00 0.00 33.50 31.85 1xn2 n PRO 237 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1xn2 n LYS 238 N -0.47 -0.37 -0.17 -0.52 4.81 -1.12 -0.86 118.16 119.46 1xn2 n LYS 238 Ca 0.12 1.34 -0.03 0.00 -0.87 0.00 0.00 58.31 58.86 1xn2 n LYS 238 Cb 0.44 -1.97 0.07 0.00 0.02 0.00 0.00 35.03 33.59 1xn2 n LYS 238 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 1xn2 h LYS 239 N 0.00 0.42 -0.44 1.64 1.57 -1.93 -1.00 116.57 116.84 1xn2 h LYS 239 Ca 0.16 -0.03 -0.06 0.00 -1.87 0.00 0.00 60.65 58.85 1xn2 h LYS 239 Cb 0.38 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.58 1xn2 h LYS 239 CO -0.84 0.28 0.02 0.28 -0.57 0.00 0.00 179.45 178.63 1xn2 h VAL 240 N 0.43 1.26 -0.48 0.50 2.07 -1.64 -2.27 116.25 116.13 1xn2 h VAL 240 Ca 0.25 -1.00 0.02 0.00 0.82 0.00 0.00 66.70 66.79 1xn2 h VAL 240 Cb 0.23 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1xn2 h VAL 240 CO -0.22 0.34 0.29 0.15 0.02 0.00 0.00 177.57 178.16 1xn2 h PHE 241 N 0.60 0.55 -0.53 1.57 3.57 -0.63 0.36 116.94 122.44 1xn2 h PHE 241 Ca 0.13 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.62 1xn2 h PHE 241 Cb 0.46 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 1xn2 h PHE 241 CO 0.03 0.33 0.23 0.93 -2.23 0.00 0.00 178.31 177.60 1xn2 h GLU 242 N 0.59 0.78 -0.54 1.11 4.39 -1.05 -0.06 114.58 119.80 1xn2 h GLU 242 Ca 0.19 -0.13 -0.11 0.00 0.34 0.00 0.00 59.36 59.65 1xn2 h GLU 242 Cb -0.01 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 1xn2 h GLU 242 CO -0.07 0.66 -0.10 0.00 -1.16 0.00 0.00 179.01 178.34 1xn2 h ALA 243 N 1.07 0.74 -0.20 3.43 0.00 -1.02 -1.83 119.26 121.46 1xn2 h ALA 243 Ca 0.18 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1xn2 h ALA 243 Cb 0.16 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1xn2 h ALA 243 CO -0.02 0.65 0.09 0.00 0.00 0.00 0.00 179.25 179.97 1xn2 h ALA 244 N 0.92 0.25 -0.53 0.00 0.00 0.02 -1.77 119.26 118.15 1xn2 h ALA 244 Ca 0.14 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1xn2 h ALA 244 Cb 0.67 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1xn2 h ALA 244 CO 0.05 -0.17 0.09 0.28 0.00 0.00 0.00 179.25 179.50 1xn2 h VAL 245 N 0.18 1.23 -0.41 0.00 2.07 -0.95 0.42 116.25 118.79 1xn2 h VAL 245 Ca 0.07 -0.88 -0.00 0.00 0.82 0.00 0.00 66.70 66.70 1xn2 h VAL 245 Cb 0.14 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 1xn2 h VAL 245 CO -0.01 0.32 0.25 0.50 0.02 0.00 0.00 177.57 178.66 1xn2 h LYS 246 N 0.80 0.55 -0.46 1.57 3.64 -1.16 0.58 116.57 122.10 1xn2 h LYS 246 Ca 0.17 -0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.38 1xn2 h LYS 246 Cb 0.35 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 1xn2 h LYS 246 CO 0.00 0.40 -0.19 1.03 -2.27 0.00 0.00 179.45 178.43 1xn2 h SER 247 N 0.54 0.92 -0.23 4.20 0.87 -0.85 -1.91 113.55 117.10 1xn2 h SER 247 Ca 0.15 -0.33 -0.12 0.00 -1.23 0.00 0.00 61.79 60.25 1xn2 h SER 247 Cb -0.01 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 61.68 1xn2 h SER 247 CO -0.03 1.09 -0.29 0.40 -0.53 0.00 0.00 176.83 177.47 1xn2 h ILE 248 N 0.80 1.28 -0.35 2.23 2.04 -0.71 -1.57 117.51 121.22 1xn2 h ILE 248 Ca 0.11 -1.42 -0.02 0.00 1.00 0.00 0.00 64.86 64.53 1xn2 h ILE 248 Cb 0.74 1.32 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 1xn2 h ILE 248 CO 0.06 0.47 0.15 0.11 0.00 0.00 0.00 178.15 178.93 1xn2 h LYS 249 N 0.63 0.52 -0.70 2.37 1.57 -0.79 -1.72 116.57 118.44 1xn2 h LYS 249 Ca 0.07 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1xn2 h LYS 249 Cb 0.81 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.00 1xn2 h LYS 249 CO 0.07 0.50 0.46 0.00 -0.57 0.00 0.00 179.45 179.90 1xn2 h ALA 250 N 0.99 0.89 0.00 3.86 0.00 -1.16 -0.94 119.26 122.91 1xn2 h ALA 250 Ca 0.12 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1xn2 h ALA 250 Cb 0.17 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1xn2 h ALA 250 CO -0.01 0.33 -0.30 0.00 0.00 0.00 0.00 179.25 179.27 1xn2 h ALA 251 N 1.25 1.30 -0.33 0.00 0.00 -1.08 -3.12 119.26 117.29 1xn2 h ALA 251 Ca 0.26 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xn2 h ALA 251 Cb -0.09 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1xn2 h ALA 251 CO -0.05 0.38 0.00 -1.13 0.00 0.00 0.00 179.25 178.44 1xn2 n SER 252 N -3.89 4.27 0.00 0.00 3.41 -0.67 -4.73 113.62 112.02 1xn2 n SER 252 Ca -0.02 -3.00 0.04 0.00 -0.26 0.00 0.00 58.87 55.64 1xn2 n SER 252 Cb 0.38 -0.57 0.20 0.00 -0.26 0.00 0.00 64.21 63.95 1xn2 n SER 252 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1xn2 n SER 253 N -0.27 0.00 0.02 4.04 3.41 -0.42 -2.24 113.62 118.17 1xn2 n SER 253 Ca 0.23 0.09 0.08 0.00 -0.26 0.00 0.00 58.87 59.01 1xn2 n SER 253 Cb 0.95 -0.22 0.35 0.00 -0.26 0.00 0.00 64.21 65.03 1xn2 n SER 253 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1xn2 n THR 254 N -1.22 0.93 -4.22 6.66 -2.24 -1.26 -4.48 114.28 108.45 1xn2 n THR 254 Ca 0.04 0.23 -0.19 0.00 -2.27 0.00 0.00 64.05 61.87 1xn2 n THR 254 Cb 0.05 -1.01 -0.16 0.00 -2.10 0.00 0.00 70.33 67.12 1xn2 n THR 254 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1xn2 s GLU 255 N -3.06 0.72 -0.11 -0.78 2.02 -0.95 -5.15 118.70 111.40 1xn2 s GLU 255 Ca 0.07 -0.18 -0.05 0.00 0.02 0.00 0.00 54.97 54.83 1xn2 s GLU 255 Cb 0.10 -0.71 -0.04 0.00 0.10 0.00 0.00 34.13 33.58 1xn2 s GLU 255 CO 0.30 0.03 0.07 0.15 0.02 0.00 0.00 175.26 175.83 1xn2 s LYS 256 N 0.40 3.27 0.03 1.61 -0.14 -1.26 -4.93 119.74 118.72 1xn2 s LYS 256 Ca -0.05 -0.27 0.07 0.00 -1.36 0.00 0.00 55.97 54.36 1xn2 s LYS 256 Cb -0.09 -3.02 -0.02 0.00 -1.68 0.00 0.00 37.83 33.02 1xn2 s LYS 256 CO 0.00 0.71 -0.20 -0.06 -0.76 0.00 0.00 175.35 175.04 1xn2 s PHE 257 N -0.87 1.79 0.68 3.18 0.40 -1.26 -5.12 117.98 116.78 1xn2 s PHE 257 Ca 0.13 -0.37 -0.17 0.00 -0.60 0.00 0.00 56.93 55.93 1xn2 s PHE 257 Cb -0.12 -1.09 -0.01 0.00 0.51 0.00 0.00 43.02 42.32 1xn2 s PHE 257 CO 0.03 0.07 1.06 -0.35 0.70 0.00 0.00 175.22 176.73 1xn2 n PRO 258 N 2.00 0.73 0.21 0.24 -0.04 -1.26 -4.86 135.00 132.02 1xn2 n PRO 258 Ca -0.17 0.30 0.13 0.00 -0.04 0.00 0.00 63.50 63.73 1xn2 n PRO 258 Cb 0.53 -2.30 0.72 0.00 -0.04 0.00 0.00 33.50 32.42 1xn2 n PRO 258 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1xn2 h ASP 259 N 0.08 0.00 -0.03 3.54 3.32 -2.00 -0.11 116.42 121.22 1xn2 h ASP 259 Ca -0.49 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.53 1xn2 h ASP 259 Cb 1.34 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.88 1xn2 h ASP 259 CO 0.49 0.00 -0.06 1.23 -1.72 0.00 0.00 179.24 179.18 1xn2 h GLY 260 N 0.00 0.23 0.77 2.75 0.00 -1.94 -2.32 103.07 102.57 1xn2 h GLY 260 Ca 0.06 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.25 1xn2 h GLY 260 CO -0.00 0.12 -0.13 -2.75 0.00 0.00 0.00 176.54 173.78 1xn2 h PHE 261 N 0.21 -0.33 0.00 5.60 3.57 -1.17 0.26 116.94 125.08 1xn2 h PHE 261 Ca 0.05 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1xn2 h PHE 261 Cb 0.25 0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.10 1xn2 h PHE 261 CO 0.00 -0.05 -0.04 -1.49 -2.23 0.00 0.00 178.31 174.50 1xn2 h TRP 262 N -0.59 0.00 -0.28 0.41 4.06 -1.51 -0.28 115.95 117.76 1xn2 h TRP 262 Ca -0.04 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.91 1xn2 h TRP 262 Cb 0.43 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.59 1xn2 h TRP 262 CO 0.00 0.04 0.00 1.28 -3.56 0.00 0.00 178.44 176.20 1xn2 n LEU 263 N -3.51 2.65 -0.88 -4.49 4.77 -0.89 -4.94 117.00 109.70 1xn2 n LEU 263 Ca -0.02 -1.12 -0.10 0.00 -0.03 0.00 0.00 56.01 54.74 1xn2 n LEU 263 Cb 0.14 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 41.02 1xn2 n LEU 263 CO 0.26 0.56 -0.10 0.61 -1.33 0.00 0.00 177.39 177.39 1xn2 n GLY 264 N 1.33 0.71 0.01 -0.72 0.00 -0.12 -4.91 105.19 101.49 1xn2 n GLY 264 Ca 0.18 -0.55 0.11 0.00 0.00 0.00 0.00 46.02 45.76 1xn2 n GLY 264 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xn2 n GLU 265 N -2.43 0.31 -3.77 1.61 -0.58 0.88 -4.97 120.64 111.68 1xn2 n GLU 265 Ca -0.10 -0.07 -0.09 0.00 -0.42 0.00 0.00 57.16 56.47 1xn2 n GLU 265 Cb 0.42 -1.53 -0.06 0.00 -0.57 0.00 0.00 31.44 29.69 1xn2 n GLU 265 CO 0.00 0.00 0.00 1.14 -0.48 0.00 0.00 177.13 177.79 1xn2 s GLN 266 N -3.23 0.94 0.39 3.49 -2.07 -1.07 -4.96 119.66 113.14 1xn2 s GLN 266 Ca 0.01 -0.87 0.07 0.00 -1.82 0.00 0.00 55.36 52.76 1xn2 s GLN 266 Cb 0.15 0.39 0.00 0.00 -1.09 0.00 0.00 33.01 32.46 1xn2 s GLN 266 CO 0.86 -0.33 0.53 -0.48 -1.32 0.00 0.00 175.29 174.56 1xn2 s LEU 267 N -2.84 3.79 -0.02 2.60 0.05 -1.26 -4.20 118.68 116.80 1xn2 s LEU 267 Ca 0.04 -0.31 0.07 0.00 0.05 0.00 0.00 54.13 53.99 1xn2 s LEU 267 Cb 0.04 -2.71 -0.02 0.00 -2.05 0.00 0.00 46.19 41.45 1xn2 s LEU 267 CO -0.11 -0.62 -0.24 -0.69 -0.55 0.00 0.00 176.35 174.13 1xn2 s VAL 268 N -2.28 1.90 0.07 1.48 1.01 -0.52 -4.94 120.40 117.11 1xn2 s VAL 268 Ca 0.51 -1.03 0.06 0.00 0.00 0.00 0.00 61.98 61.51 1xn2 s VAL 268 Cb -0.10 -1.57 -0.03 0.00 0.00 0.00 0.00 36.38 34.68 1xn2 s VAL 268 CO 0.32 0.53 -0.16 0.00 0.00 0.00 0.00 175.10 175.80 1xn2 s TRP 270 N -1.17 0.93 0.34 0.00 0.51 -0.29 -4.96 118.94 114.30 1xn2 s TRP 270 Ca 0.00 -0.75 -0.28 0.00 -2.12 0.00 0.00 56.10 52.95 1xn2 s TRP 270 Cb -0.10 -0.52 -0.12 0.00 -0.81 0.00 0.00 33.47 31.92 1xn2 s TRP 270 CO 0.02 -0.08 1.33 1.04 -0.51 0.00 0.00 176.95 178.76 1xn2 n GLN 271 N 0.40 2.22 -1.51 4.98 6.02 -1.26 0.06 117.38 128.28 1xn2 n GLN 271 Ca -0.15 0.78 -0.55 0.00 -0.01 0.00 0.00 57.00 57.07 1xn2 n GLN 271 Cb 0.59 -2.39 -0.07 0.00 1.02 0.00 0.00 30.24 29.39 1xn2 n GLN 271 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1xn2 n ALA 272 N 0.48 -2.80 -0.13 -1.58 0.00 -1.26 -0.93 120.51 114.29 1xn2 n ALA 272 Ca 0.05 0.55 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1xn2 n ALA 272 Cb 0.36 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 17.99 1xn2 n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xn2 n GLY 273 N 1.79 2.73 1.34 0.00 0.00 -1.26 -4.88 105.19 104.91 1xn2 n GLY 273 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.32 1xn2 n GLY 273 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xn2 n THR 274 N -2.00 1.17 -1.66 2.61 -2.24 -0.11 -4.99 114.28 107.07 1xn2 n THR 274 Ca 0.00 -1.05 -0.50 0.00 -2.27 0.00 0.00 64.05 60.23 1xn2 n THR 274 Cb 0.00 0.42 -0.05 0.00 -2.10 0.00 0.00 70.33 68.60 1xn2 n THR 274 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1xn2 n THR 275 N 1.44 0.20 -1.84 4.28 -1.04 -1.26 -4.82 114.28 111.23 1xn2 n THR 275 Ca 0.24 -0.04 -0.41 0.00 -2.04 0.00 0.00 64.05 61.80 1xn2 n THR 275 Cb 0.66 -1.38 -0.01 0.00 -1.82 0.00 0.00 70.33 67.78 1xn2 n THR 275 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1xn2 n PRO 276 N 4.36 3.58 -0.30 -2.82 -0.04 -1.26 -4.76 135.00 133.77 1xn2 n PRO 276 Ca 0.21 -2.92 0.10 0.00 -0.04 0.00 0.00 63.50 60.85 1xn2 n PRO 276 Cb 0.23 -2.96 0.26 0.00 -0.04 0.00 0.00 33.50 31.00 1xn2 n PRO 276 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1xn2 h TRP 277 N 5.44 0.68 -0.07 0.54 4.06 -1.96 -1.56 115.95 123.08 1xn2 h TRP 277 Ca 0.62 0.04 0.02 0.00 2.06 0.00 0.00 58.89 61.63 1xn2 h TRP 277 Cb 0.49 -0.17 -0.00 0.00 -1.00 0.00 0.00 29.16 28.48 1xn2 h TRP 277 CO 1.53 0.05 0.15 -2.95 -3.56 0.00 0.00 178.44 173.66 1xn2 h ASN 278 N 0.49 0.00 1.83 -3.49 7.08 -2.01 -1.64 115.58 117.85 1xn2 h ASN 278 Ca 0.51 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.73 1xn2 h ASN 278 Cb 0.86 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.10 1xn2 h ASN 278 CO -0.45 0.00 -0.06 0.16 -2.08 0.00 0.00 177.43 175.00 1xn2 h ILE 279 N 0.00 0.00 -3.38 6.14 3.07 -1.65 -3.44 117.51 118.25 1xn2 h ILE 279 Ca 0.03 -0.89 -0.55 0.00 1.55 0.00 0.00 64.86 65.00 1xn2 h ILE 279 Cb 0.33 1.86 -0.04 0.00 -0.27 0.00 0.00 36.82 38.70 1xn2 h ILE 279 CO -0.00 0.00 0.05 -0.36 -1.05 0.00 0.00 178.15 176.79 1xn2 s PHE 280 N -3.20 3.80 0.57 0.16 0.08 -0.62 -3.88 117.98 114.90 1xn2 s PHE 280 Ca 0.07 1.38 -0.12 0.00 0.12 0.00 0.00 56.93 58.39 1xn2 s PHE 280 Cb 0.07 -2.59 -0.05 0.00 -0.57 0.00 0.00 43.02 39.88 1xn2 s PHE 280 CO 0.66 0.51 0.99 -1.25 -0.10 0.00 0.00 175.22 176.04 1xn2 s PRO 281 N -1.33 3.70 0.57 0.24 0.04 -1.26 -4.80 135.00 132.16 1xn2 s PRO 281 Ca 0.34 0.76 -0.07 0.00 0.04 0.00 0.00 61.00 62.06 1xn2 s PRO 281 Cb -0.20 -2.13 -0.02 0.00 0.04 0.00 0.00 34.50 32.20 1xn2 s PRO 281 CO 0.21 -0.45 0.91 0.14 0.04 0.00 0.00 177.00 177.86 1xn2 s VAL 282 N -2.97 4.38 -0.07 -0.36 -7.23 -1.26 -4.30 120.40 108.59 1xn2 s VAL 282 Ca 0.55 0.34 0.02 0.00 -1.81 0.00 0.00 61.98 61.09 1xn2 s VAL 282 Cb -0.11 -3.72 0.01 0.00 0.56 0.00 0.00 36.38 33.13 1xn2 s VAL 282 CO 0.46 -0.80 -0.12 -0.63 -0.31 0.00 0.00 175.10 173.71 1xn2 s ILE 283 N -2.98 1.10 -0.10 -0.62 1.01 -0.44 -1.14 121.20 118.03 1xn2 s ILE 283 Ca 0.52 -0.45 0.02 0.00 0.00 0.00 0.00 60.65 60.75 1xn2 s ILE 283 Cb -0.11 -1.02 -0.01 0.00 0.01 0.00 0.00 42.46 41.33 1xn2 s ILE 283 CO 0.48 0.35 -0.18 -0.44 0.00 0.00 0.00 174.94 175.15 1xn2 s SER 284 N 0.76 3.65 -0.14 3.58 0.01 -0.68 -0.28 113.70 120.60 1xn2 s SER 284 Ca -0.13 -0.39 0.01 0.00 1.31 0.00 0.00 55.95 56.75 1xn2 s SER 284 Cb -0.15 -1.33 -0.00 0.00 0.21 0.00 0.00 66.02 64.74 1xn2 s SER 284 CO 0.03 0.20 -0.16 -0.76 0.41 0.00 0.00 173.24 172.96 1xn2 s LEU 285 N 0.11 2.49 -0.07 2.44 1.43 0.03 -1.42 118.68 123.69 1xn2 s LEU 285 Ca -0.08 -0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 52.46 1xn2 s LEU 285 Cb -0.15 -1.55 -0.05 0.00 0.03 0.00 0.00 46.19 44.46 1xn2 s LEU 285 CO 0.05 0.12 0.29 -0.31 0.23 0.00 0.00 176.35 176.73 1xn2 s TYR 286 N 0.63 3.65 0.09 0.29 1.51 0.59 -1.05 117.35 123.06 1xn2 s TYR 286 Ca -0.09 0.77 0.09 0.00 -1.01 0.00 0.00 57.07 56.84 1xn2 s TYR 286 Cb -0.16 -2.16 -0.03 0.00 -0.11 0.00 0.00 41.96 39.50 1xn2 s TYR 286 CO 0.03 0.64 -0.24 -0.51 -1.11 0.00 0.00 175.55 174.35 1xn2 s LEU 287 N -0.89 2.26 0.34 -1.29 1.43 0.53 -0.71 118.68 120.36 1xn2 s LEU 287 Ca 0.19 -0.67 -0.29 0.00 -1.03 0.00 0.00 54.13 52.34 1xn2 s LEU 287 Cb -0.14 -1.11 -0.12 0.00 0.03 0.00 0.00 46.19 44.85 1xn2 s LEU 287 CO 0.09 0.16 1.44 0.80 0.23 0.00 0.00 176.35 179.07 1xn2 n MET 288 N 1.28 2.46 -2.69 1.70 0.00 -0.99 -1.73 117.12 117.15 1xn2 n MET 288 Ca -0.18 0.87 -0.23 0.00 -0.00 0.00 0.00 57.70 58.16 1xn2 n MET 288 Cb 0.53 -2.56 0.11 0.00 0.00 0.00 0.00 33.22 31.30 1xn2 n MET 288 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1xn2 s GLY 289 N -0.04 1.74 0.39 -5.12 0.00 0.46 -4.12 107.32 100.63 1xn2 s GLY 289 Ca 0.57 -1.90 0.22 0.00 0.00 0.00 0.00 44.72 43.61 1xn2 s GLY 289 CO 0.59 -1.32 1.51 0.83 0.00 0.00 0.00 173.10 174.72 1xn2 h GLU 290 N -0.44 0.00 -5.92 2.90 5.08 -1.82 -3.41 114.58 110.98 1xn2 h GLU 290 Ca -0.34 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.41 1xn2 h GLU 290 Cb 1.27 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.46 1xn2 h GLU 290 CO 0.38 0.07 -0.23 0.08 -1.00 0.00 0.00 179.01 178.31 1xn2 s VAL 291 N -3.19 5.11 0.20 3.13 1.01 -1.26 -5.03 120.40 120.37 1xn2 s VAL 291 Ca 0.06 0.77 -0.32 0.00 0.00 0.00 0.00 61.98 62.48 1xn2 s VAL 291 Cb 0.06 -3.69 -0.14 0.00 0.00 0.00 0.00 36.38 32.61 1xn2 s VAL 291 CO 0.70 0.55 1.40 0.41 0.00 0.00 0.00 175.10 178.15 1xn2 n THR 292 N 2.11 0.71 -2.15 3.92 -1.04 -1.26 -1.70 114.28 114.86 1xn2 n THR 292 Ca -0.14 -0.18 -0.19 0.00 -2.04 0.00 0.00 64.05 61.50 1xn2 n THR 292 Cb 0.52 -1.34 -0.03 0.00 -1.82 0.00 0.00 70.33 67.66 1xn2 n THR 292 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1xn2 n ASN 293 N 2.39 -5.52 -4.17 8.00 3.02 -1.26 -4.98 115.26 112.73 1xn2 n ASN 293 Ca 0.14 0.12 -0.24 0.00 -0.03 0.00 0.00 54.58 54.56 1xn2 n ASN 293 Cb 0.29 -4.61 -0.15 0.00 -0.61 0.00 0.00 39.78 34.71 1xn2 n ASN 293 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1xn2 s GLN 294 N -4.62 1.30 0.21 3.52 0.74 -0.69 -1.88 119.66 118.25 1xn2 s GLN 294 Ca 0.00 -0.70 -0.01 0.00 0.05 0.00 0.00 55.36 54.70 1xn2 s GLN 294 Cb 0.00 -1.30 -0.04 0.00 1.10 0.00 0.00 33.01 32.77 1xn2 s GLN 294 CO 0.00 0.35 0.16 -1.54 -0.55 0.00 0.00 175.29 173.70 1xn2 s SER 295 N -0.69 0.22 0.19 6.67 1.04 -0.42 -0.41 113.70 120.30 1xn2 s SER 295 Ca 0.06 -1.39 -0.01 0.00 0.48 0.00 0.00 55.95 55.09 1xn2 s SER 295 Cb -0.07 0.40 -0.04 0.00 0.10 0.00 0.00 66.02 66.41 1xn2 s SER 295 CO 0.00 -0.87 0.12 0.72 0.98 0.00 0.00 173.24 174.20 1xn2 s PHE 296 N -4.11 1.09 0.08 5.02 -0.12 -0.71 -0.64 117.98 118.59 1xn2 s PHE 296 Ca 0.38 -1.34 0.05 0.00 -0.05 0.00 0.00 56.93 55.97 1xn2 s PHE 296 Cb 0.06 -0.53 -0.03 0.00 -0.63 0.00 0.00 43.02 41.89 1xn2 s PHE 296 CO 0.13 -0.63 -0.13 -0.98 -0.05 0.00 0.00 175.22 173.56 1xn2 s ARG 297 N -4.14 0.84 -0.04 1.99 1.70 0.61 -0.35 118.95 119.57 1xn2 s ARG 297 Ca 0.36 -1.03 0.06 0.00 -0.47 0.00 0.00 55.73 54.65 1xn2 s ARG 297 Cb 0.07 -0.74 -0.02 0.00 -0.57 0.00 0.00 34.95 33.69 1xn2 s ARG 297 CO 0.10 0.15 -0.21 0.96 -1.08 0.00 0.00 175.30 175.22 1xn2 s ILE 298 N -1.66 2.46 -0.09 4.99 -4.36 -0.22 -1.13 121.20 121.19 1xn2 s ILE 298 Ca 0.01 -0.95 0.03 0.00 -0.26 0.00 0.00 60.65 59.48 1xn2 s ILE 298 Cb -0.08 -1.91 0.01 0.00 1.25 0.00 0.00 42.46 41.73 1xn2 s ILE 298 CO 0.02 0.58 -0.19 -0.89 0.24 0.00 0.00 174.94 174.70 1xn2 s THR 299 N -0.58 1.67 0.25 8.37 2.01 0.17 -0.79 115.64 126.74 1xn2 s THR 299 Ca 0.09 -0.78 0.10 0.00 0.31 0.00 0.00 61.69 61.41 1xn2 s THR 299 Cb -0.11 -1.47 -0.05 0.00 0.01 0.00 0.00 72.50 70.89 1xn2 s THR 299 CO 0.00 0.47 -0.10 0.27 -0.69 0.00 0.00 174.62 174.58 1xn2 s ILE 300 N 0.53 3.03 0.41 1.82 -4.36 0.61 -2.07 121.20 121.17 1xn2 s ILE 300 Ca -0.16 -2.04 0.08 0.00 -0.26 0.00 0.00 60.65 58.26 1xn2 s ILE 300 Cb -0.17 -2.59 -0.02 0.00 1.25 0.00 0.00 42.46 40.94 1xn2 s ILE 300 CO 0.06 -0.33 0.39 -0.76 0.24 0.00 0.00 174.94 174.54 1xn2 s LEU 301 N -3.43 3.46 0.56 0.37 1.43 -1.26 -1.33 118.68 118.48 1xn2 s LEU 301 Ca 0.29 -0.67 0.31 0.00 -1.03 0.00 0.00 54.13 53.04 1xn2 s LEU 301 Cb -0.06 -2.16 1.68 0.00 0.03 0.00 0.00 46.19 45.67 1xn2 s LEU 301 CO 0.17 -0.62 2.15 1.55 0.23 0.00 0.00 176.35 179.82 1xn2 h PRO 302 N 1.01 0.00 0.00 1.29 0.13 -1.87 0.15 132.00 132.70 1xn2 h PRO 302 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1xn2 h PRO 302 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1xn2 h PRO 302 CO 0.56 0.07 0.00 1.96 -0.23 0.00 0.00 178.00 180.36 1xn2 h GLN 303 N 0.00 0.00 0.00 0.86 7.50 -1.86 0.87 115.11 122.48 1xn2 h GLN 303 Ca -0.00 0.00 -0.27 0.00 0.50 0.00 0.00 58.65 58.88 1xn2 h GLN 303 Cb 0.24 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.73 1xn2 h GLN 303 CO 0.01 0.00 -1.49 1.04 -1.50 0.00 0.00 178.83 176.89 1xn2 n GLN 304 N -2.93 0.56 0.00 1.46 3.00 0.48 -4.53 117.38 115.43 1xn2 n GLN 304 Ca -0.02 0.51 0.15 0.00 -0.01 0.00 0.00 57.00 57.63 1xn2 n GLN 304 Cb 0.09 -1.69 0.74 0.00 0.00 0.00 0.00 30.24 29.37 1xn2 n GLN 304 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.06 179.54 1xn2 n TYR 305 N -4.40 0.00 -3.73 1.08 0.18 -1.03 -4.49 117.16 104.77 1xn2 n TYR 305 Ca -0.36 0.00 -0.38 0.00 1.88 0.00 0.00 57.90 59.04 1xn2 n TYR 305 Cb 0.71 -0.14 -0.12 0.00 -0.38 0.00 0.00 39.34 39.40 1xn2 n TYR 305 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1xn2 s LEU 306 N -2.32 4.45 -0.15 -3.48 1.43 0.27 0.13 118.68 119.01 1xn2 s LEU 306 Ca 0.35 -1.18 -0.22 0.00 -1.03 0.00 0.00 54.13 52.05 1xn2 s LEU 306 Cb 0.21 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 1xn2 s LEU 306 CO 0.43 -0.36 0.67 -0.60 0.23 0.00 0.00 176.35 176.72 1xn2 s ARG 307 N 1.41 4.30 0.31 1.70 3.52 0.67 -4.78 118.95 126.08 1xn2 s ARG 307 Ca -0.01 0.73 -0.29 0.00 -0.13 0.00 0.00 55.73 56.04 1xn2 s ARG 307 Cb -0.20 -3.53 -0.10 0.00 -1.56 0.00 0.00 34.95 29.56 1xn2 s ARG 307 CO 0.03 -0.14 1.25 -2.14 -0.81 0.00 0.00 175.30 173.49 1xn2 s PRO 308 N 1.54 4.43 -0.01 5.12 0.02 -1.26 -0.43 135.00 144.41 1xn2 s PRO 308 Ca 0.32 2.09 0.01 0.00 0.02 0.00 0.00 61.00 63.45 1xn2 s PRO 308 Cb -0.16 -3.11 0.00 0.00 0.02 0.00 0.00 34.50 31.25 1xn2 s PRO 308 CO 0.13 -0.09 -0.04 0.14 -0.33 0.00 0.00 177.00 176.80 1xn2 s VAL 309 N -1.03 0.39 0.29 3.83 -7.23 -0.86 -4.72 120.40 111.06 1xn2 s VAL 309 Ca 0.48 -0.17 -0.30 0.00 -1.81 0.00 0.00 61.98 60.18 1xn2 s VAL 309 Cb -0.37 -0.35 -0.11 0.00 0.56 0.00 0.00 36.38 36.10 1xn2 s VAL 309 CO 0.48 0.13 1.55 -0.70 -0.31 0.00 0.00 175.10 176.25 1xn2 s GLU 310 N 0.10 4.16 0.56 4.82 2.56 -1.26 -4.21 118.70 125.43 1xn2 s GLU 310 Ca -0.01 2.51 -0.19 0.00 0.00 0.00 0.00 54.97 57.29 1xn2 s GLU 310 Cb -0.04 -3.04 -0.05 0.00 2.00 0.00 0.00 34.13 33.00 1xn2 s GLU 310 CO -0.00 -0.57 1.11 0.34 -0.56 0.00 0.00 175.26 175.58 1xn2 s ASP 311 N 0.39 5.69 -0.05 -1.70 2.15 -1.26 -5.01 116.67 116.89 1xn2 s ASP 311 Ca 0.61 2.10 -0.00 0.00 0.43 0.00 0.00 52.55 55.69 1xn2 s ASP 311 Cb -0.46 -2.57 -0.00 0.00 -0.30 0.00 0.00 42.92 39.58 1xn2 s ASP 311 CO 0.48 -1.23 0.03 -0.37 -0.17 0.00 0.00 175.17 173.91 1xn2 h VAL 312 N 1.00 0.00 -4.16 1.11 -1.51 -1.93 -3.46 116.25 107.30 1xn2 h VAL 312 Ca -0.49 -0.50 -0.50 0.00 -1.23 0.00 0.00 66.70 63.98 1xn2 h VAL 312 Cb 1.25 0.00 0.08 0.00 -2.13 0.00 0.00 31.29 30.49 1xn2 h VAL 312 CO 0.57 0.00 0.39 0.00 -1.23 0.00 0.00 177.57 177.30 1xn2 s ALA 313 N -2.81 2.65 -1.54 5.19 0.00 -1.26 -4.82 121.76 119.17 1xn2 s ALA 313 Ca -0.00 0.56 0.00 0.00 0.00 0.00 0.00 51.96 52.52 1xn2 s ALA 313 Cb 0.00 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.83 1xn2 s ALA 313 CO 0.01 -0.92 0.04 0.25 0.00 0.00 0.00 175.76 175.14 1xn2 n THR 314 N -1.91 0.00 -0.84 0.00 -2.24 -1.26 -4.75 114.28 103.27 1xn2 n THR 314 Ca 0.10 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.57 1xn2 n THR 314 Cb 0.52 -0.27 0.15 0.00 -2.10 0.00 0.00 70.33 68.63 1xn2 n THR 314 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1xn2 s SER 315 N -1.49 3.30 0.19 3.42 0.15 -1.26 -4.94 113.70 113.07 1xn2 s SER 315 Ca 0.00 2.08 0.11 0.00 0.70 0.00 0.00 55.95 58.84 1xn2 s SER 315 Cb 0.00 -2.55 -0.08 0.00 -1.71 0.00 0.00 66.02 61.68 1xn2 s SER 315 CO 0.00 -2.85 1.36 1.56 1.20 0.00 0.00 173.24 174.51 1xn2 h GLN 316 N -1.69 0.00 -0.16 5.44 1.08 -1.97 -3.48 115.11 114.32 1xn2 h GLN 316 Ca -0.43 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 56.75 1xn2 h GLN 316 Cb 1.26 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.69 1xn2 h GLN 316 CO 0.44 0.77 -0.00 -0.25 -0.95 0.00 0.00 178.83 178.84 1xn2 n ASP 317 N -3.29 -0.01 -4.62 1.46 9.92 -1.26 -4.21 116.55 114.53 1xn2 n ASP 317 Ca 0.01 0.03 -0.37 0.00 -0.53 0.00 0.00 54.79 53.93 1xn2 n ASP 317 Cb 0.84 -0.03 -0.10 0.00 -0.64 0.00 0.00 41.12 41.20 1xn2 n ASP 317 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1xn2 s ASP 318 N -0.01 6.08 0.15 -2.24 -0.00 0.11 -4.67 116.67 116.09 1xn2 s ASP 318 Ca 0.02 0.07 0.10 0.00 -0.00 0.00 0.00 52.55 52.73 1xn2 s ASP 318 Cb -0.03 -2.12 -0.04 0.00 -0.00 0.00 0.00 42.92 40.73 1xn2 s ASP 318 CO 0.02 -0.00 -0.17 0.00 -0.00 0.00 0.00 175.17 175.01 1xn2 s TYR 320 N -1.39 0.06 -0.00 0.00 1.51 0.14 -2.04 117.35 115.63 1xn2 s TYR 320 Ca 0.20 -0.32 0.03 0.00 -1.01 0.00 0.00 57.07 55.97 1xn2 s TYR 320 Cb -0.10 -0.02 -0.03 0.00 -0.11 0.00 0.00 41.96 41.70 1xn2 s TYR 320 CO 0.11 -0.47 -0.08 0.21 -1.11 0.00 0.00 175.55 174.21 1xn2 s LYS 321 N -2.91 2.53 -0.22 -0.62 2.20 0.42 -1.44 119.74 119.70 1xn2 s LYS 321 Ca -0.02 -0.73 -0.29 0.00 -0.36 0.00 0.00 55.97 54.57 1xn2 s LYS 321 Cb 0.01 -2.48 -0.01 0.00 -1.51 0.00 0.00 37.83 33.84 1xn2 s LYS 321 CO -0.06 0.60 1.25 0.12 -0.36 0.00 0.00 175.35 176.90 1xn2 s PHE 322 N -0.97 2.86 -0.55 4.03 5.36 -1.26 -0.24 117.98 127.21 1xn2 s PHE 322 Ca 0.16 1.02 0.01 0.00 -0.96 0.00 0.00 56.93 57.16 1xn2 s PHE 322 Cb -0.11 -3.61 0.56 0.00 -0.34 0.00 0.00 43.02 39.51 1xn2 s PHE 322 CO 0.07 -1.55 1.97 0.00 -1.46 0.00 0.00 175.22 174.25 1xn2 n ALA 323 N 6.91 5.94 -3.36 11.12 0.00 0.12 -4.63 120.51 136.61 1xn2 n ALA 323 Ca 0.14 -3.15 -0.30 0.00 0.00 0.00 0.00 53.44 50.13 1xn2 n ALA 323 Cb 0.46 -1.60 -0.17 0.00 0.00 0.00 0.00 19.45 18.13 1xn2 n ALA 323 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1xn2 s ILE 324 N -4.00 1.76 0.16 0.00 1.01 -1.26 -1.64 121.20 117.23 1xn2 s ILE 324 Ca 0.60 -0.84 -0.03 0.00 0.00 0.00 0.00 60.65 60.39 1xn2 s ILE 324 Cb 0.49 -1.55 -0.03 0.00 0.01 0.00 0.00 42.46 41.38 1xn2 s ILE 324 CO 0.05 0.49 0.13 -0.94 0.00 0.00 0.00 174.94 174.67 1xn2 s SER 325 N 0.52 0.21 0.55 3.58 1.04 -0.56 -4.84 113.70 114.20 1xn2 s SER 325 Ca -0.16 -1.18 -0.17 0.00 0.48 0.00 0.00 55.95 54.93 1xn2 s SER 325 Cb -0.17 0.35 -0.06 0.00 0.10 0.00 0.00 66.02 66.24 1xn2 s SER 325 CO 0.06 -0.80 1.03 0.00 0.98 0.00 0.00 173.24 174.51 1xn2 s GLN 326 N -4.06 3.61 0.05 4.02 -2.07 -1.26 -0.77 119.66 119.19 1xn2 s GLN 326 Ca 0.26 1.15 0.03 0.00 -1.82 0.00 0.00 55.36 54.98 1xn2 s GLN 326 Cb 0.06 -2.08 -0.03 0.00 -1.09 0.00 0.00 33.01 29.88 1xn2 s GLN 326 CO 0.04 -0.56 -0.10 0.45 -1.32 0.00 0.00 175.29 173.80 1xn2 s SER 327 N -2.74 1.13 0.00 12.60 0.15 0.88 -4.66 113.70 121.06 1xn2 s SER 327 Ca 0.63 -0.56 0.11 0.00 0.70 0.00 0.00 55.95 56.82 1xn2 s SER 327 Cb -0.14 0.00 0.17 0.00 -1.71 0.00 0.00 66.02 64.35 1xn2 s SER 327 CO 0.32 -0.16 1.01 -1.54 1.20 0.00 0.00 173.24 174.08 1xn2 n SER 328 N 1.43 2.33 -1.33 5.45 3.41 -1.26 -2.80 113.62 120.83 1xn2 n SER 328 Ca -0.22 -1.68 -0.03 0.00 -0.26 0.00 0.00 58.87 56.68 1xn2 n SER 328 Cb 0.54 -0.09 0.11 0.00 -0.26 0.00 0.00 64.21 64.52 1xn2 n SER 328 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1xn2 n THR 329 N 0.58 1.86 -0.52 6.66 -2.24 -1.26 -5.05 114.28 114.30 1xn2 n THR 329 Ca 0.09 -3.12 0.00 0.00 -2.27 0.00 0.00 64.05 58.74 1xn2 n THR 329 Cb 0.34 -0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 1xn2 n THR 329 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xn2 n GLY 330 N -0.70 -2.98 3.75 3.38 0.00 -1.22 -4.47 105.19 102.94 1xn2 n GLY 330 Ca 0.23 -1.83 -0.40 0.00 0.00 0.00 0.00 46.02 44.02 1xn2 n GLY 330 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xn2 s THR 331 N -0.72 3.89 -0.17 2.61 2.01 0.83 -4.26 115.64 119.83 1xn2 s THR 331 Ca 0.00 1.80 0.00 0.00 0.31 0.00 0.00 61.69 63.80 1xn2 s THR 331 Cb 0.00 -4.15 0.04 0.00 0.01 0.00 0.00 72.50 68.40 1xn2 s THR 331 CO 0.00 0.39 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.55 1xn2 s VAL 332 N -0.86 1.32 -0.86 3.82 1.01 0.41 -1.19 120.40 124.05 1xn2 s VAL 332 Ca 0.44 -0.72 -0.19 0.00 0.00 0.00 0.00 61.98 61.52 1xn2 s VAL 332 Cb -0.28 -1.42 0.13 0.00 0.00 0.00 0.00 36.38 34.81 1xn2 s VAL 332 CO 0.35 0.20 1.04 -0.04 0.00 0.00 0.00 175.10 176.65 1xn2 s MET 333 N 1.55 3.50 0.00 2.72 1.00 0.35 -0.57 119.30 127.85 1xn2 s MET 333 Ca 0.01 -1.69 0.00 0.00 0.00 0.00 0.00 55.69 54.01 1xn2 s MET 333 Cb -0.15 -4.74 0.00 0.00 0.00 0.00 0.00 34.83 29.94 1xn2 s MET 333 CO -0.08 -1.71 0.00 0.41 0.00 0.00 0.00 175.02 173.64 1xn2 n GLY 334 N 5.30 0.24 0.39 -0.03 0.00 -0.97 -1.34 105.19 108.79 1xn2 n GLY 334 Ca 0.17 -1.81 0.20 0.00 0.00 0.00 0.00 46.02 44.57 1xn2 n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xn2 h ALA 335 N -1.41 2.11 -0.50 4.61 0.00 -0.30 -0.19 119.26 123.57 1xn2 h ALA 335 Ca 0.00 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.06 1xn2 h ALA 335 Cb 0.00 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.68 1xn2 h ALA 335 CO 0.00 -0.47 -0.12 0.28 0.00 0.00 0.00 179.25 178.94 1xn2 h VAL 336 N 0.47 0.50 -0.00 0.00 2.07 -1.42 0.13 116.25 118.00 1xn2 h VAL 336 Ca 0.55 -0.00 -0.02 0.00 0.82 0.00 0.00 66.70 68.06 1xn2 h VAL 336 Cb 1.28 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.55 1xn2 h VAL 336 CO -0.28 0.00 -0.06 0.40 0.02 0.00 0.00 177.57 177.66 1xn2 h ILE 337 N 0.00 1.59 0.00 4.57 1.08 -1.40 -3.32 117.51 120.03 1xn2 h ILE 337 Ca 0.24 -1.81 -0.00 0.00 -0.39 0.00 0.00 64.86 62.89 1xn2 h ILE 337 Cb 0.36 2.80 -0.00 0.00 -3.07 0.00 0.00 36.82 36.91 1xn2 h ILE 337 CO -0.51 0.48 -0.00 0.24 -0.69 0.00 0.00 178.15 177.66 1xn2 h MET 338 N -0.69 0.00 0.00 2.37 2.86 -0.71 -0.68 114.93 118.07 1xn2 h MET 338 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1xn2 h MET 338 Cb 0.81 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.47 1xn2 h MET 338 CO 0.01 0.00 0.00 0.39 1.06 0.00 0.00 176.91 178.37 1xn2 n GLU 339 N -3.86 0.04 0.03 1.72 1.02 0.40 -1.95 120.64 118.05 1xn2 n GLU 339 Ca -0.03 0.31 0.11 0.00 -0.02 0.00 0.00 57.16 57.53 1xn2 n GLU 339 Cb 0.08 -1.59 -0.02 0.00 -0.02 0.00 0.00 31.44 29.89 1xn2 n GLU 339 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1xn2 n GLY 340 N -0.12 -1.18 3.20 0.62 0.00 -0.26 -4.27 105.19 103.16 1xn2 n GLY 340 Ca 0.03 -0.42 -0.12 0.00 0.00 0.00 0.00 46.02 45.50 1xn2 n GLY 340 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1xn2 s PHE 341 N -3.25 1.03 -0.21 1.61 0.40 -0.82 -1.50 117.98 115.24 1xn2 s PHE 341 Ca 0.02 -0.83 -0.16 0.00 -0.60 0.00 0.00 56.93 55.36 1xn2 s PHE 341 Cb 0.14 -0.56 -0.04 0.00 0.51 0.00 0.00 43.02 43.07 1xn2 s PHE 341 CO 0.82 -0.05 0.39 -0.47 0.70 0.00 0.00 175.22 176.61 1xn2 s TYR 342 N -3.36 3.37 -0.17 0.36 5.04 0.84 -4.52 117.35 118.91 1xn2 s TYR 342 Ca 0.12 0.60 -0.01 0.00 -2.44 0.00 0.00 57.07 55.35 1xn2 s TYR 342 Cb 0.03 -2.52 -0.00 0.00 0.35 0.00 0.00 41.96 39.82 1xn2 s TYR 342 CO -0.02 -0.02 -0.13 0.08 -1.34 0.00 0.00 175.55 174.12 1xn2 s VAL 343 N 1.34 2.80 -0.29 3.14 1.01 -0.61 -1.83 120.40 125.96 1xn2 s VAL 343 Ca 0.19 -0.72 -0.08 0.00 0.00 0.00 0.00 61.98 61.37 1xn2 s VAL 343 Cb -0.15 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 1xn2 s VAL 343 CO 0.08 0.50 0.12 -0.69 0.00 0.00 0.00 175.10 175.10 1xn2 s VAL 344 N 0.96 4.43 -1.07 2.92 1.01 0.38 -0.62 120.40 128.41 1xn2 s VAL 344 Ca -0.02 -0.36 -0.13 0.00 0.00 0.00 0.00 61.98 61.46 1xn2 s VAL 344 Cb -0.15 -3.20 0.21 0.00 0.00 0.00 0.00 36.38 33.24 1xn2 s VAL 344 CO -0.02 0.16 1.17 -0.36 0.00 0.00 0.00 175.10 176.06 1xn2 s PHE 345 N 1.60 3.73 -1.20 5.22 0.08 0.63 -0.42 117.98 127.62 1xn2 s PHE 345 Ca 0.05 -2.16 -0.19 0.00 0.12 0.00 0.00 56.93 54.75 1xn2 s PHE 345 Cb -0.16 -4.08 0.08 0.00 -0.57 0.00 0.00 43.02 38.29 1xn2 s PHE 345 CO 0.05 -1.21 1.59 0.34 -0.10 0.00 0.00 175.22 175.90 1xn2 s ASP 346 N 2.38 6.77 0.22 1.36 -1.08 -0.01 -2.67 116.67 123.65 1xn2 s ASP 346 Ca 0.33 -2.25 -0.06 0.00 -0.52 0.00 0.00 52.55 50.06 1xn2 s ASP 346 Cb -0.07 -2.54 0.20 0.00 -1.46 0.00 0.00 42.92 39.05 1xn2 s ASP 346 CO -0.06 -1.19 1.73 0.03 0.52 0.00 0.00 175.17 176.19 1xn2 h ARG 347 N 8.15 0.99 -0.89 4.34 3.08 -1.74 -0.80 114.38 127.52 1xn2 h ARG 347 Ca 0.35 -0.26 0.06 0.00 0.07 0.00 0.00 59.98 60.21 1xn2 h ARG 347 Cb 0.91 -0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.78 1xn2 h ARG 347 CO 1.40 0.93 0.55 0.00 -1.07 0.00 0.00 179.97 181.78 1xn2 h ALA 348 N 1.15 1.22 -0.63 0.04 0.00 -1.48 -2.16 119.26 117.41 1xn2 h ALA 348 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1xn2 h ALA 348 Cb 0.43 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1xn2 h ALA 348 CO 0.01 0.30 0.00 0.54 0.00 0.00 0.00 179.25 180.10 1xn2 n ARG 349 N -4.60 3.10 -3.82 0.00 1.74 -1.12 -4.97 116.66 106.98 1xn2 n ARG 349 Ca 0.13 -2.65 -0.23 0.00 -0.77 0.00 0.00 57.85 54.33 1xn2 n ARG 349 Cb 0.18 -1.64 0.01 0.00 -1.02 0.00 0.00 32.46 29.99 1xn2 n ARG 349 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 1xn2 n LYS 350 N 1.22 -4.16 -3.74 5.56 4.81 -0.42 -4.94 118.16 116.50 1xn2 n LYS 350 Ca 0.23 0.52 -0.10 0.00 -0.87 0.00 0.00 58.31 58.09 1xn2 n LYS 350 Cb 0.69 -4.88 -0.06 0.00 0.02 0.00 0.00 35.03 30.80 1xn2 n LYS 350 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 1xn2 s ARG 351 N -6.25 0.94 -0.12 1.64 1.70 -0.54 -1.08 118.95 115.25 1xn2 s ARG 351 Ca 0.01 -0.78 0.03 0.00 -0.47 0.00 0.00 55.73 54.52 1xn2 s ARG 351 Cb -0.00 0.40 0.01 0.00 -0.57 0.00 0.00 34.95 34.78 1xn2 s ARG 351 CO 0.85 -0.33 -0.22 0.42 -1.08 0.00 0.00 175.30 174.93 1xn2 s ILE 352 N -3.65 2.00 -0.03 4.99 1.01 -0.06 -0.83 121.20 124.63 1xn2 s ILE 352 Ca 0.03 -0.97 -0.01 0.00 0.00 0.00 0.00 60.65 59.70 1xn2 s ILE 352 Cb 0.03 -1.76 -0.04 0.00 0.01 0.00 0.00 42.46 40.70 1xn2 s ILE 352 CO -0.10 0.54 0.08 -0.83 0.00 0.00 0.00 174.94 174.63 1xn2 s GLY 353 N 0.60 2.01 -0.05 6.18 0.00 0.43 -0.62 107.32 115.88 1xn2 s GLY 353 Ca -0.13 -0.83 0.05 0.00 0.00 0.00 0.00 44.72 43.81 1xn2 s GLY 353 CO 0.03 -0.68 -0.18 -1.36 0.00 0.00 0.00 173.10 170.91 1xn2 s PHE 354 N -1.14 1.82 0.03 1.90 0.40 0.30 -0.47 117.98 120.82 1xn2 s PHE 354 Ca 0.21 -0.53 -0.02 0.00 -0.60 0.00 0.00 56.93 55.98 1xn2 s PHE 354 Cb -0.12 -1.22 -0.02 0.00 0.51 0.00 0.00 43.02 42.17 1xn2 s PHE 354 CO 0.11 -0.18 0.02 0.00 0.70 0.00 0.00 175.22 175.87 1xn2 s ALA 355 N 0.02 0.10 0.16 5.36 0.00 -0.76 -1.25 121.76 125.37 1xn2 s ALA 355 Ca -0.04 -0.64 -0.31 0.00 0.00 0.00 0.00 51.96 50.97 1xn2 s ALA 355 Cb -0.12 0.19 -0.11 0.00 0.00 0.00 0.00 23.12 23.09 1xn2 s ALA 355 CO 0.02 -0.24 1.69 0.08 0.00 0.00 0.00 175.76 177.31 1xn2 s VAL 356 N -2.15 2.44 0.30 0.00 1.01 -1.25 -0.11 120.40 120.64 1xn2 s VAL 356 Ca -0.09 0.22 -0.29 0.00 0.00 0.00 0.00 61.98 61.82 1xn2 s VAL 356 Cb -0.04 -3.14 -0.10 0.00 0.00 0.00 0.00 36.38 33.10 1xn2 s VAL 356 CO -0.03 0.01 1.11 -0.55 0.00 0.00 0.00 175.10 175.64 1xn2 s SER 357 N 1.64 7.16 0.03 3.32 0.15 -0.56 -1.87 113.70 123.57 1xn2 s SER 357 Ca 0.74 2.28 0.19 0.00 0.70 0.00 0.00 55.95 59.86 1xn2 s SER 357 Cb -0.46 -2.62 0.79 0.00 -1.71 0.00 0.00 66.02 62.02 1xn2 s SER 357 CO 0.33 -0.22 1.59 0.00 1.20 0.00 0.00 173.24 176.14 1xn2 n ALA 358 N 1.02 1.82 -0.08 5.45 0.00 -0.29 -2.75 120.51 125.67 1xn2 n ALA 358 Ca -0.00 -0.05 0.04 0.00 0.00 0.00 0.00 53.44 53.43 1xn2 n ALA 358 Cb 0.45 -1.31 0.11 0.00 0.00 0.00 0.00 19.45 18.70 1xn2 n ALA 358 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xn2 s HIS 360 N -0.97 2.49 0.00 0.00 -0.00 -1.11 -4.68 115.29 111.03 1xn2 s HIS 360 Ca 0.17 1.53 -0.24 0.00 -0.00 0.00 0.00 55.06 56.52 1xn2 s HIS 360 Cb 0.09 -3.40 -0.05 0.00 -0.00 0.00 0.00 32.58 29.22 1xn2 s HIS 360 CO 0.12 -1.97 0.71 0.08 -0.00 0.00 0.00 174.74 173.69 1xn2 s VAL 361 N -1.69 4.85 0.18 -5.38 1.01 -1.26 -5.04 120.40 113.07 1xn2 s VAL 361 Ca 0.75 1.50 -0.05 0.00 0.00 0.00 0.00 61.98 64.19 1xn2 s VAL 361 Cb -0.28 -4.06 0.02 0.00 0.00 0.00 0.00 36.38 32.07 1xn2 s VAL 361 CO 0.31 0.34 0.32 0.00 0.00 0.00 0.00 175.10 176.08 1xn2 n HIS 362 N 3.06 -1.38 -4.16 5.22 -0.00 -1.26 -4.73 115.22 111.97 1xn2 n HIS 362 Ca -0.03 -0.97 -0.07 0.00 -0.00 0.00 0.00 57.72 56.65 1xn2 n HIS 362 Cb 0.51 0.38 -0.02 0.00 -0.00 0.00 0.00 29.99 30.85 1xn2 n HIS 362 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 1xn2 n ASP 363 N -1.48 1.73 0.25 4.39 5.68 -1.22 -5.03 116.55 120.87 1xn2 n ASP 363 Ca -0.03 -1.54 0.16 0.00 -0.50 0.00 0.00 54.79 52.88 1xn2 n ASP 363 Cb 0.28 0.16 0.58 0.00 -1.14 0.00 0.00 41.12 41.01 1xn2 n ASP 363 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 1xn2 h GLU 364 N 0.00 0.00 0.00 0.11 4.81 -2.06 -3.31 114.58 114.13 1xn2 h GLU 364 Ca -0.09 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1xn2 h GLU 364 Cb 0.31 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.68 1xn2 h GLU 364 CO 0.15 0.00 -1.67 1.19 -0.73 0.00 0.00 179.01 177.95 1xn2 n PHE 365 N -2.95 0.34 -3.91 0.92 3.01 -1.26 -4.99 117.46 108.62 1xn2 n PHE 365 Ca 0.01 0.10 -0.10 0.00 1.01 0.00 0.00 57.45 58.48 1xn2 n PHE 365 Cb 0.33 -0.68 -0.10 0.00 -0.01 0.00 0.00 39.48 39.02 1xn2 n PHE 365 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 1xn2 s ARG 366 N -3.42 0.54 0.10 -1.08 0.52 -1.25 -5.17 118.95 109.20 1xn2 s ARG 366 Ca -0.06 -0.63 -0.00 0.00 -0.52 0.00 0.00 55.73 54.52 1xn2 s ARG 366 Cb 0.12 0.22 -0.04 0.00 0.52 0.00 0.00 34.95 35.77 1xn2 s ARG 366 CO 0.87 -0.13 0.00 0.95 0.02 0.00 0.00 175.30 177.01 1xn2 s THR 367 N -2.15 0.29 0.84 0.02 -4.23 -1.26 -3.42 115.64 105.74 1xn2 s THR 367 Ca -0.09 -1.89 -0.11 0.00 -1.18 0.00 0.00 61.69 58.43 1xn2 s THR 367 Cb -0.04 -1.83 0.10 0.00 1.34 0.00 0.00 72.50 72.07 1xn2 s THR 367 CO -0.02 -0.70 1.10 0.00 -0.54 0.00 0.00 174.62 174.45 1xn2 s ALA 368 N -3.90 1.86 0.07 3.99 0.00 -1.26 -4.91 121.76 117.61 1xn2 s ALA 368 Ca 0.17 0.23 -0.13 0.00 0.00 0.00 0.00 51.96 52.23 1xn2 s ALA 368 Cb 0.07 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.93 1xn2 s ALA 368 CO -0.03 -2.15 0.30 0.00 0.00 0.00 0.00 175.76 173.89 1xn2 s ALA 369 N -2.85 -0.65 -0.12 0.00 0.00 -0.88 -4.96 121.76 112.29 1xn2 s ALA 369 Ca 0.63 -0.12 -0.02 0.00 0.00 0.00 0.00 51.96 52.45 1xn2 s ALA 369 Cb -0.19 0.43 0.04 0.00 0.00 0.00 0.00 23.12 23.40 1xn2 s ALA 369 CO 0.57 -0.48 0.01 0.08 0.00 0.00 0.00 175.76 175.94 1xn2 s VAL 370 N -3.06 0.44 0.03 0.00 1.01 -1.26 -0.66 120.40 116.92 1xn2 s VAL 370 Ca -0.01 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.82 1xn2 s VAL 370 Cb 0.01 -0.74 -0.02 0.00 0.00 0.00 0.00 36.38 35.62 1xn2 s VAL 370 CO -0.07 0.07 -0.07 -1.61 0.00 0.00 0.00 175.10 173.43 1xn2 s GLU 371 N 1.92 0.47 0.03 2.72 2.02 -0.28 -4.90 118.70 120.68 1xn2 s GLU 371 Ca 0.03 -0.69 -0.28 0.00 0.02 0.00 0.00 54.97 54.05 1xn2 s GLU 371 Cb -0.14 -0.20 0.10 0.00 0.10 0.00 0.00 34.13 33.98 1xn2 s GLU 371 CO -0.06 0.03 1.23 0.20 0.02 0.00 0.00 175.26 176.67 1xn2 s GLY 372 N -1.47 -0.16 0.40 -1.39 0.00 -1.26 -0.28 107.32 103.16 1xn2 s GLY 372 Ca -0.11 0.13 0.07 0.00 0.00 0.00 0.00 44.72 44.81 1xn2 s GLY 372 CO 0.00 3.40 0.56 2.56 0.00 0.00 0.00 173.10 179.62 1xn2 s PRO 373 N -2.20 2.91 -0.03 2.90 0.04 -1.26 -5.08 135.00 132.28 1xn2 s PRO 373 Ca 0.23 -1.10 0.04 0.00 0.04 0.00 0.00 61.00 60.22 1xn2 s PRO 373 Cb 0.00 -2.75 -0.01 0.00 0.04 0.00 0.00 34.50 31.79 1xn2 s PRO 373 CO -0.00 -0.19 -0.16 -0.06 0.04 0.00 0.00 177.00 176.63 1xn2 s PHE 374 N -2.33 1.54 -0.39 0.56 0.40 0.18 -4.93 117.98 113.01 1xn2 s PHE 374 Ca 0.52 -0.39 -0.29 0.00 -0.60 0.00 0.00 56.93 56.17 1xn2 s PHE 374 Cb -0.10 -1.03 0.02 0.00 0.51 0.00 0.00 43.02 42.42 1xn2 s PHE 374 CO 0.33 -0.11 1.23 0.08 0.70 0.00 0.00 175.22 177.44 1xn2 s VAL 375 N -0.07 4.18 -0.02 -0.44 1.01 -1.26 -1.31 120.40 122.49 1xn2 s VAL 375 Ca -0.01 1.27 0.04 0.00 0.00 0.00 0.00 61.98 63.29 1xn2 s VAL 375 Cb -0.10 -4.38 -0.01 0.00 0.00 0.00 0.00 36.38 31.90 1xn2 s VAL 375 CO 0.01 -0.73 -0.15 -0.89 0.00 0.00 0.00 175.10 173.35 1xn2 s THR 376 N 4.50 1.18 0.18 3.92 2.01 -0.79 -4.98 115.64 121.66 1xn2 s THR 376 Ca 0.52 -0.61 0.06 0.00 0.31 0.00 0.00 61.69 61.97 1xn2 s THR 376 Cb -0.12 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.35 1xn2 s THR 376 CO 0.27 0.34 0.13 -0.76 -0.69 0.00 0.00 174.62 173.91 1xn2 s LEU 377 N -0.13 3.75 -1.55 4.42 1.43 -1.26 -4.09 118.68 121.24 1xn2 s LEU 377 Ca 0.01 -0.18 -0.11 0.00 -1.03 0.00 0.00 54.13 52.82 1xn2 s LEU 377 Cb -0.08 -2.35 0.09 0.00 0.03 0.00 0.00 46.19 43.88 1xn2 s LEU 377 CO 0.00 0.05 0.74 0.47 0.23 0.00 0.00 176.35 177.85 1xn2 n ASP 378 N -0.46 -2.79 0.17 2.29 10.43 -1.26 -4.88 116.55 120.06 1xn2 n ASP 378 Ca -0.08 -0.93 0.03 0.00 2.57 0.00 0.00 54.79 56.37 1xn2 n ASP 378 Cb 0.55 -3.25 0.39 0.00 1.84 0.00 0.00 41.12 40.66 1xn2 n ASP 378 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 1xn2 h MET 379 N -1.78 0.07 -0.23 -1.24 2.86 -2.00 -2.01 114.93 110.60 1xn2 h MET 379 Ca -0.60 -0.02 0.01 0.00 -2.06 0.00 0.00 59.70 57.03 1xn2 h MET 379 Cb 1.38 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 33.02 1xn2 h MET 379 CO 0.69 0.34 0.16 1.49 1.06 0.00 0.00 176.91 180.65 1xn2 h GLU 380 N 0.07 0.27 0.00 1.72 4.81 -1.98 0.35 114.58 119.81 1xn2 h GLU 380 Ca 0.01 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1xn2 h GLU 380 Cb 0.51 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.83 1xn2 h GLU 380 CO 0.04 0.18 0.00 -0.25 -0.73 0.00 0.00 179.01 178.24 1xn2 n ASP 381 N -4.50 0.53 0.20 1.04 8.00 -0.75 -1.88 116.55 119.18 1xn2 n ASP 381 Ca 0.01 0.69 0.09 0.00 0.71 0.00 0.00 54.79 56.29 1xn2 n ASP 381 Cb 0.11 -0.78 0.21 0.00 -0.02 0.00 0.00 41.12 40.64 1xn2 n ASP 381 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xn2 s GLY 383 N -4.30 2.82 0.22 0.00 0.00 -0.79 -3.87 107.32 101.41 1xn2 s GLY 383 Ca 0.05 0.83 -0.21 0.00 0.00 0.00 0.00 44.72 45.38 1xn2 s GLY 383 CO 0.68 1.69 0.76 -0.47 0.00 0.00 0.00 173.10 175.76 1xn2 s TYR 384 N -0.20 3.70 0.00 1.90 5.04 -1.26 -4.99 117.35 121.53 1xn2 s TYR 384 Ca 0.50 1.48 0.00 0.00 -2.44 0.00 0.00 57.07 56.61 1xn2 s TYR 384 Cb -0.30 -2.68 0.00 0.00 0.35 0.00 0.00 41.96 39.33 1xn2 s TYR 384 CO 0.35 0.35 0.23 0.09 -1.34 0.00 0.00 175.55 175.24