#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g94 s SER 46 N 0.00 0.66 -0.50 1.61 0.15 -1.24 -2.15 113.70 112.25 2g94 s SER 46 Ca 0.00 -0.06 0.08 0.00 0.70 0.00 0.00 55.95 56.66 2g94 s SER 46 Cb 0.00 0.89 0.29 0.00 -1.71 0.00 0.00 66.02 65.50 2g94 s SER 46 CO 0.00 -0.32 0.73 0.49 1.20 0.00 0.00 173.24 175.33 2g94 n PHE 47 N 5.35 1.84 -0.08 3.44 3.01 -1.26 -4.94 117.46 124.81 2g94 n PHE 47 Ca -0.03 -3.88 0.24 0.00 1.01 0.00 0.00 57.45 54.79 2g94 n PHE 47 Cb 0.49 -0.45 0.71 0.00 -0.01 0.00 0.00 39.48 40.22 2g94 n PHE 47 CO 0.00 0.00 0.00 -0.39 1.01 0.00 0.00 176.76 177.38 2g94 h VAL 48 N 2.31 0.65 -0.27 -4.37 -1.51 -1.96 0.11 116.25 111.20 2g94 h VAL 48 Ca 0.13 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.59 2g94 h VAL 48 Cb 0.76 0.65 -0.01 0.00 -2.13 0.00 0.00 31.29 30.55 2g94 h VAL 48 CO 0.65 0.00 0.15 1.05 -1.23 0.00 0.00 177.57 178.19 2g94 h GLU 1 N 0.00 0.36 0.00 5.19 4.11 -1.97 -3.07 114.58 119.20 2g94 h GLU 1 Ca 0.33 -0.03 0.00 0.00 0.07 0.00 0.00 59.36 59.74 2g94 h GLU 1 Cb 1.34 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.52 2g94 h GLU 1 CO -0.00 0.27 -1.11 -1.33 0.07 0.00 0.00 179.01 176.90 2g94 n MET 2 N -4.47 0.67 -1.85 1.06 2.81 -0.00 -4.66 117.12 110.68 2g94 n MET 2 Ca 0.01 -0.04 -0.41 0.00 -1.81 0.00 0.00 57.70 55.45 2g94 n MET 2 Cb 0.09 -1.42 -0.01 0.00 -0.71 0.00 0.00 33.22 31.18 2g94 n MET 2 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2g94 s VAL 3 N -2.92 2.19 -1.32 2.03 1.01 -1.02 -2.42 120.40 117.96 2g94 s VAL 3 Ca 0.04 0.18 -0.01 0.00 0.00 0.00 0.00 61.98 62.20 2g94 s VAL 3 Cb 0.14 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.41 2g94 s VAL 3 CO 0.79 0.04 0.07 0.47 0.00 0.00 0.00 175.10 176.47 2g94 n ASP 4 N 1.30 -4.74 -0.60 3.32 10.43 -1.23 -4.92 116.55 120.11 2g94 n ASP 4 Ca 0.04 -0.05 0.09 0.00 2.57 0.00 0.00 54.79 57.45 2g94 n ASP 4 Cb 0.39 -3.83 0.31 0.00 1.84 0.00 0.00 41.12 39.83 2g94 n ASP 4 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 2g94 n ASN 5 N -1.06 1.79 -4.68 -2.24 6.94 -1.01 -4.85 115.26 110.15 2g94 n ASN 5 Ca -0.17 -1.80 -0.28 0.00 -0.02 0.00 0.00 54.58 52.31 2g94 n ASN 5 Cb 0.63 -0.15 -0.08 0.00 -2.36 0.00 0.00 39.78 37.83 2g94 n ASN 5 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2g94 s LEU 6 N -1.40 3.39 0.20 -4.53 1.43 -0.22 -4.44 118.68 113.11 2g94 s LEU 6 Ca 0.30 -0.29 0.02 0.00 -1.03 0.00 0.00 54.13 53.13 2g94 s LEU 6 Cb 0.16 -2.08 -0.05 0.00 0.03 0.00 0.00 46.19 44.25 2g94 s LEU 6 CO 0.24 0.13 0.02 -0.13 0.23 0.00 0.00 176.35 176.84 2g94 s ARG 7 N -2.64 1.21 0.00 1.70 0.52 -0.59 0.02 118.95 119.17 2g94 s ARG 7 Ca 0.26 -1.61 0.00 0.00 -0.52 0.00 0.00 55.73 53.87 2g94 s ARG 7 Cb -0.10 -0.32 0.00 0.00 0.52 0.00 0.00 34.95 35.04 2g94 s ARG 7 CO 0.18 -0.16 0.00 0.41 0.02 0.00 0.00 175.30 175.75 2g94 n GLY 8 N -0.32 -0.31 3.75 -3.53 0.00 -1.26 -0.42 105.19 103.11 2g94 n GLY 8 Ca -0.05 -2.22 -0.02 0.00 0.00 0.00 0.00 46.02 43.74 2g94 n GLY 8 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g94 s LYS 9 N 0.00 0.99 0.87 1.61 -2.85 -0.98 -4.57 119.74 114.82 2g94 s LYS 9 Ca 0.00 -0.57 -0.10 0.00 -1.00 0.00 0.00 55.97 54.30 2g94 s LYS 9 Cb 0.00 0.32 0.12 0.00 -2.06 0.00 0.00 37.83 36.21 2g94 s LYS 9 CO 0.00 -0.46 1.12 -1.54 0.10 0.00 0.00 175.35 174.58 2g94 s SER 10 N -3.06 3.42 0.00 0.03 1.04 -1.26 -0.18 113.70 113.69 2g94 s SER 10 Ca 0.15 2.03 0.00 0.00 0.48 0.00 0.00 55.95 58.60 2g94 s SER 10 Cb 0.00 -2.53 0.00 0.00 0.10 0.00 0.00 66.02 63.59 2g94 s SER 10 CO 0.01 -2.76 0.00 0.61 0.98 0.00 0.00 173.24 172.08 2g94 n GLY 11 N -0.31 2.13 0.10 7.32 0.00 -1.26 -4.46 105.19 108.71 2g94 n GLY 11 Ca 0.11 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.69 2g94 n GLY 11 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2g94 n GLN 12 N 0.00 0.69 0.00 1.61 6.02 -1.18 -5.00 117.38 119.51 2g94 n GLN 12 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2g94 n GLN 12 Cb 0.00 -1.53 0.00 0.00 1.02 0.00 0.00 30.24 29.73 2g94 n GLN 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2g94 n GLY 13 N 1.76 3.22 3.64 1.08 0.00 0.74 -4.91 105.19 110.73 2g94 n GLY 13 Ca -0.33 -1.80 -0.35 0.00 0.00 0.00 0.00 46.02 43.54 2g94 n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2g94 s TYR 14 N -2.23 3.26 0.13 1.61 1.51 -1.26 -2.31 117.35 118.06 2g94 s TYR 14 Ca 0.00 0.08 0.04 0.00 -1.01 0.00 0.00 57.07 56.18 2g94 s TYR 14 Cb 0.00 -2.09 -0.04 0.00 -0.11 0.00 0.00 41.96 39.72 2g94 s TYR 14 CO 0.00 0.15 -0.10 1.52 -1.11 0.00 0.00 175.55 176.01 2g94 s TYR 15 N 0.41 1.19 0.13 2.71 -0.85 0.44 -1.05 117.35 120.33 2g94 s TYR 15 Ca 0.03 -0.73 0.09 0.00 -0.52 0.00 0.00 57.07 55.95 2g94 s TYR 15 Cb -0.12 -0.62 -0.04 0.00 0.38 0.00 0.00 41.96 41.56 2g94 s TYR 15 CO 0.00 0.05 -0.23 0.54 -1.52 0.00 0.00 175.55 174.39 2g94 s VAL 16 N -3.05 1.97 0.08 -3.49 0.11 -0.24 -1.54 120.40 114.25 2g94 s VAL 16 Ca 0.13 -1.73 -0.25 0.00 -2.93 0.00 0.00 61.98 57.19 2g94 s VAL 16 Cb 0.01 -1.81 -0.06 0.00 -1.53 0.00 0.00 36.38 32.99 2g94 s VAL 16 CO 0.00 -0.07 0.78 -0.70 -3.33 0.00 0.00 175.10 171.78 2g94 s GLU 17 N -2.20 4.52 0.14 1.54 2.12 -1.26 -0.81 118.70 122.75 2g94 s GLU 17 Ca 0.12 1.11 0.00 0.00 0.36 0.00 0.00 54.97 56.56 2g94 s GLU 17 Cb -0.09 -3.33 -0.04 0.00 0.26 0.00 0.00 34.13 30.92 2g94 s GLU 17 CO 0.06 0.37 0.02 -1.64 -0.54 0.00 0.00 175.26 173.53 2g94 s MET 18 N -0.38 0.96 0.06 4.30 -1.94 -0.25 -3.99 119.30 118.06 2g94 s MET 18 Ca 0.38 -1.45 0.07 0.00 -1.71 0.00 0.00 55.69 52.97 2g94 s MET 18 Cb -0.21 0.02 -0.03 0.00 2.01 0.00 0.00 34.83 36.62 2g94 s MET 18 CO 0.24 -0.19 -0.18 0.95 -0.01 0.00 0.00 175.02 175.84 2g94 s THR 19 N -3.86 1.45 0.01 2.05 -4.23 -0.34 -1.18 115.64 109.53 2g94 s THR 19 Ca 0.22 -1.25 0.02 0.00 -1.18 0.00 0.00 61.69 59.49 2g94 s THR 19 Cb 0.07 -1.30 -0.01 0.00 1.34 0.00 0.00 72.50 72.60 2g94 s THR 19 CO 0.01 0.02 -0.06 0.68 -0.54 0.00 0.00 174.62 174.73 2g94 s VAL 20 N -0.98 0.42 0.00 2.29 -7.23 -0.31 -1.75 120.40 112.84 2g94 s VAL 20 Ca 0.04 -0.44 0.00 0.00 -1.81 0.00 0.00 61.98 59.77 2g94 s VAL 20 Cb -0.09 -0.40 0.00 0.00 0.56 0.00 0.00 36.38 36.45 2g94 s VAL 20 CO 0.02 -0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.40 2g94 n GLY 21 N 2.56 -1.00 2.72 2.32 0.00 -0.20 -1.09 105.19 110.50 2g94 n GLY 21 Ca -0.15 -1.65 -0.23 0.00 0.00 0.00 0.00 46.02 43.99 2g94 n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2g94 s SER 22 N -2.41 1.64 0.81 1.61 0.01 -1.26 -2.89 113.70 111.20 2g94 s SER 22 Ca 0.00 -0.15 -0.12 0.00 1.31 0.00 0.00 55.95 56.99 2g94 s SER 22 Cb 0.00 -0.35 0.08 0.00 0.21 0.00 0.00 66.02 65.96 2g94 s SER 22 CO 0.00 -0.23 1.14 -2.16 0.41 0.00 0.00 173.24 172.40 2g94 s PRO 23 N 2.04 1.80 0.17 12.44 0.04 -1.26 -0.97 135.00 149.26 2g94 s PRO 23 Ca 0.04 1.48 -0.33 0.00 0.04 0.00 0.00 61.00 62.23 2g94 s PRO 23 Cb -0.13 -1.82 -0.13 0.00 0.04 0.00 0.00 34.50 32.46 2g94 s PRO 23 CO -0.05 -2.03 1.64 -2.30 0.04 0.00 0.00 177.00 174.29 2g94 n PRO 24 N -3.49 2.36 -3.77 0.56 -0.02 -1.14 -4.92 135.00 124.58 2g94 n PRO 24 Ca 0.11 0.85 -0.37 0.00 -2.02 0.00 0.00 63.50 62.08 2g94 n PRO 24 Cb 0.52 -2.65 -0.13 0.00 -0.02 0.00 0.00 33.50 31.22 2g94 n PRO 24 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2g94 s GLN 25 N 1.11 3.51 0.08 -0.52 -0.21 -0.25 -4.88 119.66 118.49 2g94 s GLN 25 Ca 0.78 -0.57 -0.30 0.00 0.02 0.00 0.00 55.36 55.29 2g94 s GLN 25 Cb -0.62 -3.31 -0.05 0.00 1.00 0.00 0.00 33.01 30.03 2g94 s GLN 25 CO 0.36 -0.25 0.98 0.99 -2.12 0.00 0.00 175.29 175.25 2g94 s THR 26 N 1.58 4.58 -0.03 -0.19 2.01 -1.26 -1.16 115.64 121.18 2g94 s THR 26 Ca 0.06 2.04 -0.09 0.00 0.31 0.00 0.00 61.69 64.01 2g94 s THR 26 Cb -0.15 -4.30 0.01 0.00 0.01 0.00 0.00 72.50 68.06 2g94 s THR 26 CO 0.03 0.26 0.19 -0.76 -0.69 0.00 0.00 174.62 173.65 2g94 s LEU 27 N 0.33 1.31 -0.18 4.42 1.43 -0.33 -4.93 118.68 120.73 2g94 s LEU 27 Ca 0.49 0.06 -0.16 0.00 -1.03 0.00 0.00 54.13 53.49 2g94 s LEU 27 Cb -0.23 0.79 -0.04 0.00 0.03 0.00 0.00 46.19 46.74 2g94 s LEU 27 CO 0.29 -0.28 0.39 0.20 0.23 0.00 0.00 176.35 177.18 2g94 s ASN 28 N -0.86 6.48 -0.16 2.29 0.02 -1.26 -1.10 114.94 120.36 2g94 s ASN 28 Ca -0.09 0.57 0.01 0.00 -1.02 0.00 0.00 52.86 52.33 2g94 s ASN 28 Cb -0.05 -2.23 0.01 0.00 0.02 0.00 0.00 41.25 39.00 2g94 s ASN 28 CO 0.02 -0.02 -0.18 -0.63 0.02 0.00 0.00 177.10 176.31 2g94 s ILE 29 N 0.97 2.37 0.24 0.60 -1.09 0.01 0.08 121.20 124.38 2g94 s ILE 29 Ca 0.20 -0.86 -0.30 0.00 -2.23 0.00 0.00 60.65 57.45 2g94 s ILE 29 Cb -0.14 -1.99 -0.10 0.00 -1.58 0.00 0.00 42.46 38.65 2g94 s ILE 29 CO 0.07 0.53 1.45 -0.22 -1.23 0.00 0.00 174.94 175.54 2g94 s LEU 30 N 0.96 4.38 -0.35 2.97 2.96 0.15 -1.08 118.68 128.68 2g94 s LEU 30 Ca -0.03 2.65 -0.22 0.00 -0.22 0.00 0.00 54.13 56.31 2g94 s LEU 30 Cb -0.15 -3.62 0.01 0.00 0.50 0.00 0.00 46.19 42.93 2g94 s LEU 30 CO -0.04 -0.71 0.75 -0.69 -1.32 0.00 0.00 176.35 174.34 2g94 s VAL 31 N 0.14 4.78 -0.32 1.68 1.01 -0.22 -0.55 120.40 126.92 2g94 s VAL 31 Ca 0.60 0.84 0.01 0.00 0.00 0.00 0.00 61.98 63.44 2g94 s VAL 31 Cb -0.42 -4.17 0.10 0.00 0.00 0.00 0.00 36.38 31.89 2g94 s VAL 31 CO 0.42 -0.38 0.08 -0.62 0.00 0.00 0.00 175.10 174.60 2g94 s ASP 32 N 1.80 4.30 0.00 3.32 2.15 -0.83 -4.08 116.67 123.33 2g94 s ASP 32 Ca 0.30 -1.82 0.28 0.00 0.43 0.00 0.00 52.55 51.73 2g94 s ASP 32 Cb -0.14 -1.14 1.53 0.00 -0.30 0.00 0.00 42.92 42.88 2g94 s ASP 32 CO 0.16 -0.40 1.99 0.35 -0.17 0.00 0.00 175.17 177.09 2g94 n THR 33 N 4.63 0.06 1.06 1.71 -2.24 -1.26 -1.47 114.28 116.77 2g94 n THR 33 Ca 0.00 0.02 0.11 0.00 -2.27 0.00 0.00 64.05 61.91 2g94 n THR 33 Cb 0.42 -0.57 0.34 0.00 -2.10 0.00 0.00 70.33 68.42 2g94 n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g94 n GLY 34 N 0.92 0.59 3.41 3.38 0.00 -1.26 -4.12 105.19 108.10 2g94 n GLY 34 Ca 0.17 -0.50 -0.15 0.00 0.00 0.00 0.00 46.02 45.54 2g94 n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2g94 s SER 35 N -1.61 0.91 -0.02 1.61 1.04 -1.20 -4.99 113.70 109.44 2g94 s SER 35 Ca 0.34 -1.49 0.03 0.00 0.48 0.00 0.00 55.95 55.31 2g94 s SER 35 Cb 0.19 0.60 0.05 0.00 0.10 0.00 0.00 66.02 66.95 2g94 s SER 35 CO 0.28 -1.17 0.85 -1.20 0.98 0.00 0.00 173.24 172.98 2g94 n SER 36 N -1.21 0.97 -4.65 7.02 7.64 -1.26 -0.57 113.62 121.56 2g94 n SER 36 Ca 0.02 -1.84 -0.35 0.00 1.01 0.00 0.00 58.87 57.72 2g94 n SER 36 Cb 0.62 -0.11 -0.10 0.00 -1.01 0.00 0.00 64.21 63.61 2g94 n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2g94 s ASN 37 N -0.97 5.25 -0.24 6.43 -0.87 -1.26 -4.51 114.94 118.77 2g94 s ASN 37 Ca 0.05 0.09 -0.15 0.00 -1.57 0.00 0.00 52.86 51.28 2g94 s ASN 37 Cb 0.05 -1.62 -0.04 0.00 -0.02 0.00 0.00 41.25 39.62 2g94 s ASN 37 CO 0.01 0.31 0.39 0.12 -2.57 0.00 0.00 177.10 175.36 2g94 s PHE 38 N -0.46 3.30 0.01 2.20 5.99 -1.26 -1.82 117.98 125.94 2g94 s PHE 38 Ca 0.08 0.51 -0.07 0.00 0.00 0.00 0.00 56.93 57.46 2g94 s PHE 38 Cb -0.12 -2.56 -0.00 0.00 0.00 0.00 0.00 43.02 40.34 2g94 s PHE 38 CO 0.02 -0.14 0.13 0.00 -0.00 0.00 0.00 175.22 175.23 2g94 s ALA 39 N 1.77 -0.26 -0.03 11.12 0.00 -0.45 -1.32 121.76 132.60 2g94 s ALA 39 Ca 0.17 -0.24 -0.05 0.00 0.00 0.00 0.00 51.96 51.84 2g94 s ALA 39 Cb -0.15 0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.13 2g94 s ALA 39 CO 0.09 -0.24 0.11 0.14 0.00 0.00 0.00 175.76 175.86 2g94 s VAL 40 N -1.71 0.03 0.32 0.00 -7.23 -0.36 -0.11 120.40 111.34 2g94 s VAL 40 Ca -0.12 -0.28 -0.29 0.00 -1.81 0.00 0.00 61.98 59.47 2g94 s VAL 40 Cb -0.06 -0.26 -0.11 0.00 0.56 0.00 0.00 36.38 36.50 2g94 s VAL 40 CO -0.00 -0.15 1.57 0.61 -0.31 0.00 0.00 175.10 176.81 2g94 n GLY 41 N 2.44 1.31 0.64 2.32 0.00 0.10 -0.48 105.19 111.52 2g94 n GLY 41 Ca -0.16 0.42 0.05 0.00 0.00 0.00 0.00 46.02 46.33 2g94 n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g94 n ALA 42 N 1.67 2.50 -3.59 4.61 0.00 -0.63 -0.58 120.51 124.49 2g94 n ALA 42 Ca 0.07 -2.23 -0.12 0.00 0.00 0.00 0.00 53.44 51.16 2g94 n ALA 42 Cb 0.37 -0.49 -0.06 0.00 0.00 0.00 0.00 19.45 19.27 2g94 n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g94 s ALA 43 N -1.43 -1.90 0.31 0.00 0.00 -1.25 -4.79 121.76 112.69 2g94 s ALA 43 Ca 0.24 1.65 -0.26 0.00 0.00 0.00 0.00 51.96 53.60 2g94 s ALA 43 Cb 0.24 -0.81 -0.15 0.00 0.00 0.00 0.00 23.12 22.40 2g94 s ALA 43 CO -0.05 -0.30 0.58 -0.35 0.00 0.00 0.00 175.76 175.64 2g94 n PRO 44 N 1.35 0.46 -3.71 0.00 -0.04 -1.26 -4.98 135.00 126.83 2g94 n PRO 44 Ca -0.13 0.16 -0.13 0.00 -0.04 0.00 0.00 63.50 63.36 2g94 n PRO 44 Cb 0.57 -1.33 -0.09 0.00 -0.04 0.00 0.00 33.50 32.61 2g94 n PRO 44 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2g94 s HIS 45 N -1.23 -0.51 0.47 0.54 2.46 -1.26 -5.05 115.29 110.71 2g94 s HIS 45 Ca 0.62 1.22 0.26 0.00 0.47 0.00 0.00 55.06 57.63 2g94 s HIS 45 Cb -0.75 0.18 1.30 0.00 -0.13 0.00 0.00 32.58 33.18 2g94 s HIS 45 CO 0.58 -0.27 1.82 -1.35 -2.47 0.00 0.00 174.74 173.05 2g94 h PRO 46 N 5.25 0.20 -0.02 2.88 0.11 -2.04 -0.71 132.00 137.67 2g94 h PRO 46 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2g94 h PRO 46 Cb 1.18 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2g94 h PRO 46 CO 0.22 0.13 -0.07 1.19 -0.21 0.00 0.00 178.00 179.26 2g94 n PHE 47 N -4.41 0.00 -3.91 0.65 0.99 -1.26 -4.90 117.46 104.62 2g94 n PHE 47 Ca 0.23 0.00 -0.35 0.00 -0.00 0.00 0.00 57.45 57.33 2g94 n PHE 47 Cb 0.96 -0.01 -0.10 0.00 -1.00 0.00 0.00 39.48 39.33 2g94 n PHE 47 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 2g94 s LEU 48 N -2.10 3.79 0.20 4.37 1.43 -0.28 -4.64 118.68 121.46 2g94 s LEU 48 Ca 0.31 0.03 0.24 0.00 -1.03 0.00 0.00 54.13 53.69 2g94 s LEU 48 Cb 0.20 -1.98 0.42 0.00 0.03 0.00 0.00 46.19 44.87 2g94 s LEU 48 CO 0.36 0.12 1.44 0.45 0.23 0.00 0.00 176.35 178.95 2g94 h HIS 49 N 7.11 0.00 -2.68 0.29 3.86 -1.90 -3.42 115.15 118.41 2g94 h HIS 49 Ca -0.37 0.00 0.12 0.00 -1.16 0.00 0.00 60.37 58.95 2g94 h HIS 49 Cb 1.17 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 29.57 2g94 h HIS 49 CO 0.60 0.00 0.35 -0.98 0.86 0.00 0.00 177.93 178.76 2g94 s ARG 50 N -3.18 1.46 0.24 2.45 1.70 -1.26 -5.16 118.95 115.20 2g94 s ARG 50 Ca 0.07 -0.79 -0.22 0.00 -0.47 0.00 0.00 55.73 54.32 2g94 s ARG 50 Cb 0.11 0.51 0.03 0.00 -0.57 0.00 0.00 34.95 35.04 2g94 s ARG 50 CO 0.69 -0.67 0.75 1.52 -1.08 0.00 0.00 175.30 176.51 2g94 s TYR 51 N -3.60 -0.23 -0.06 5.89 -0.85 -1.26 -4.91 117.35 112.34 2g94 s TYR 51 Ca 0.11 -0.17 -0.30 0.00 -0.52 0.00 0.00 57.07 56.19 2g94 s TYR 51 Cb -0.03 0.68 -0.04 0.00 0.38 0.00 0.00 41.96 42.94 2g94 s TYR 51 CO 0.03 -1.11 1.43 -0.47 -1.52 0.00 0.00 175.55 173.91 2g94 s TYR 52 N -3.78 2.62 -0.62 -3.49 5.04 0.25 -4.95 117.35 112.42 2g94 s TYR 52 Ca 0.10 0.71 -0.04 0.00 -2.44 0.00 0.00 57.07 55.39 2g94 s TYR 52 Cb -0.05 -3.68 0.16 0.00 0.35 0.00 0.00 41.96 38.74 2g94 s TYR 52 CO 0.03 -2.61 0.44 -0.65 -1.34 0.00 0.00 175.55 171.43 2g94 s GLN 53 N 3.13 2.60 0.33 4.97 -0.21 -1.26 -4.43 119.66 124.78 2g94 s GLN 53 Ca 0.64 -2.44 0.04 0.00 0.02 0.00 0.00 55.36 53.62 2g94 s GLN 53 Cb -0.29 -3.78 0.65 0.00 1.00 0.00 0.00 33.01 30.59 2g94 s GLN 53 CO 0.24 -1.18 1.90 0.00 -2.12 0.00 0.00 175.29 174.13 2g94 h ARG 54 N 7.23 0.85 0.00 2.91 3.08 -1.94 -1.52 114.38 124.99 2g94 h ARG 54 Ca -0.02 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2g94 h ARG 54 Cb 0.97 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.83 2g94 h ARG 54 CO 0.72 0.56 0.00 1.96 -1.07 0.00 0.00 179.97 182.15 2g94 h GLN 55 N 0.88 0.00 -0.22 0.04 4.20 -2.01 -1.96 115.11 116.04 2g94 h GLN 55 Ca 0.41 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.12 2g94 h GLN 55 Cb 0.39 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.17 2g94 h GLN 55 CO -0.17 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.27 2g94 n LEU 56 N -2.62 3.26 -4.41 1.46 4.77 -0.57 -4.88 117.00 114.02 2g94 n LEU 56 Ca -0.01 -1.27 -0.36 0.00 -0.03 0.00 0.00 56.01 54.34 2g94 n LEU 56 Cb 0.12 -0.13 -0.13 0.00 -2.33 0.00 0.00 43.42 40.95 2g94 n LEU 56 CO 0.17 0.63 -0.29 -0.55 -1.33 0.00 0.00 177.39 176.02 2g94 s SER 57 N -1.73 5.02 0.30 -1.43 0.15 -0.74 -4.24 113.70 111.03 2g94 s SER 57 Ca 0.34 -0.34 0.25 0.00 0.70 0.00 0.00 55.95 56.90 2g94 s SER 57 Cb 0.22 -1.89 1.01 0.00 -1.71 0.00 0.00 66.02 63.64 2g94 s SER 57 CO 0.31 -0.07 1.75 0.77 1.20 0.00 0.00 173.24 177.21 2g94 h SER 58 N 8.22 0.00 -0.20 5.45 4.64 -1.35 -3.01 113.55 127.30 2g94 h SER 58 Ca -0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 2g94 h SER 58 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2g94 h SER 58 CO 0.59 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.90 2g94 n THR 59 N -2.37 0.28 -2.03 2.95 -2.24 -1.26 -4.99 114.28 104.62 2g94 n THR 59 Ca 0.02 -0.64 -0.42 0.00 -2.27 0.00 0.00 64.05 60.75 2g94 n THR 59 Cb 0.27 1.17 -0.03 0.00 -2.10 0.00 0.00 70.33 69.64 2g94 n THR 59 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2g94 s TYR 60 N -1.52 3.08 -0.14 4.78 5.04 -1.14 -4.50 117.35 122.95 2g94 s TYR 60 Ca 0.29 0.94 0.01 0.00 -2.44 0.00 0.00 57.07 55.88 2g94 s TYR 60 Cb 0.19 -3.81 0.02 0.00 0.35 0.00 0.00 41.96 38.71 2g94 s TYR 60 CO 0.27 -2.73 -0.17 1.03 -1.34 0.00 0.00 175.55 172.61 2g94 s ARG 61 N 0.19 2.51 -0.32 4.97 0.52 -0.20 -4.98 118.95 121.63 2g94 s ARG 61 Ca 0.62 -0.65 -0.22 0.00 -0.52 0.00 0.00 55.73 54.96 2g94 s ARG 61 Cb -0.41 -2.16 -0.00 0.00 0.52 0.00 0.00 34.95 32.89 2g94 s ARG 61 CO 0.38 -0.13 0.72 0.34 0.02 0.00 0.00 175.30 176.63 2g94 s ASP 62 N 1.17 6.57 0.00 0.23 -1.08 -1.26 -0.48 116.67 121.82 2g94 s ASP 62 Ca -0.01 0.50 0.30 0.00 -0.52 0.00 0.00 52.55 52.81 2g94 s ASP 62 Cb -0.14 -2.37 1.39 0.00 -1.46 0.00 0.00 42.92 40.34 2g94 s ASP 62 CO -0.06 -0.58 1.95 0.18 0.52 0.00 0.00 175.17 177.18 2g94 n LEU 63 N 6.10 0.42 -3.86 -1.34 4.77 -0.76 -4.94 117.00 117.38 2g94 n LEU 63 Ca 0.02 -0.01 -0.25 0.00 -0.03 0.00 0.00 56.01 55.73 2g94 n LEU 63 Cb 0.48 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 2g94 n LEU 63 CO 0.49 0.07 -0.12 0.54 -1.33 0.00 0.00 177.39 177.05 2g94 n ARG 64 N -0.88 -4.18 -3.70 3.23 1.74 -1.25 -4.98 116.66 106.64 2g94 n ARG 64 Ca 0.17 0.51 -0.11 0.00 -0.77 0.00 0.00 57.85 57.65 2g94 n ARG 64 Cb 0.24 -4.93 -0.11 0.00 -1.02 0.00 0.00 32.46 26.65 2g94 n ARG 64 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2g94 s LYS 65 N -6.35 0.38 0.60 5.56 2.20 -1.26 -5.05 119.74 115.82 2g94 s LYS 65 Ca 0.12 0.73 -0.07 0.00 -0.36 0.00 0.00 55.97 56.40 2g94 s LYS 65 Cb -0.06 -0.00 0.01 0.00 -1.51 0.00 0.00 37.83 36.27 2g94 s LYS 65 CO 0.85 -0.15 0.93 0.20 -0.36 0.00 0.00 175.35 176.82 2g94 s GLY 66 N 1.24 1.61 -0.07 5.54 0.00 -1.26 -0.88 107.32 113.49 2g94 s GLY 66 Ca -0.08 -0.65 -0.13 0.00 0.00 0.00 0.00 44.72 43.86 2g94 s GLY 66 CO -0.11 -0.36 0.32 0.54 0.00 0.00 0.00 173.10 173.49 2g94 s VAL 67 N -3.04 0.03 -0.05 1.40 0.11 -0.51 -4.83 120.40 113.52 2g94 s VAL 67 Ca 0.54 -0.25 0.04 0.00 -2.93 0.00 0.00 61.98 59.38 2g94 s VAL 67 Cb -0.11 -0.54 0.00 0.00 -1.53 0.00 0.00 36.38 34.20 2g94 s VAL 67 CO 0.46 -0.14 -0.16 -0.47 -3.33 0.00 0.00 175.10 171.46 2g94 s TYR 68 N -0.61 1.69 -0.11 1.54 5.04 -1.26 -1.02 117.35 122.62 2g94 s TYR 68 Ca -0.07 -0.55 -0.02 0.00 -2.44 0.00 0.00 57.07 53.99 2g94 s TYR 68 Cb -0.04 -1.16 0.04 0.00 0.35 0.00 0.00 41.96 41.14 2g94 s TYR 68 CO 0.02 -0.22 0.01 0.08 -1.34 0.00 0.00 175.55 174.10 2g94 s VAL 69 N 0.26 0.46 -0.05 3.14 1.01 -0.47 -4.85 120.40 119.90 2g94 s VAL 69 Ca -0.08 -0.12 -0.03 0.00 0.00 0.00 0.00 61.98 61.75 2g94 s VAL 69 Cb -0.13 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 2g94 s VAL 69 CO 0.03 0.12 0.11 -2.16 0.00 0.00 0.00 175.10 173.20 2g94 s PRO 70 N 1.92 3.25 0.43 2.72 0.04 -1.26 -1.72 135.00 140.38 2g94 s PRO 70 Ca 0.03 -0.34 0.04 0.00 0.04 0.00 0.00 61.00 60.78 2g94 s PRO 70 Cb -0.14 -3.00 -0.05 0.00 0.04 0.00 0.00 34.50 31.35 2g94 s PRO 70 CO -0.06 0.70 0.03 0.71 0.04 0.00 0.00 177.00 178.41 2g94 s TYR 71 N -1.14 2.16 0.32 0.56 2.02 0.13 -4.99 117.35 116.41 2g94 s TYR 71 Ca 0.21 -0.86 0.08 0.00 -0.37 0.00 0.00 57.07 56.12 2g94 s TYR 71 Cb -0.12 -1.59 0.81 0.00 -0.40 0.00 0.00 41.96 40.65 2g94 s TYR 71 CO 0.11 0.24 1.77 1.15 -1.57 0.00 0.00 175.55 177.25 2g94 h THR 72 N 1.70 0.65 -3.21 -0.71 2.02 -1.99 -3.35 112.91 108.01 2g94 h THR 72 Ca -0.43 -0.24 -0.35 0.00 0.77 0.00 0.00 66.41 66.17 2g94 h THR 72 Cb 1.27 -0.10 -0.38 0.00 -1.74 0.00 0.00 68.15 67.20 2g94 h THR 72 CO 0.75 0.13 -0.70 -1.10 0.37 0.00 0.00 175.52 174.96 2g94 s GLN 73 N -5.80 -0.03 0.00 6.66 -0.21 -1.26 -5.10 119.66 113.91 2g94 s GLN 73 Ca -0.11 0.42 0.00 0.00 0.02 0.00 0.00 55.36 55.69 2g94 s GLN 73 Cb 0.26 -0.50 0.00 0.00 1.00 0.00 0.00 33.01 33.77 2g94 s GLN 73 CO 0.80 -0.34 0.00 0.41 -2.12 0.00 0.00 175.29 174.04 2g94 n GLY 74 N 5.31 2.59 3.56 3.09 0.00 -1.25 -4.84 105.19 113.65 2g94 n GLY 74 Ca -0.04 -1.89 -0.06 0.00 0.00 0.00 0.00 46.02 44.03 2g94 n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g94 s LYS 75 N -3.19 0.67 0.14 1.61 -2.85 -0.68 -0.69 119.74 114.76 2g94 s LYS 75 Ca 0.00 -0.27 -0.19 0.00 -1.00 0.00 0.00 55.97 54.51 2g94 s LYS 75 Cb 0.00 0.29 0.05 0.00 -2.06 0.00 0.00 37.83 36.11 2g94 s LYS 75 CO 0.00 -0.30 0.49 1.67 0.10 0.00 0.00 175.35 177.31 2g94 s TRP 76 N -2.88 -0.33 0.05 1.78 1.48 -0.70 -0.98 118.94 117.36 2g94 s TRP 76 Ca 0.08 0.05 0.08 0.00 -1.06 0.00 0.00 56.10 55.25 2g94 s TRP 76 Cb -0.01 0.39 -0.03 0.00 -1.16 0.00 0.00 33.47 32.66 2g94 s TRP 76 CO -0.06 -0.77 -0.22 -1.21 -4.06 0.00 0.00 176.95 170.63 2g94 s GLU 77 N -3.79 1.46 0.20 3.25 2.02 -0.11 -1.37 118.70 120.35 2g94 s GLU 77 Ca 0.03 -0.98 -0.05 0.00 0.02 0.00 0.00 54.97 53.98 2g94 s GLU 77 Cb 0.01 -1.59 0.02 0.00 0.10 0.00 0.00 34.13 32.67 2g94 s GLU 77 CO -0.12 0.41 0.35 0.41 0.02 0.00 0.00 175.26 176.33 2g94 n GLY 78 N 1.81 1.89 3.25 -1.39 0.00 -0.19 -1.52 105.19 109.04 2g94 n GLY 78 Ca -0.17 -1.28 -0.33 0.00 0.00 0.00 0.00 46.02 44.24 2g94 n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2g94 s GLU 79 N -2.19 3.16 0.32 1.61 2.02 -0.16 -1.42 118.70 122.05 2g94 s GLU 79 Ca 0.11 -0.79 -0.26 0.00 0.02 0.00 0.00 54.97 54.04 2g94 s GLU 79 Cb -0.02 -2.51 -0.10 0.00 0.10 0.00 0.00 34.13 31.60 2g94 s GLU 79 CO 0.08 0.08 0.97 -0.51 0.02 0.00 0.00 175.26 175.89 2g94 s LEU 80 N 0.64 4.35 0.00 1.80 1.43 -0.06 -0.64 118.68 126.20 2g94 s LEU 80 Ca -0.10 1.90 -0.10 0.00 -1.03 0.00 0.00 54.13 54.80 2g94 s LEU 80 Cb -0.16 -3.98 0.04 0.00 0.03 0.00 0.00 46.19 42.11 2g94 s LEU 80 CO 0.02 -0.11 0.49 0.61 0.23 0.00 0.00 176.35 177.59 2g94 n GLY 81 N 0.65 0.92 3.16 -3.19 0.00 -0.75 -1.84 105.19 104.14 2g94 n GLY 81 Ca 0.02 -1.02 -0.10 0.00 0.00 0.00 0.00 46.02 44.92 2g94 n GLY 81 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2g94 s THR 82 N -2.31 0.66 0.15 2.61 -4.23 0.37 -0.55 115.64 112.35 2g94 s THR 82 Ca 0.11 -1.90 -0.25 0.00 -1.18 0.00 0.00 61.69 58.46 2g94 s THR 82 Cb -0.01 -1.64 0.06 0.00 1.34 0.00 0.00 72.50 72.25 2g94 s THR 82 CO 0.02 -0.87 0.97 -0.62 -0.54 0.00 0.00 174.62 173.59 2g94 s ASP 83 N -2.99 -0.17 0.23 3.99 -1.08 -0.99 -1.04 116.67 114.61 2g94 s ASP 83 Ca 0.11 -0.40 -0.29 0.00 -0.52 0.00 0.00 52.55 51.45 2g94 s ASP 83 Cb 0.05 0.48 -0.09 0.00 -1.46 0.00 0.00 42.92 41.90 2g94 s ASP 83 CO -0.05 -0.89 0.91 -0.76 0.52 0.00 0.00 175.17 174.90 2g94 s LEU 84 N -2.95 4.63 0.00 -1.34 1.43 -1.26 -1.46 118.68 117.74 2g94 s LEU 84 Ca 0.12 1.89 0.03 0.00 -1.03 0.00 0.00 54.13 55.14 2g94 s LEU 84 Cb -0.01 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.63 2g94 s LEU 84 CO 0.02 0.16 -0.09 -0.69 0.23 0.00 0.00 176.35 175.99 2g94 s VAL 85 N -1.19 0.67 0.12 -1.59 1.01 0.43 -1.03 120.40 118.82 2g94 s VAL 85 Ca 0.40 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.93 2g94 s VAL 85 Cb -0.25 -0.58 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 2g94 s VAL 85 CO 0.31 0.12 -0.01 -0.44 0.00 0.00 0.00 175.10 175.07 2g94 s SER 86 N -0.39 0.88 -0.30 3.32 0.01 -0.72 -1.56 113.70 114.94 2g94 s SER 86 Ca 0.02 -1.11 0.00 0.00 1.31 0.00 0.00 55.95 56.17 2g94 s SER 86 Cb -0.04 0.16 0.09 0.00 0.21 0.00 0.00 66.02 66.45 2g94 s SER 86 CO -0.00 -0.58 0.07 -0.63 0.41 0.00 0.00 173.24 172.50 2g94 s ILE 87 N -3.78 1.24 0.25 1.44 1.01 -1.26 -1.20 121.20 118.90 2g94 s ILE 87 Ca 0.18 -1.53 -0.09 0.00 0.00 0.00 0.00 60.65 59.21 2g94 s ILE 87 Cb 0.06 -1.87 0.33 0.00 0.01 0.00 0.00 42.46 41.00 2g94 s ILE 87 CO -0.01 -0.56 1.60 -0.65 0.00 0.00 0.00 174.94 175.32 2g94 h PRO 88 N 7.98 0.02 -1.97 2.79 0.11 -1.91 -0.82 132.00 138.20 2g94 h PRO 88 Ca -0.12 -0.00 -0.72 0.00 0.11 0.00 0.00 66.00 65.27 2g94 h PRO 88 Cb 1.03 -0.01 -0.32 0.00 0.11 0.00 0.00 31.00 31.81 2g94 h PRO 88 CO 0.47 0.02 0.45 0.72 -0.21 0.00 0.00 178.00 179.44 2g94 n HIS 89 N -5.48 3.16 -3.09 0.65 8.25 -1.26 -4.93 115.22 112.52 2g94 n HIS 89 Ca 0.13 -2.75 0.00 0.00 -0.26 0.00 0.00 57.72 54.84 2g94 n HIS 89 Cb 0.45 -0.85 0.00 0.00 1.12 0.00 0.00 29.99 30.71 2g94 n HIS 89 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2g94 n GLY 90 N -0.39 4.60 3.73 -1.41 0.00 -0.31 -4.48 105.19 106.92 2g94 n GLY 90 Ca 0.46 -1.38 -0.34 0.00 0.00 0.00 0.00 46.02 44.76 2g94 n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2g94 s PRO 91 N 0.30 2.26 -1.31 1.61 0.04 -1.26 -4.86 135.00 131.77 2g94 s PRO 91 Ca 0.00 1.71 -0.16 0.00 0.04 0.00 0.00 61.00 62.59 2g94 s PRO 91 Cb 0.00 -1.85 0.09 0.00 0.04 0.00 0.00 34.50 32.77 2g94 s PRO 91 CO 0.00 -1.73 1.79 -1.71 0.04 0.00 0.00 177.00 175.39 2g94 n ASN 92 N -2.64 4.80 -3.99 6.66 2.85 -1.26 -4.63 115.26 117.04 2g94 n ASN 92 Ca 0.13 -2.92 -0.12 0.00 -0.11 0.00 0.00 54.58 51.56 2g94 n ASN 92 Cb 0.50 -1.69 -0.08 0.00 1.24 0.00 0.00 39.78 39.76 2g94 n ASN 92 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 2g94 s VAL 93 N 3.40 0.00 -0.03 3.44 -7.23 -1.26 -5.15 120.40 113.57 2g94 s VAL 93 Ca 0.50 -1.79 -0.01 0.00 -1.81 0.00 0.00 61.98 58.88 2g94 s VAL 93 Cb 0.05 -2.42 0.03 0.00 0.56 0.00 0.00 36.38 34.60 2g94 s VAL 93 CO 0.03 0.00 0.03 -0.89 -0.31 0.00 0.00 175.10 173.96 2g94 s THR 94 N -3.97 0.05 0.07 5.32 2.01 -1.26 -4.48 115.64 113.39 2g94 s THR 94 Ca 0.33 0.22 0.08 0.00 0.31 0.00 0.00 61.69 62.64 2g94 s THR 94 Cb 0.04 -0.21 -0.03 0.00 0.01 0.00 0.00 72.50 72.31 2g94 s THR 94 CO 0.13 0.15 -0.22 0.68 -0.69 0.00 0.00 174.62 174.67 2g94 s VAL 95 N 1.45 1.83 -0.27 3.82 -7.23 -0.60 -4.93 120.40 114.48 2g94 s VAL 95 Ca -0.04 -1.39 -0.17 0.00 -1.81 0.00 0.00 61.98 58.57 2g94 s VAL 95 Cb -0.13 -1.61 -0.03 0.00 0.56 0.00 0.00 36.38 35.18 2g94 s VAL 95 CO -0.03 0.14 0.48 -0.60 -0.31 0.00 0.00 175.10 174.78 2g94 s ARG 96 N -1.50 4.03 0.18 4.82 3.52 -1.26 -0.43 118.95 128.31 2g94 s ARG 96 Ca 0.09 0.22 0.06 0.00 -0.13 0.00 0.00 55.73 55.97 2g94 s ARG 96 Cb -0.09 -3.66 -0.05 0.00 -1.56 0.00 0.00 34.95 29.59 2g94 s ARG 96 CO 0.03 -0.35 -0.12 0.00 -0.81 0.00 0.00 175.30 174.05 2g94 s ALA 97 N 2.26 1.72 0.28 6.12 0.00 -0.53 -4.93 121.76 126.68 2g94 s ALA 97 Ca 0.19 -1.58 -0.29 0.00 0.00 0.00 0.00 51.96 50.28 2g94 s ALA 97 Cb -0.16 0.01 -0.10 0.00 0.00 0.00 0.00 23.12 22.88 2g94 s ALA 97 CO 0.10 -0.03 1.18 -0.80 0.00 0.00 0.00 175.76 176.21 2g94 s ASN 98 N -3.24 7.08 -0.04 0.00 0.01 -1.26 -2.36 114.94 115.14 2g94 s ASN 98 Ca 0.20 2.40 0.00 0.00 -0.71 0.00 0.00 52.86 54.75 2g94 s ASN 98 Cb 0.01 -2.63 0.03 0.00 0.41 0.00 0.00 41.25 39.07 2g94 s ASN 98 CO 0.04 -0.30 -0.01 -0.63 -1.51 0.00 0.00 177.10 174.68 2g94 s ILE 99 N -0.98 0.29 -0.26 0.60 1.01 0.29 -4.61 121.20 117.54 2g94 s ILE 99 Ca 0.47 0.04 -0.15 0.00 0.00 0.00 0.00 60.65 61.01 2g94 s ILE 99 Cb -0.35 -0.38 -0.04 0.00 0.01 0.00 0.00 42.46 41.71 2g94 s ILE 99 CO 0.44 0.18 0.39 0.00 0.00 0.00 0.00 174.94 175.96 2g94 s ALA 100 N 1.14 3.57 -0.56 9.38 0.00 -0.44 -1.81 121.76 133.04 2g94 s ALA 100 Ca -0.08 -0.77 -0.23 0.00 0.00 0.00 0.00 51.96 50.88 2g94 s ALA 100 Cb -0.14 -2.73 0.05 0.00 0.00 0.00 0.00 23.12 20.31 2g94 s ALA 100 CO -0.02 -0.64 0.88 0.00 0.00 0.00 0.00 175.76 175.99 2g94 s ALA 101 N 2.04 3.20 -0.09 0.00 0.00 0.19 -1.23 121.76 125.86 2g94 s ALA 101 Ca 0.16 -1.46 -0.29 0.00 0.00 0.00 0.00 51.96 50.37 2g94 s ALA 101 Cb -0.16 -3.68 -0.04 0.00 0.00 0.00 0.00 23.12 19.24 2g94 s ALA 101 CO 0.10 -2.39 1.58 0.42 0.00 0.00 0.00 175.76 175.47 2g94 s ILE 102 N 3.71 3.72 -0.04 0.00 1.01 0.37 -0.99 121.20 128.98 2g94 s ILE 102 Ca 0.26 0.87 0.11 0.00 0.00 0.00 0.00 60.65 61.88 2g94 s ILE 102 Cb -0.15 -3.58 -0.16 0.00 0.01 0.00 0.00 42.46 38.58 2g94 s ILE 102 CO 0.16 -0.10 0.18 0.35 0.00 0.00 0.00 174.94 175.53 2g94 n THR 103 N 5.58 0.24 -3.91 2.92 -2.24 -0.58 -1.61 114.28 114.68 2g94 n THR 103 Ca 0.17 -0.32 -0.11 0.00 -2.27 0.00 0.00 64.05 61.52 2g94 n THR 103 Cb 0.43 -0.07 -0.12 0.00 -2.10 0.00 0.00 70.33 68.48 2g94 n THR 103 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2g94 s GLU 104 N -2.62 0.26 0.16 -0.78 0.41 -1.05 -4.95 118.70 110.12 2g94 s GLU 104 Ca -0.05 -0.32 -0.20 0.00 -0.41 0.00 0.00 54.97 54.00 2g94 s GLU 104 Cb 0.06 0.10 0.05 0.00 -1.78 0.00 0.00 34.13 32.56 2g94 s GLU 104 CO 0.46 -0.05 0.53 -1.54 -0.49 0.00 0.00 175.26 174.17 2g94 s SER 105 N -0.91 -0.41 -0.14 -0.19 1.04 -1.26 -0.94 113.70 110.89 2g94 s SER 105 Ca -0.10 -0.18 -0.05 0.00 0.48 0.00 0.00 55.95 56.10 2g94 s SER 105 Cb -0.06 0.56 0.07 0.00 0.10 0.00 0.00 66.02 66.69 2g94 s SER 105 CO -0.00 -0.95 0.29 -0.62 0.98 0.00 0.00 173.24 172.94 2g94 s ASP 106 N -2.79 0.15 -1.51 7.02 2.15 -0.15 -4.87 116.67 116.67 2g94 s ASP 106 Ca 0.03 0.66 0.00 0.00 0.43 0.00 0.00 52.55 53.67 2g94 s ASP 106 Cb -0.00 0.77 0.00 0.00 -0.30 0.00 0.00 42.92 43.39 2g94 s ASP 106 CO -0.11 -0.23 0.00 0.29 -0.17 0.00 0.00 175.17 174.95 2g94 n LYS 107 N 5.18 -1.88 -0.05 4.34 5.02 -1.26 -1.68 118.16 127.83 2g94 n LYS 107 Ca -0.09 0.85 -0.06 0.00 -2.02 0.00 0.00 58.31 56.99 2g94 n LYS 107 Cb 0.50 -5.48 -0.02 0.00 -0.02 0.00 0.00 35.03 30.02 2g94 n LYS 107 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2g94 n PHE 108 N -3.67 0.00 -2.31 2.13 7.35 -1.26 -3.90 117.46 115.79 2g94 n PHE 108 Ca -0.20 0.00 -0.37 0.00 -0.76 0.00 0.00 57.45 56.12 2g94 n PHE 108 Cb 0.65 -0.33 -0.02 0.00 0.35 0.00 0.00 39.48 40.14 2g94 n PHE 108 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 2g94 s PHE 109 N -2.36 2.95 -0.19 -5.13 0.40 -1.26 -5.02 117.98 107.38 2g94 s PHE 109 Ca -0.19 1.56 -0.01 0.00 -0.60 0.00 0.00 56.93 57.69 2g94 s PHE 109 Cb 0.03 -3.33 0.01 0.00 0.51 0.00 0.00 43.02 40.24 2g94 s PHE 109 CO 0.28 -1.33 -0.14 0.42 0.70 0.00 0.00 175.22 175.15 2g94 s ILE 110 N -1.57 2.57 0.09 0.64 1.01 -1.26 -5.03 121.20 117.64 2g94 s ILE 110 Ca 0.62 -0.77 -0.34 0.00 0.00 0.00 0.00 60.65 60.16 2g94 s ILE 110 Cb -0.27 -2.12 -0.14 0.00 0.01 0.00 0.00 42.46 39.94 2g94 s ILE 110 CO 0.33 0.50 1.62 -3.20 0.00 0.00 0.00 174.94 174.19 2g94 n ASN 111 N 4.65 2.99 0.00 3.58 4.05 -1.26 -1.70 115.26 127.58 2g94 n ASN 111 Ca -0.20 1.06 0.00 0.00 0.45 0.00 0.00 54.58 55.89 2g94 n ASN 111 Cb 0.50 -1.38 0.00 0.00 1.23 0.00 0.00 39.78 40.13 2g94 n ASN 111 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2g94 n GLY 112 N 3.55 1.11 0.23 8.20 0.00 -1.26 -4.90 105.19 112.11 2g94 n GLY 112 Ca 0.19 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.31 2g94 n GLY 112 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2g94 h SER 113 N 0.00 0.00 -0.24 1.61 4.64 -1.67 -3.47 113.55 114.42 2g94 h SER 113 Ca 0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 2g94 h SER 113 Cb 0.00 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.05 2g94 h SER 113 CO 0.00 0.19 -0.09 -3.20 -0.87 0.00 0.00 176.83 172.86 2g94 n ASN 114 N -3.33 -4.23 -4.44 4.97 5.15 -1.26 -4.93 115.26 107.19 2g94 n ASN 114 Ca 0.00 0.12 -0.30 0.00 -0.60 0.00 0.00 54.58 53.81 2g94 n ASN 114 Cb 0.43 -2.17 -0.13 0.00 -0.53 0.00 0.00 39.78 37.38 2g94 n ASN 114 CO 0.00 0.00 0.00 -1.66 1.40 0.00 0.00 177.26 177.00 2g94 s TRP 115 N -1.97 2.50 0.00 1.20 1.48 -1.26 -4.62 118.94 116.26 2g94 s TRP 115 Ca 0.00 -0.29 0.00 0.00 -1.06 0.00 0.00 56.10 54.75 2g94 s TRP 115 Cb 0.00 -1.41 0.00 0.00 -1.16 0.00 0.00 33.47 30.90 2g94 s TRP 115 CO 0.00 0.27 0.59 0.39 -4.06 0.00 0.00 176.95 174.14 2g94 n GLU 116 N 1.37 -0.14 -3.87 3.25 4.71 0.11 -4.86 120.64 121.22 2g94 n GLU 116 Ca -0.16 -0.69 -0.10 0.00 -0.01 0.00 0.00 57.16 56.19 2g94 n GLU 116 Cb 0.52 -0.98 0.01 0.00 -1.01 0.00 0.00 31.44 29.98 2g94 n GLU 116 CO 0.00 0.00 0.00 0.20 0.09 0.00 0.00 177.13 177.42 2g94 s GLY 117 N -0.21 0.66 -0.01 0.62 0.00 -1.06 -0.72 107.32 106.60 2g94 s GLY 117 Ca 0.00 -0.95 0.01 0.00 0.00 0.00 0.00 44.72 43.78 2g94 s GLY 117 CO 0.00 -0.48 -0.04 -1.50 0.00 0.00 0.00 173.10 171.08 2g94 s ILE 118 N -2.39 0.35 -0.49 0.90 2.07 0.84 -0.67 121.20 121.80 2g94 s ILE 118 Ca 0.19 -0.15 -0.05 0.00 -1.41 0.00 0.00 60.65 59.23 2g94 s ILE 118 Cb -0.04 -0.32 0.13 0.00 0.13 0.00 0.00 42.46 42.36 2g94 s ILE 118 CO 0.14 0.12 0.32 -0.22 -1.91 0.00 0.00 174.94 173.38 2g94 s LEU 119 N 0.13 5.43 -0.25 8.50 2.96 0.28 -1.33 118.68 134.40 2g94 s LEU 119 Ca -0.01 -2.21 -0.29 0.00 -0.22 0.00 0.00 54.13 51.39 2g94 s LEU 119 Cb -0.04 -1.90 -0.01 0.00 0.50 0.00 0.00 46.19 44.74 2g94 s LEU 119 CO -0.00 -0.55 1.38 -0.83 -1.32 0.00 0.00 176.35 175.03 2g94 s GLY 120 N 1.81 1.40 0.00 7.98 0.00 -0.76 -1.97 107.32 115.79 2g94 s GLY 120 Ca 0.10 0.28 0.24 0.00 0.00 0.00 0.00 44.72 45.34 2g94 s GLY 120 CO -0.03 2.68 1.22 1.04 0.00 0.00 0.00 173.10 178.01 2g94 n LEU 121 N 7.60 2.49 0.00 0.66 4.77 -0.54 -4.30 117.00 127.68 2g94 n LEU 121 Ca 0.16 -0.86 -0.11 0.00 -0.03 0.00 0.00 56.01 55.17 2g94 n LEU 121 Cb 0.46 -0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.62 2g94 n LEU 121 CO 0.62 0.43 0.29 0.00 -1.33 0.00 0.00 177.39 177.40 2g94 n ALA 122 N 0.69 -0.75 -2.08 -1.18 0.00 0.26 -4.92 120.51 112.52 2g94 n ALA 122 Ca 0.12 -0.61 -0.28 0.00 0.00 0.00 0.00 53.44 52.67 2g94 n ALA 122 Cb 0.53 -0.03 0.02 0.00 0.00 0.00 0.00 19.45 19.96 2g94 n ALA 122 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2g94 s TYR 123 N -1.94 3.42 0.39 0.00 1.51 -0.62 -4.64 117.35 115.48 2g94 s TYR 123 Ca 0.27 0.86 0.15 0.00 -1.01 0.00 0.00 57.07 57.33 2g94 s TYR 123 Cb -0.01 -2.65 1.01 0.00 -0.11 0.00 0.00 41.96 40.20 2g94 s TYR 123 CO 0.19 -0.68 1.83 0.00 -1.11 0.00 0.00 175.55 175.78 2g94 h ALA 124 N -0.14 2.10 -1.09 3.71 0.00 -1.87 -2.33 119.26 119.64 2g94 h ALA 124 Ca -0.46 0.03 0.31 0.00 0.00 0.00 0.00 54.91 54.80 2g94 h ALA 124 Cb 1.23 -0.04 -0.12 0.00 0.00 0.00 0.00 17.79 18.87 2g94 h ALA 124 CO 0.62 -0.41 0.68 1.49 0.00 0.00 0.00 179.25 181.62 2g94 h GLU 125 N 0.49 0.33 -0.47 0.00 4.57 -1.87 0.30 114.58 117.93 2g94 h GLU 125 Ca 0.50 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.66 2g94 h GLU 125 Cb 1.14 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 2g94 h GLU 125 CO -0.23 0.22 0.00 0.44 -1.18 0.00 0.00 179.01 178.26 2g94 n ILE 126 N -4.76 1.87 -2.60 2.32 -5.35 -0.88 -4.58 119.36 105.38 2g94 n ILE 126 Ca 0.29 -1.37 -0.33 0.00 -0.27 0.00 0.00 62.75 61.07 2g94 n ILE 126 Cb 1.00 0.07 -0.04 0.00 -1.74 0.00 0.00 39.64 38.92 2g94 n ILE 126 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2g94 s ALA 127 N -2.02 2.94 0.02 -1.28 0.00 0.09 -4.53 121.76 116.98 2g94 s ALA 127 Ca 0.43 0.47 0.02 0.00 0.00 0.00 0.00 51.96 52.88 2g94 s ALA 127 Cb 0.30 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 20.18 2g94 s ALA 127 CO 0.17 -0.17 0.00 1.03 0.00 0.00 0.00 175.76 176.79 2g94 s ARG 128 N -3.35 2.74 0.34 0.00 1.81 -1.26 -2.98 118.95 116.26 2g94 s ARG 128 Ca 0.64 -0.66 0.08 0.00 -1.72 0.00 0.00 55.73 54.07 2g94 s ARG 128 Cb -0.13 -2.65 0.63 0.00 -0.45 0.00 0.00 34.95 32.36 2g94 s ARG 128 CO 0.20 0.60 1.82 -1.35 -0.68 0.00 0.00 175.30 175.89 2g94 h PRO 129 N 4.11 0.26 0.00 3.54 0.11 -1.90 -3.46 132.00 134.65 2g94 h PRO 129 Ca -0.49 -0.08 -0.02 0.00 0.11 0.00 0.00 66.00 65.53 2g94 h PRO 129 Cb 1.17 -0.02 0.01 0.00 0.11 0.00 0.00 31.00 32.27 2g94 h PRO 129 CO 0.58 0.49 0.23 -0.40 -0.21 0.00 0.00 178.00 178.69 2g94 n ASP 130 N -4.17 -1.82 0.00 -2.05 5.75 -1.16 -5.01 116.55 108.09 2g94 n ASP 130 Ca -0.01 -2.25 0.04 0.00 -0.01 0.00 0.00 54.79 52.56 2g94 n ASP 130 Cb 0.36 3.03 0.21 0.00 -1.03 0.00 0.00 41.12 43.69 2g94 n ASP 130 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 2g94 n ASP 131 N -1.42 0.00 0.21 -1.12 5.68 -1.24 -2.18 116.55 116.49 2g94 n ASP 131 Ca -0.07 -0.52 0.11 0.00 -0.50 0.00 0.00 54.79 53.81 2g94 n ASP 131 Cb 0.47 0.00 0.18 0.00 -1.14 0.00 0.00 41.12 40.64 2g94 n ASP 131 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2g94 h SER 132 N 0.00 0.00 -2.53 -1.12 4.64 -1.91 -3.42 113.55 109.21 2g94 h SER 132 Ca 0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.72 2g94 h SER 132 Cb 0.00 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 61.97 2g94 h SER 132 CO 0.00 0.07 0.75 -0.22 -0.87 0.00 0.00 176.83 176.56 2g94 s LEU 133 N -6.25 3.93 0.04 5.97 2.96 -0.93 -4.99 118.68 119.42 2g94 s LEU 133 Ca 0.06 -0.81 -0.33 0.00 -0.22 0.00 0.00 54.13 52.83 2g94 s LEU 133 Cb 0.06 -2.47 -0.11 0.00 0.50 0.00 0.00 46.19 44.16 2g94 s LEU 133 CO 0.67 -1.59 1.82 1.21 -1.32 0.00 0.00 176.35 177.15 2g94 n GLU 134 N 8.32 2.46 -1.18 1.98 2.13 -1.26 -4.87 120.64 128.23 2g94 n GLU 134 Ca -0.01 0.90 -0.31 0.00 0.66 0.00 0.00 57.16 58.40 2g94 n GLU 134 Cb 0.47 -2.76 0.10 0.00 0.27 0.00 0.00 31.44 29.52 2g94 n GLU 134 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 2g94 s PRO 135 N 3.08 2.02 0.15 5.31 0.02 -1.26 -4.53 135.00 139.79 2g94 s PRO 135 Ca 0.86 1.20 -0.20 0.00 0.02 0.00 0.00 61.00 62.88 2g94 s PRO 135 Cb -0.59 -1.87 0.04 0.00 0.02 0.00 0.00 34.50 32.10 2g94 s PRO 135 CO 0.43 -1.82 1.66 0.35 -0.33 0.00 0.00 177.00 177.29 2g94 h PHE 136 N -1.26 -0.36 -0.38 6.54 3.57 -1.82 -2.35 116.94 120.88 2g94 h PHE 136 Ca -0.44 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.08 2g94 h PHE 136 Cb 1.24 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 40.16 2g94 h PHE 136 CO 0.56 -0.22 0.19 0.35 -2.23 0.00 0.00 178.31 176.96 2g94 h PHE 137 N -0.12 0.51 -0.59 0.41 3.57 -1.91 -0.40 116.94 118.41 2g94 h PHE 137 Ca 0.14 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.61 2g94 h PHE 137 Cb 0.34 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.88 2g94 h PHE 137 CO -0.33 0.38 0.26 -0.44 -2.23 0.00 0.00 178.31 175.95 2g94 h ASP 138 N 0.53 0.80 -0.37 0.41 3.32 -1.81 -1.29 116.42 118.02 2g94 h ASP 138 Ca 0.14 -0.15 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 2g94 h ASP 138 Cb 0.05 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 2g94 h ASP 138 CO -0.02 0.73 0.20 0.28 -1.72 0.00 0.00 179.24 178.71 2g94 h SER 139 N 0.81 0.46 -0.11 6.45 0.02 -0.86 -1.16 113.55 119.16 2g94 h SER 139 Ca 0.20 -0.09 0.04 0.00 -0.84 0.00 0.00 61.79 61.11 2g94 h SER 139 Cb 0.16 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 62.53 2g94 h SER 139 CO -0.02 0.41 -0.20 0.25 -1.14 0.00 0.00 176.83 176.13 2g94 h LEU 140 N 0.47 -0.61 -0.94 5.07 5.85 -0.76 0.17 115.31 124.57 2g94 h LEU 140 Ca 0.13 0.10 -0.06 0.00 0.84 0.00 0.00 57.88 58.89 2g94 h LEU 140 Cb 0.05 0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.33 2g94 h LEU 140 CO -0.02 -0.25 0.11 0.58 -0.34 0.00 0.00 178.44 178.52 2g94 h VAL 141 N -0.26 1.24 -0.08 1.05 2.07 -1.11 -1.66 116.25 117.49 2g94 h VAL 141 Ca 0.09 -0.89 -0.17 0.00 0.82 0.00 0.00 66.70 66.55 2g94 h VAL 141 Cb 0.40 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.84 2g94 h VAL 141 CO -0.27 0.33 -0.67 0.11 0.02 0.00 0.00 177.57 177.09 2g94 h LYS 142 N 0.85 0.35 -0.01 1.57 1.57 -0.62 -3.29 116.57 116.99 2g94 h LYS 142 Ca 0.18 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 2g94 h LYS 142 Cb 0.35 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2g94 h LYS 142 CO 0.00 0.89 -0.43 1.04 -0.57 0.00 0.00 179.45 180.39 2g94 n GLN 143 N -3.85 0.76 -3.02 3.15 6.02 0.56 -4.98 117.38 116.02 2g94 n GLN 143 Ca -0.03 -0.54 -0.09 0.00 -0.01 0.00 0.00 57.00 56.32 2g94 n GLN 143 Cb 0.67 -1.49 -0.03 0.00 1.02 0.00 0.00 30.24 30.40 2g94 n GLN 143 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2g94 n THR 144 N -0.65 0.00 -0.50 5.09 -2.24 -0.64 -5.05 114.28 110.30 2g94 n THR 144 Ca 0.10 -1.09 0.09 0.00 -2.27 0.00 0.00 64.05 60.87 2g94 n THR 144 Cb 0.38 0.51 0.28 0.00 -2.10 0.00 0.00 70.33 69.40 2g94 n THR 144 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 2g94 n HIS 145 N -0.31 1.03 -1.93 4.78 8.25 -1.26 -4.77 115.22 121.01 2g94 n HIS 145 Ca 0.02 -0.60 -0.42 0.00 -0.26 0.00 0.00 57.72 56.47 2g94 n HIS 145 Cb 0.27 -0.15 -0.03 0.00 1.12 0.00 0.00 29.99 31.21 2g94 n HIS 145 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2g94 s VAL 146 N -1.58 2.59 0.66 1.59 1.01 -1.26 -4.94 120.40 118.47 2g94 s VAL 146 Ca 0.42 0.43 -0.17 0.00 0.00 0.00 0.00 61.98 62.65 2g94 s VAL 146 Cb 0.26 -3.27 -0.00 0.00 0.00 0.00 0.00 36.38 33.36 2g94 s VAL 146 CO 0.22 0.03 1.27 -2.84 0.00 0.00 0.00 175.10 173.78 2g94 s PRO 147 N 1.09 2.47 -1.19 2.72 0.02 -1.26 -4.68 135.00 134.16 2g94 s PRO 147 Ca 0.70 2.00 -0.15 0.00 0.02 0.00 0.00 61.00 63.57 2g94 s PRO 147 Cb -0.44 -1.84 -0.05 0.00 0.02 0.00 0.00 34.50 32.18 2g94 s PRO 147 CO 0.32 -1.65 2.22 -1.71 -0.33 0.00 0.00 177.00 175.85 2g94 n ASN 148 N -2.07 4.25 -3.60 2.53 5.15 -1.26 -4.24 115.26 116.03 2g94 n ASN 148 Ca 0.15 -2.69 -0.05 0.00 -0.60 0.00 0.00 54.58 51.40 2g94 n ASN 148 Cb 0.49 -1.40 -0.03 0.00 -0.53 0.00 0.00 39.78 38.31 2g94 n ASN 148 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 2g94 s LEU 149 N 1.32 -0.15 0.18 1.20 2.34 -1.26 -1.41 118.68 120.90 2g94 s LEU 149 Ca 0.53 0.04 -0.10 0.00 0.06 0.00 0.00 54.13 54.66 2g94 s LEU 149 Cb 0.14 1.42 -0.01 0.00 -0.56 0.00 0.00 46.19 47.18 2g94 s LEU 149 CO -0.01 -0.23 0.33 0.72 -1.06 0.00 0.00 176.35 176.09 2g94 s PHE 150 N -2.14 0.41 0.02 3.48 -0.71 -1.09 0.20 117.98 118.15 2g94 s PHE 150 Ca 0.08 -0.76 -0.00 0.00 -1.04 0.00 0.00 56.93 55.21 2g94 s PHE 150 Cb -0.01 -0.01 -0.02 0.00 -1.21 0.00 0.00 43.02 41.77 2g94 s PHE 150 CO -0.05 -0.78 -0.02 -1.54 -1.34 0.00 0.00 175.22 171.50 2g94 s SER 151 N -2.98 0.19 -0.05 1.98 1.04 -0.27 -0.42 113.70 113.19 2g94 s SER 151 Ca 0.19 -0.40 0.03 0.00 0.48 0.00 0.00 55.95 56.25 2g94 s SER 151 Cb 0.02 0.09 0.01 0.00 0.10 0.00 0.00 66.02 66.24 2g94 s SER 151 CO 0.02 -0.25 -0.13 -0.76 0.98 0.00 0.00 173.24 173.10 2g94 s LEU 152 N -1.22 1.75 -0.28 2.42 1.43 0.53 -0.80 118.68 122.52 2g94 s LEU 152 Ca -0.13 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 52.70 2g94 s LEU 152 Cb -0.08 -0.79 0.08 0.00 0.03 0.00 0.00 46.19 45.42 2g94 s LEU 152 CO -0.01 0.07 -0.01 -1.58 0.23 0.00 0.00 176.35 175.06 2g94 s GLN 153 N 0.37 1.55 -0.22 1.70 0.74 0.37 -0.92 119.66 123.25 2g94 s GLN 153 Ca -0.09 -1.30 -0.11 0.00 0.05 0.00 0.00 55.36 53.92 2g94 s GLN 153 Cb -0.13 -2.72 -0.05 0.00 1.10 0.00 0.00 33.01 31.22 2g94 s GLN 153 CO 0.02 -0.74 0.16 -0.51 -0.55 0.00 0.00 175.29 173.68 2g94 s LEU 154 N 1.25 4.16 -0.33 3.68 1.43 -1.26 -0.45 118.68 127.16 2g94 s LEU 154 Ca 0.00 0.19 -0.04 0.00 -1.03 0.00 0.00 54.13 53.25 2g94 s LEU 154 Cb -0.19 -2.13 0.05 0.00 0.03 0.00 0.00 46.19 43.95 2g94 s LEU 154 CO -0.09 0.11 0.07 0.00 0.23 0.00 0.00 176.35 176.66 2g94 s GLY 156 N 1.39 2.79 0.22 0.00 0.00 -1.26 -4.78 107.32 105.68 2g94 s GLY 156 Ca -0.02 0.35 0.12 0.00 0.00 0.00 0.00 44.72 45.16 2g94 s GLY 156 CO 0.01 0.78 1.43 0.00 0.00 0.00 0.00 173.10 175.32 2g94 h ALA 157 N 3.68 0.61 0.00 3.20 0.00 -1.96 -3.43 119.26 121.36 2g94 h ALA 157 Ca -0.47 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 53.80 2g94 h ALA 157 Cb 1.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2g94 h ALA 157 CO 0.66 0.88 0.00 0.41 0.00 0.00 0.00 179.25 181.20 2g94 n GLY 158 N 1.05 0.71 3.40 0.00 0.00 -1.26 -4.99 105.19 104.11 2g94 n GLY 158 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 2g94 n GLY 158 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2g94 s PHE 159 N -2.64 -0.11 0.61 1.61 -0.71 -1.26 -4.86 117.98 110.62 2g94 s PHE 159 Ca 0.00 -0.23 -0.18 0.00 -1.04 0.00 0.00 56.93 55.49 2g94 s PHE 159 Cb 0.00 0.28 -0.02 0.00 -1.21 0.00 0.00 43.02 42.06 2g94 s PHE 159 CO 0.00 -0.79 1.17 -1.25 -1.34 0.00 0.00 175.22 173.01 2g94 s PRO 160 N -3.85 2.93 -0.03 1.99 0.04 -1.26 -4.92 135.00 129.90 2g94 s PRO 160 Ca 0.07 1.67 0.05 0.00 0.04 0.00 0.00 61.00 62.83 2g94 s PRO 160 Cb 0.01 -1.94 -0.01 0.00 0.04 0.00 0.00 34.50 32.60 2g94 s PRO 160 CO -0.07 -1.20 -0.19 -0.51 0.04 0.00 0.00 177.00 175.07 2g94 s LEU 161 N -4.30 1.98 0.79 -3.56 1.43 -1.26 -5.06 118.68 108.70 2g94 s LEU 161 Ca 0.74 -0.37 -0.07 0.00 -1.03 0.00 0.00 54.13 53.40 2g94 s LEU 161 Cb -0.26 -1.02 0.13 0.00 0.03 0.00 0.00 46.19 45.07 2g94 s LEU 161 CO 0.35 0.19 1.10 0.54 0.23 0.00 0.00 176.35 178.76 2g94 s ASN 162 N -0.17 4.08 0.15 2.29 6.03 -1.26 -4.79 114.94 121.28 2g94 s ASN 162 Ca 0.01 0.04 -0.20 0.00 -1.03 0.00 0.00 52.86 51.67 2g94 s ASN 162 Cb -0.10 -0.38 0.05 0.00 -3.03 0.00 0.00 41.25 37.78 2g94 s ASN 162 CO 0.01 -2.06 1.65 -0.61 -2.03 0.00 0.00 177.10 174.06 2g94 h GLN 163 N -0.89 -0.14 -0.11 3.55 5.75 -2.00 -0.63 115.11 120.64 2g94 h GLN 163 Ca -0.41 0.01 -0.06 0.00 -0.15 0.00 0.00 58.65 58.04 2g94 h GLN 163 Cb 1.27 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 29.84 2g94 h GLN 163 CO 0.44 -0.10 -0.19 0.66 -2.65 0.00 0.00 178.83 176.99 2g94 h SER 164 N -0.15 0.17 -0.30 -0.69 4.64 -1.99 -2.23 113.55 113.00 2g94 h SER 164 Ca 0.15 -0.04 -0.17 0.00 -0.47 0.00 0.00 61.79 61.26 2g94 h SER 164 Cb 0.38 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2g94 h SER 164 CO -0.37 0.38 -0.48 -0.33 -0.87 0.00 0.00 176.83 175.15 2g94 h GLU 165 N 0.17 0.85 -0.16 4.77 5.08 -1.68 -1.95 114.58 121.66 2g94 h GLU 165 Ca 0.03 -0.52 -0.12 0.00 -1.00 0.00 0.00 59.36 57.75 2g94 h GLU 165 Cb 0.45 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2g94 h GLU 165 CO 0.03 1.15 -0.42 0.28 -1.00 0.00 0.00 179.01 179.05 2g94 h VAL 166 N 0.63 1.31 -0.18 3.13 2.07 -0.93 -2.63 116.25 119.64 2g94 h VAL 166 Ca 0.02 -1.57 -0.14 0.00 0.82 0.00 0.00 66.70 65.84 2g94 h VAL 166 Cb 1.09 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 2g94 h VAL 166 CO 0.11 0.48 -0.46 -0.07 0.02 0.00 0.00 177.57 177.65 2g94 h LEU 167 N 0.30 0.50 -2.27 2.57 3.38 -1.36 -3.24 115.31 115.18 2g94 h LEU 167 Ca 0.03 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2g94 h LEU 167 Cb 0.87 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.47 2g94 h LEU 167 CO 0.07 0.89 0.00 0.00 0.09 0.00 0.00 178.44 179.49 2g94 n ALA 168 N -2.50 2.63 -2.52 1.53 0.00 -0.74 -4.96 120.51 113.95 2g94 n ALA 168 Ca -0.02 -1.10 -0.25 0.00 0.00 0.00 0.00 53.44 52.08 2g94 n ALA 168 Cb 0.54 -0.98 -0.11 0.00 0.00 0.00 0.00 19.45 18.90 2g94 n ALA 168 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2g94 s SER 169 N -0.92 3.17 -0.18 0.00 1.04 -1.01 -5.04 113.70 110.75 2g94 s SER 169 Ca 0.39 -1.33 -0.20 0.00 0.48 0.00 0.00 55.95 55.29 2g94 s SER 169 Cb 0.22 -0.25 -0.03 0.00 0.10 0.00 0.00 66.02 66.06 2g94 s SER 169 CO 0.23 -0.47 0.60 -0.69 0.98 0.00 0.00 173.24 173.90 2g94 s VAL 170 N -2.95 5.05 -0.84 5.02 1.01 -1.26 -4.76 120.40 121.67 2g94 s VAL 170 Ca 0.35 1.14 0.23 0.00 0.00 0.00 0.00 61.98 63.70 2g94 s VAL 170 Cb 0.08 -3.92 -0.09 0.00 0.00 0.00 0.00 36.38 32.45 2g94 s VAL 170 CO 0.16 0.15 1.16 0.61 0.00 0.00 0.00 175.10 177.18 2g94 n GLY 171 N 3.71 -1.19 0.00 4.51 0.00 0.10 -4.90 105.19 107.42 2g94 n GLY 171 Ca -0.02 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2g94 n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g94 n GLY 172 N 1.44 0.45 2.92 -0.02 0.00 -1.13 -0.59 105.19 108.27 2g94 n GLY 172 Ca 0.04 -1.62 -0.13 0.00 0.00 0.00 0.00 46.02 44.31 2g94 n GLY 172 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2g94 s SER 173 N -4.00 0.26 -0.29 1.61 0.01 0.41 -1.05 113.70 110.65 2g94 s SER 173 Ca 0.00 -0.15 0.02 0.00 1.31 0.00 0.00 55.95 57.13 2g94 s SER 173 Cb 0.00 0.00 0.08 0.00 0.21 0.00 0.00 66.02 66.31 2g94 s SER 173 CO 0.00 -0.05 0.01 -0.32 0.41 0.00 0.00 173.24 173.29 2g94 s MET 174 N -0.39 1.45 -0.37 12.44 0.00 -1.26 -0.48 119.30 130.70 2g94 s MET 174 Ca -0.03 -1.34 -0.21 0.00 0.00 0.00 0.00 55.69 54.11 2g94 s MET 174 Cb -0.03 -2.71 0.01 0.00 0.00 0.00 0.00 34.83 32.10 2g94 s MET 174 CO -0.00 -0.79 0.65 0.42 0.00 0.00 0.00 175.02 175.30 2g94 s ILE 175 N 1.24 4.86 -0.26 10.11 -1.09 0.02 -4.87 121.20 131.22 2g94 s ILE 175 Ca 0.03 0.55 -0.18 0.00 -2.23 0.00 0.00 60.65 58.81 2g94 s ILE 175 Cb -0.19 -4.11 -0.03 0.00 -1.58 0.00 0.00 42.46 36.56 2g94 s ILE 175 CO -0.11 -0.37 0.54 -0.63 -1.23 0.00 0.00 174.94 173.14 2g94 s ILE 176 N 2.77 5.05 0.00 2.92 1.01 -1.26 -1.11 121.20 130.58 2g94 s ILE 176 Ca 0.25 0.93 0.00 0.00 0.00 0.00 0.00 60.65 61.83 2g94 s ILE 176 Cb -0.14 -3.85 0.00 0.00 0.01 0.00 0.00 42.46 38.48 2g94 s ILE 176 CO 0.16 0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.78 2g94 n GLY 177 N 4.34 0.75 0.00 6.18 0.00 0.13 -4.78 105.19 111.81 2g94 n GLY 177 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.99 2g94 n GLY 177 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2g94 n GLY 178 N -2.27 1.18 3.12 -0.02 0.00 -1.24 -4.31 105.19 101.65 2g94 n GLY 178 Ca 0.00 -0.83 -0.24 0.00 0.00 0.00 0.00 46.02 44.95 2g94 n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2g94 s ILE 179 N -2.40 1.24 -0.22 -0.61 1.01 -1.26 -4.01 121.20 114.94 2g94 s ILE 179 Ca 0.00 -0.64 -0.02 0.00 0.00 0.00 0.00 60.65 59.99 2g94 s ILE 179 Cb 0.00 -1.05 0.01 0.00 0.01 0.00 0.00 42.46 41.43 2g94 s ILE 179 CO 0.00 0.36 -0.09 -0.62 0.00 0.00 0.00 174.94 174.58 2g94 s ASP 180 N -0.14 3.97 0.23 3.58 2.15 -1.26 -1.34 116.67 123.86 2g94 s ASP 180 Ca 0.01 -0.65 0.19 0.00 0.43 0.00 0.00 52.55 52.53 2g94 s ASP 180 Cb -0.08 -1.64 0.91 0.00 -0.30 0.00 0.00 42.92 41.81 2g94 s ASP 180 CO 0.01 -0.05 1.59 1.41 -0.17 0.00 0.00 175.17 177.95 2g94 n HIS 181 N 4.70 0.61 0.64 -5.34 8.25 -0.91 -2.35 115.22 120.82 2g94 n HIS 181 Ca -0.18 0.27 0.13 0.00 -0.26 0.00 0.00 57.72 57.68 2g94 n HIS 181 Cb 0.49 -0.94 0.45 0.00 1.12 0.00 0.00 29.99 31.11 2g94 n HIS 181 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2g94 n SER 182 N -2.09 0.65 -0.03 0.41 3.41 -1.26 -3.48 113.62 111.23 2g94 n SER 182 Ca 0.01 0.58 0.13 0.00 -0.26 0.00 0.00 58.87 59.33 2g94 n SER 182 Cb 0.12 -0.75 0.47 0.00 -0.26 0.00 0.00 64.21 63.80 2g94 n SER 182 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2g94 n LEU 183 N -2.12 0.32 -4.10 1.04 4.77 -0.99 -4.80 117.00 111.13 2g94 n LEU 183 Ca 0.05 0.18 -0.11 0.00 -0.03 0.00 0.00 56.01 56.10 2g94 n LEU 183 Cb 0.38 -0.32 -0.08 0.00 -2.33 0.00 0.00 43.42 41.07 2g94 n LEU 183 CO 0.28 0.07 -0.05 -0.72 -1.33 0.00 0.00 177.39 175.64 2g94 s TYR 184 N -2.86 0.76 0.18 -1.77 1.13 -1.23 -1.02 117.35 112.55 2g94 s TYR 184 Ca 0.17 -1.06 0.06 0.00 -1.41 0.00 0.00 57.07 54.83 2g94 s TYR 184 Cb 0.19 -0.21 -0.05 0.00 -1.10 0.00 0.00 41.96 40.79 2g94 s TYR 184 CO 0.58 -0.79 -0.11 0.95 -2.51 0.00 0.00 175.55 173.67 2g94 s THR 185 N -4.08 1.43 0.00 -3.49 -4.23 -0.77 -4.78 115.64 99.71 2g94 s THR 185 Ca 0.30 -2.13 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 2g94 s THR 185 Cb 0.04 -1.98 0.00 0.00 1.34 0.00 0.00 72.50 71.90 2g94 s THR 185 CO 0.09 -0.65 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 2g94 n GLY 186 N -0.30 -0.91 3.90 3.99 0.00 -1.26 -3.61 105.19 107.00 2g94 n GLY 186 Ca -0.09 -1.16 -0.21 0.00 0.00 0.00 0.00 46.02 44.56 2g94 n GLY 186 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2g94 s SER 187 N -4.00 5.71 -0.08 1.61 1.04 -1.26 -4.94 113.70 111.78 2g94 s SER 187 Ca 0.00 -0.25 -0.19 0.00 0.48 0.00 0.00 55.95 55.99 2g94 s SER 187 Cb 0.00 -1.32 -0.04 0.00 0.10 0.00 0.00 66.02 64.76 2g94 s SER 187 CO 0.00 -0.24 0.51 -0.76 0.98 0.00 0.00 173.24 173.74 2g94 s LEU 188 N -4.00 4.32 -0.08 2.42 1.43 -1.26 -4.49 118.68 117.03 2g94 s LEU 188 Ca 0.38 0.93 0.03 0.00 -1.03 0.00 0.00 54.13 54.44 2g94 s LEU 188 Cb -0.08 -2.76 -0.02 0.00 0.03 0.00 0.00 46.19 43.36 2g94 s LEU 188 CO 0.28 0.04 -0.16 0.26 0.23 0.00 0.00 176.35 177.00 2g94 s TRP 189 N 0.33 2.70 -0.02 0.29 0.52 -0.12 -4.89 118.94 117.74 2g94 s TRP 189 Ca 0.28 -0.42 0.02 0.00 0.02 0.00 0.00 56.10 56.00 2g94 s TRP 189 Cb -0.16 -1.70 -0.03 0.00 -1.15 0.00 0.00 33.47 30.43 2g94 s TRP 189 CO 0.13 -0.02 -0.06 0.71 0.02 0.00 0.00 176.95 177.73 2g94 s TYR 190 N -0.25 2.93 0.03 -1.98 1.51 -1.26 -0.60 117.35 117.72 2g94 s TYR 190 Ca 0.01 0.00 0.08 0.00 -1.01 0.00 0.00 57.07 56.15 2g94 s TYR 190 Cb -0.13 -1.65 -0.02 0.00 -0.11 0.00 0.00 41.96 40.04 2g94 s TYR 190 CO 0.03 0.37 -0.24 -0.08 -1.11 0.00 0.00 175.55 174.53 2g94 s THR 191 N -0.95 1.90 0.38 -0.71 -1.32 -0.36 -3.41 115.64 111.17 2g94 s THR 191 Ca 0.16 -1.22 -0.27 0.00 -1.21 0.00 0.00 61.69 59.15 2g94 s THR 191 Cb -0.11 -1.62 -0.09 0.00 -1.51 0.00 0.00 72.50 69.16 2g94 s THR 191 CO 0.06 0.35 1.26 -2.84 -2.21 0.00 0.00 174.62 171.24 2g94 s PRO 192 N -1.04 4.13 -0.40 7.08 0.02 -1.26 -0.49 135.00 143.04 2g94 s PRO 192 Ca 0.10 2.08 -0.27 0.00 0.02 0.00 0.00 61.00 62.92 2g94 s PRO 192 Cb -0.09 -2.85 0.02 0.00 0.02 0.00 0.00 34.50 31.60 2g94 s PRO 192 CO 0.01 -0.33 1.00 0.42 -0.33 0.00 0.00 177.00 177.78 2g94 s ILE 193 N -1.26 4.45 0.18 2.83 1.01 -0.64 -4.59 121.20 123.18 2g94 s ILE 193 Ca 0.54 1.21 -0.13 0.00 0.00 0.00 0.00 60.65 62.27 2g94 s ILE 193 Cb -0.36 -4.44 0.08 0.00 0.01 0.00 0.00 42.46 37.75 2g94 s ILE 193 CO 0.47 -0.70 1.76 -0.09 0.00 0.00 0.00 174.94 176.38 2g94 h ARG 194 N 8.71 0.37 -2.71 2.79 2.43 -1.45 -3.44 114.38 121.08 2g94 h ARG 194 Ca -0.23 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 58.81 2g94 h ARG 194 Cb 1.07 -0.08 -0.21 0.00 -0.42 0.00 0.00 29.97 30.32 2g94 h ARG 194 CO 1.04 0.25 -0.17 0.50 -1.51 0.00 0.00 179.97 180.08 2g94 s ARG 195 N -6.13 0.67 -1.09 0.20 3.52 -1.26 -5.09 118.95 109.77 2g94 s ARG 195 Ca -0.13 0.21 -0.16 0.00 -0.13 0.00 0.00 55.73 55.52 2g94 s ARG 195 Cb 0.14 0.31 0.15 0.00 -1.56 0.00 0.00 34.95 33.99 2g94 s ARG 195 CO 0.73 -0.16 1.31 -1.21 -0.81 0.00 0.00 175.30 175.16 2g94 s GLU 196 N -0.67 3.87 0.00 5.12 2.02 -1.26 -4.09 118.70 123.69 2g94 s GLU 196 Ca -0.08 -2.19 0.00 0.00 0.02 0.00 0.00 54.97 52.72 2g94 s GLU 196 Cb -0.04 -5.02 0.00 0.00 0.10 0.00 0.00 34.13 29.18 2g94 s GLU 196 CO 0.04 -1.79 0.00 -2.67 0.02 0.00 0.00 175.26 170.86 2g94 n TRP 197 N 6.16 0.00 -2.24 1.61 4.27 -1.26 -4.61 117.44 121.36 2g94 n TRP 197 Ca 0.31 0.00 -0.27 0.00 -3.89 0.00 0.00 57.50 53.66 2g94 n TRP 197 Cb 0.46 0.00 0.14 0.00 -1.36 0.00 0.00 31.31 30.55 2g94 n TRP 197 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 2g94 s TYR 198 N 0.00 1.68 -1.18 -2.67 2.02 -1.26 -1.58 117.35 114.35 2g94 s TYR 198 Ca 0.00 0.06 -0.16 0.00 -0.37 0.00 0.00 57.07 56.60 2g94 s TYR 198 Cb 0.00 -3.55 0.14 0.00 -0.40 0.00 0.00 41.96 38.15 2g94 s TYR 198 CO 0.00 -2.14 1.46 0.71 -1.57 0.00 0.00 175.55 174.00 2g94 s TYR 199 N -3.51 3.27 0.06 2.71 1.51 -1.26 -4.83 117.35 115.30 2g94 s TYR 199 Ca 0.70 -1.89 -0.25 0.00 -1.01 0.00 0.00 57.07 54.62 2g94 s TYR 199 Cb -0.05 -4.41 -0.06 0.00 -0.11 0.00 0.00 41.96 37.33 2g94 s TYR 199 CO 0.49 -1.51 0.76 -2.00 -1.11 0.00 0.00 175.55 172.17 2g94 s GLU 200 N 2.38 4.50 0.40 -0.62 2.12 -1.26 -1.90 118.70 124.31 2g94 s GLU 200 Ca 0.44 1.07 0.04 0.00 0.36 0.00 0.00 54.97 56.87 2g94 s GLU 200 Cb -0.02 -3.34 -0.03 0.00 0.26 0.00 0.00 34.13 31.00 2g94 s GLU 200 CO 0.00 0.34 0.12 0.14 -0.54 0.00 0.00 175.26 175.31 2g94 s VAL 201 N -0.26 0.69 -0.15 3.70 -7.23 -0.01 -1.12 120.40 116.03 2g94 s VAL 201 Ca 0.38 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.55 2g94 s VAL 201 Cb -0.21 -2.41 0.02 0.00 0.56 0.00 0.00 36.38 34.35 2g94 s VAL 201 CO 0.23 0.00 -0.14 -0.63 -0.31 0.00 0.00 175.10 174.25 2g94 s ILE 202 N -3.22 1.60 -0.13 -0.62 1.01 -1.26 -4.17 121.20 114.40 2g94 s ILE 202 Ca 0.25 -0.67 -0.19 0.00 0.00 0.00 0.00 60.65 60.04 2g94 s ILE 202 Cb 0.03 -1.51 -0.04 0.00 0.01 0.00 0.00 42.46 40.96 2g94 s ILE 202 CO 0.14 0.45 0.53 -0.63 0.00 0.00 0.00 174.94 175.44 2g94 s ILE 203 N 1.47 5.14 -0.52 2.92 1.01 -1.26 -2.29 121.20 127.66 2g94 s ILE 203 Ca 0.05 1.05 0.12 0.00 0.00 0.00 0.00 60.65 61.87 2g94 s ILE 203 Cb -0.13 -3.87 -0.14 0.00 0.01 0.00 0.00 42.46 38.33 2g94 s ILE 203 CO -0.11 0.26 0.50 1.33 0.00 0.00 0.00 174.94 176.93 2g94 n VAL 204 N 3.96 0.00 -3.61 2.92 0.24 -0.07 -4.72 118.33 117.04 2g94 n VAL 204 Ca -0.05 -0.22 -0.10 0.00 -2.04 0.00 0.00 64.34 61.93 2g94 n VAL 204 Cb 0.51 0.91 -0.06 0.00 -1.47 0.00 0.00 33.84 33.73 2g94 n VAL 204 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2g94 s ARG 205 N -2.26 0.55 -0.03 7.34 3.52 -1.24 -4.81 118.95 122.01 2g94 s ARG 205 Ca 0.04 0.37 0.03 0.00 -0.13 0.00 0.00 55.73 56.04 2g94 s ARG 205 Cb 0.09 0.26 0.00 0.00 -1.56 0.00 0.00 34.95 33.75 2g94 s ARG 205 CO 0.52 -0.12 -0.11 0.08 -0.81 0.00 0.00 175.30 174.86 2g94 s VAL 206 N -0.43 0.91 0.06 7.11 1.01 -1.26 -0.54 120.40 127.25 2g94 s VAL 206 Ca 0.01 -0.43 0.06 0.00 0.00 0.00 0.00 61.98 61.62 2g94 s VAL 206 Cb -0.03 -0.80 -0.03 0.00 0.00 0.00 0.00 36.38 35.53 2g94 s VAL 206 CO -0.02 0.28 -0.17 -1.61 0.00 0.00 0.00 175.10 173.57 2g94 s GLU 207 N 0.18 1.09 -0.25 2.72 2.02 -0.34 -1.27 118.70 122.85 2g94 s GLU 207 Ca -0.04 -0.91 0.03 0.00 0.02 0.00 0.00 54.97 54.07 2g94 s GLU 207 Cb -0.09 -1.18 0.06 0.00 0.10 0.00 0.00 34.13 33.01 2g94 s GLU 207 CO 0.01 0.29 -0.11 0.42 0.02 0.00 0.00 175.26 175.88 2g94 s ILE 208 N -0.94 2.18 -1.40 -1.63 -1.09 -0.49 -1.17 121.20 116.65 2g94 s ILE 208 Ca 0.04 -1.58 -0.04 0.00 -2.23 0.00 0.00 60.65 56.84 2g94 s ILE 208 Cb -0.09 -2.26 0.02 0.00 -1.58 0.00 0.00 42.46 38.56 2g94 s ILE 208 CO 0.02 0.01 0.69 0.59 -1.23 0.00 0.00 174.94 175.02 2g94 n ASN 209 N 4.45 -1.75 0.00 3.58 5.03 0.00 -1.30 115.26 125.27 2g94 n ASN 209 Ca -0.14 -0.87 0.00 0.00 0.87 0.00 0.00 54.58 54.44 2g94 n ASN 209 Cb 0.43 -3.70 0.00 0.00 -1.02 0.00 0.00 39.78 35.48 2g94 n ASN 209 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2g94 n GLY 210 N -1.69 2.27 3.63 7.41 0.00 -1.26 -4.98 105.19 110.56 2g94 n GLY 210 Ca -0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.41 2g94 n GLY 210 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2g94 s GLN 211 N -0.02 4.11 0.15 1.61 0.74 -0.42 -4.98 119.66 120.85 2g94 s GLN 211 Ca 0.00 0.34 -0.31 0.00 0.05 0.00 0.00 55.36 55.44 2g94 s GLN 211 Cb 0.00 -3.62 -0.10 0.00 1.10 0.00 0.00 33.01 30.39 2g94 s GLN 211 CO 0.00 -0.27 1.72 0.34 -0.55 0.00 0.00 175.29 176.53 2g94 s ASP 212 N 1.40 6.47 0.53 6.67 2.15 -1.26 -1.40 116.67 131.23 2g94 s ASP 212 Ca 0.22 2.72 0.30 0.00 0.43 0.00 0.00 52.55 56.21 2g94 s ASP 212 Cb -0.15 -2.58 1.45 0.00 -0.30 0.00 0.00 42.92 41.33 2g94 s ASP 212 CO 0.09 -0.94 2.05 0.25 -0.17 0.00 0.00 175.17 176.45 2g94 h LEU 213 N 7.75 0.00 -1.97 -1.34 5.85 -1.56 -3.47 115.31 120.57 2g94 h LEU 213 Ca -0.44 0.00 -0.44 0.00 0.84 0.00 0.00 57.88 57.84 2g94 h LEU 213 Cb 1.21 0.00 0.03 0.00 0.37 0.00 0.00 40.66 42.27 2g94 h LEU 213 CO 0.94 0.11 -0.86 1.17 -0.34 0.00 0.00 178.44 179.46 2g94 n LYS 214 N -3.44 -4.01 -3.93 1.25 4.81 -1.26 -5.01 118.16 106.58 2g94 n LYS 214 Ca -0.01 0.54 -0.22 0.00 -0.87 0.00 0.00 58.31 57.76 2g94 n LYS 214 Cb 0.27 -4.89 -0.04 0.00 0.02 0.00 0.00 35.03 30.38 2g94 n LYS 214 CO 0.00 0.00 0.00 -1.64 1.17 0.00 0.00 177.40 176.93 2g94 s MET 215 N -6.12 2.72 0.12 1.64 -1.94 -1.26 -5.04 119.30 109.42 2g94 s MET 215 Ca 0.05 -1.27 -0.31 0.00 -1.71 0.00 0.00 55.69 52.45 2g94 s MET 215 Cb -0.02 -2.46 -0.10 0.00 2.01 0.00 0.00 34.83 34.27 2g94 s MET 215 CO 0.84 0.18 1.74 0.34 -0.01 0.00 0.00 175.02 178.10 2g94 s ASP 216 N -3.93 6.48 0.64 3.03 3.68 -1.26 -4.83 116.67 120.48 2g94 s ASP 216 Ca 0.38 2.68 0.39 0.00 2.13 0.00 0.00 52.55 58.13 2g94 s ASP 216 Cb -0.06 -2.57 2.12 0.00 -1.45 0.00 0.00 42.92 40.95 2g94 s ASP 216 CO 0.26 -0.95 2.19 0.00 0.13 0.00 0.00 175.17 176.80 2g94 h LYS 218 N 0.00 0.00 -0.14 0.00 1.57 -1.81 -1.85 116.57 114.34 2g94 h LYS 218 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2g94 h LYS 218 Cb 0.20 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.50 2g94 h LYS 218 CO 0.00 0.19 0.08 0.93 -0.57 0.00 0.00 179.45 180.08 2g94 h GLU 219 N 0.00 0.19 0.00 3.15 4.39 -1.40 0.16 114.58 121.06 2g94 h GLU 219 Ca -0.00 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.65 2g94 h GLU 219 Cb 0.35 -0.04 -0.00 0.00 -0.10 0.00 0.00 28.75 28.95 2g94 h GLU 219 CO 0.03 0.14 -0.15 1.88 -1.16 0.00 0.00 179.01 179.74 2g94 h TYR 220 N 0.19 0.00 0.00 4.33 0.99 -1.48 -2.93 116.97 118.07 2g94 h TYR 220 Ca 0.05 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.77 2g94 h TYR 220 Cb 0.00 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 37.72 2g94 h TYR 220 CO 0.00 0.15 -0.20 0.09 -0.00 0.00 0.00 178.16 178.21 2g94 n ASN 221 N -3.31 1.83 -4.55 3.88 3.02 -0.65 -4.47 115.26 111.01 2g94 n ASN 221 Ca 0.00 -3.01 -0.42 0.00 -0.03 0.00 0.00 54.58 51.13 2g94 n ASN 221 Cb 0.39 -0.41 -0.04 0.00 -0.61 0.00 0.00 39.78 39.12 2g94 n ASN 221 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2g94 n TYR 222 N -1.09 1.66 0.00 3.10 9.36 0.45 -0.25 117.16 130.39 2g94 n TYR 222 Ca 0.14 0.04 0.00 0.00 3.32 0.00 0.00 57.90 61.40 2g94 n TYR 222 Cb 0.68 -2.65 0.00 0.00 -0.63 0.00 0.00 39.34 36.73 2g94 n TYR 222 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 2g94 n ASP 223 N 12.93 0.00 -3.62 2.98 -0.08 -1.26 -3.67 116.55 123.83 2g94 n ASP 223 Ca 0.36 0.00 0.01 0.00 -1.51 0.00 0.00 54.79 53.64 2g94 n ASP 223 Cb 0.43 0.00 -0.01 0.00 2.34 0.00 0.00 41.12 43.89 2g94 n ASP 223 CO 0.00 0.00 0.00 -1.59 0.12 0.00 0.00 177.20 175.73 2g94 s LYS 224 N 0.00 0.39 -0.08 -0.67 -2.85 0.66 -4.75 119.74 112.44 2g94 s LYS 224 Ca 0.00 -0.21 -0.00 0.00 -1.00 0.00 0.00 55.97 54.76 2g94 s LYS 224 Cb 0.00 0.14 0.02 0.00 -2.06 0.00 0.00 37.83 35.93 2g94 s LYS 224 CO 0.00 -0.18 -0.05 -1.12 0.10 0.00 0.00 175.35 174.10 2g94 s SER 225 N -2.86 1.65 0.21 0.03 0.01 -1.26 -0.17 113.70 111.30 2g94 s SER 225 Ca 0.13 -0.19 0.07 0.00 1.31 0.00 0.00 55.95 57.27 2g94 s SER 225 Cb 0.04 -0.62 -0.05 0.00 0.21 0.00 0.00 66.02 65.60 2g94 s SER 225 CO -0.04 -0.11 -0.12 0.27 0.41 0.00 0.00 173.24 173.66 2g94 s ILE 226 N 1.48 1.60 -0.25 1.44 -4.36 -0.61 -0.83 121.20 119.67 2g94 s ILE 226 Ca -0.01 -2.17 -0.08 0.00 -0.26 0.00 0.00 60.65 58.13 2g94 s ILE 226 Cb -0.13 -2.10 -0.03 0.00 1.25 0.00 0.00 42.46 41.45 2g94 s ILE 226 CO -0.04 -0.56 0.09 -0.69 0.24 0.00 0.00 174.94 173.99 2g94 s VAL 227 N -3.06 4.50 -0.23 8.37 1.01 -0.80 -0.75 120.40 129.44 2g94 s VAL 227 Ca 0.23 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.08 2g94 s VAL 227 Cb 0.01 -3.11 0.07 0.00 0.00 0.00 0.00 36.38 33.35 2g94 s VAL 227 CO 0.07 0.32 0.06 -0.62 0.00 0.00 0.00 175.10 174.93 2g94 s ASP 228 N 1.62 3.24 0.00 3.32 2.15 -0.37 -4.40 116.67 122.23 2g94 s ASP 228 Ca 0.06 -1.06 0.16 0.00 0.43 0.00 0.00 52.55 52.14 2g94 s ASP 228 Cb -0.15 -0.63 0.78 0.00 -0.30 0.00 0.00 42.92 42.61 2g94 s ASP 228 CO 0.05 -0.35 1.45 -1.54 -0.17 0.00 0.00 175.17 174.61 2g94 n SER 229 N 5.02 0.00 -1.27 -0.34 3.41 -1.26 -2.56 113.62 116.62 2g94 n SER 229 Ca -0.07 0.11 0.12 0.00 -0.26 0.00 0.00 58.87 58.77 2g94 n SER 229 Cb 0.45 -0.31 0.28 0.00 -0.26 0.00 0.00 64.21 64.37 2g94 n SER 229 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2g94 n GLY 230 N 0.05 2.18 3.30 5.00 0.00 -1.26 -4.74 105.19 109.72 2g94 n GLY 230 Ca 0.07 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 45.00 2g94 n GLY 230 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g94 s THR 231 N -1.20 2.21 -0.10 2.61 2.01 -1.06 -5.06 115.64 115.05 2g94 s THR 231 Ca 0.45 -1.02 -0.27 0.00 0.31 0.00 0.00 61.69 61.16 2g94 s THR 231 Cb 0.24 -1.81 -0.25 0.00 0.01 0.00 0.00 72.50 70.70 2g94 s THR 231 CO 0.33 0.57 0.91 0.74 -0.69 0.00 0.00 174.62 176.48 2g94 h THR 232 N 4.94 1.67 -3.98 -0.82 2.02 -1.89 0.19 112.91 115.04 2g94 h THR 232 Ca -0.34 -2.06 -0.46 0.00 0.77 0.00 0.00 66.41 64.31 2g94 h THR 232 Cb 1.17 3.05 0.08 0.00 -1.74 0.00 0.00 68.15 70.71 2g94 h THR 232 CO 0.48 0.54 0.27 0.20 0.37 0.00 0.00 175.52 177.38 2g94 s ASN 233 N -6.17 4.80 -0.35 4.18 -0.87 -1.26 -1.71 114.94 113.56 2g94 s ASN 233 Ca -0.18 0.57 -0.19 0.00 -1.57 0.00 0.00 52.86 51.49 2g94 s ASN 233 Cb -0.01 -1.20 -0.00 0.00 -0.02 0.00 0.00 41.25 40.01 2g94 s ASN 233 CO 0.70 -1.64 0.57 -0.22 -2.57 0.00 0.00 177.10 173.94 2g94 s LEU 234 N -5.31 4.29 -0.13 0.60 0.20 -0.69 -2.66 118.68 114.97 2g94 s LEU 234 Ca 0.60 0.09 -0.04 0.00 0.69 0.00 0.00 54.13 55.47 2g94 s LEU 234 Cb -0.11 -2.68 -0.03 0.00 -0.43 0.00 0.00 46.19 42.94 2g94 s LEU 234 CO 0.46 -0.52 0.01 -0.13 -0.29 0.00 0.00 176.35 175.88 2g94 s ARG 235 N 2.52 3.48 0.09 1.98 0.52 -0.19 -1.91 118.95 125.44 2g94 s ARG 235 Ca 0.21 -0.42 0.09 0.00 -0.52 0.00 0.00 55.73 55.09 2g94 s ARG 235 Cb -0.15 -2.95 -0.03 0.00 0.52 0.00 0.00 34.95 32.33 2g94 s ARG 235 CO 0.14 0.44 -0.22 -0.51 0.02 0.00 0.00 175.30 175.17 2g94 s LEU 236 N -0.16 2.26 0.41 2.53 1.43 0.13 -0.35 118.68 124.93 2g94 s LEU 236 Ca 0.05 -0.65 -0.26 0.00 -1.03 0.00 0.00 54.13 52.25 2g94 s LEU 236 Cb -0.12 -1.00 -0.10 0.00 0.03 0.00 0.00 46.19 44.99 2g94 s LEU 236 CO 0.02 0.12 1.25 -2.65 0.23 0.00 0.00 176.35 175.32 2g94 n PRO 237 N 1.31 1.90 -0.29 1.29 -0.02 -1.26 0.15 135.00 138.08 2g94 n PRO 237 Ca -0.18 0.68 -0.03 0.00 -2.02 0.00 0.00 63.50 61.94 2g94 n PRO 237 Cb 0.53 -2.35 -0.01 0.00 -0.02 0.00 0.00 33.50 31.66 2g94 n PRO 237 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2g94 n LYS 238 N 0.11 -0.22 -0.29 -0.52 4.81 -1.09 -0.44 118.16 120.52 2g94 n LYS 238 Ca 0.07 1.12 -0.04 0.00 -0.87 0.00 0.00 58.31 58.58 2g94 n LYS 238 Cb 0.39 -1.66 0.07 0.00 0.02 0.00 0.00 35.03 33.85 2g94 n LYS 238 CO 0.00 0.00 0.00 0.87 1.17 0.00 0.00 177.40 179.44 2g94 h LYS 239 N 0.00 1.05 -0.29 1.64 1.57 -1.92 -1.51 116.57 117.10 2g94 h LYS 239 Ca 0.21 -0.08 -0.15 0.00 -1.87 0.00 0.00 60.65 58.76 2g94 h LYS 239 Cb 0.39 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 32.47 2g94 h LYS 239 CO -0.71 0.71 -0.40 0.28 -0.57 0.00 0.00 179.45 178.76 2g94 h VAL 240 N 1.07 1.29 -0.36 0.50 2.07 -1.19 -2.58 116.25 117.05 2g94 h VAL 240 Ca 0.28 -1.59 0.04 0.00 0.82 0.00 0.00 66.70 66.26 2g94 h VAL 240 Cb -0.09 1.60 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 2g94 h VAL 240 CO -0.06 0.51 0.12 0.15 0.02 0.00 0.00 177.57 178.32 2g94 h PHE 241 N 0.55 0.21 -0.46 1.57 3.57 -0.51 0.13 116.94 122.01 2g94 h PHE 241 Ca 0.03 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2g94 h PHE 241 Cb 1.00 -0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.67 2g94 h PHE 241 CO 0.07 0.08 0.24 0.93 -2.23 0.00 0.00 178.31 177.41 2g94 h GLU 242 N 0.27 0.64 -0.69 1.11 4.39 -1.25 0.24 114.58 119.29 2g94 h GLU 242 Ca 0.17 -0.08 -0.07 0.00 0.34 0.00 0.00 59.36 59.72 2g94 h GLU 242 Cb 0.15 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 2g94 h GLU 242 CO -0.18 0.52 0.16 0.00 -1.16 0.00 0.00 179.01 178.35 2g94 h ALA 243 N 1.09 0.91 -0.17 3.43 0.00 -1.08 -1.68 119.26 121.76 2g94 h ALA 243 Ca 0.16 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2g94 h ALA 243 Cb 0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2g94 h ALA 243 CO -0.02 0.64 -0.01 0.00 0.00 0.00 0.00 179.25 179.85 2g94 h ALA 244 N 1.08 0.23 -0.60 0.00 0.00 -0.46 -2.36 119.26 117.16 2g94 h ALA 244 Ca 0.22 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2g94 h ALA 244 Cb 0.38 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 2g94 h ALA 244 CO 0.00 -0.04 0.23 0.28 0.00 0.00 0.00 179.25 179.72 2g94 h VAL 245 N 0.05 1.22 -0.26 0.00 2.07 -0.88 0.15 116.25 118.59 2g94 h VAL 245 Ca 0.05 -0.68 -0.00 0.00 0.82 0.00 0.00 66.70 66.88 2g94 h VAL 245 Cb 0.41 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 2g94 h VAL 245 CO 0.01 0.27 0.15 0.50 0.02 0.00 0.00 177.57 178.53 2g94 h LYS 246 N 0.86 0.35 -0.50 1.57 3.64 -1.21 0.44 116.57 121.72 2g94 h LYS 246 Ca 0.20 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.46 2g94 h LYS 246 Cb 0.18 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 2g94 h LYS 246 CO -0.02 0.28 -0.03 1.03 -2.27 0.00 0.00 179.45 178.45 2g94 h SER 247 N 0.32 0.89 -0.59 4.20 0.87 -0.93 -1.71 113.55 116.60 2g94 h SER 247 Ca 0.09 -0.32 -0.09 0.00 -1.23 0.00 0.00 61.79 60.25 2g94 h SER 247 Cb 0.02 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.72 2g94 h SER 247 CO -0.02 1.00 0.05 0.40 -0.53 0.00 0.00 176.83 177.73 2g94 h ILE 248 N 0.76 1.26 -0.68 2.23 2.04 -0.52 -1.51 117.51 121.09 2g94 h ILE 248 Ca 0.14 -1.08 -0.03 0.00 1.00 0.00 0.00 64.86 64.89 2g94 h ILE 248 Cb 0.56 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 2g94 h ILE 248 CO 0.03 0.40 0.33 0.11 0.00 0.00 0.00 178.15 179.01 2g94 h LYS 249 N 0.96 0.98 -0.62 2.37 1.57 -0.76 -2.01 116.57 119.06 2g94 h LYS 249 Ca 0.18 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2g94 h LYS 249 Cb 0.49 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 2g94 h LYS 249 CO 0.02 0.78 0.32 0.00 -0.57 0.00 0.00 179.45 180.00 2g94 h ALA 250 N 1.15 0.80 0.00 3.86 0.00 -0.96 -0.89 119.26 123.23 2g94 h ALA 250 Ca 0.23 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 2g94 h ALA 250 Cb 0.12 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2g94 h ALA 250 CO -0.03 0.34 -0.32 0.00 0.00 0.00 0.00 179.25 179.24 2g94 h ALA 251 N 1.15 1.16 -0.37 0.00 0.00 -1.08 -3.04 119.26 117.07 2g94 h ALA 251 Ca 0.22 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2g94 h ALA 251 Cb 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2g94 h ALA 251 CO -0.03 0.40 0.00 -1.13 0.00 0.00 0.00 179.25 178.49 2g94 n SER 252 N -3.71 3.98 0.05 0.00 3.41 -0.77 -4.73 113.62 111.85 2g94 n SER 252 Ca -0.01 -2.68 0.03 0.00 -0.26 0.00 0.00 58.87 55.95 2g94 n SER 252 Cb 0.42 -0.49 0.16 0.00 -0.26 0.00 0.00 64.21 64.04 2g94 n SER 252 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2g94 n SER 253 N 0.11 0.15 0.00 4.04 3.41 -0.37 -1.92 113.62 119.04 2g94 n SER 253 Ca 0.20 0.55 0.05 0.00 -0.26 0.00 0.00 58.87 59.42 2g94 n SER 253 Cb 0.81 -0.57 0.23 0.00 -0.26 0.00 0.00 64.21 64.43 2g94 n SER 253 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2g94 n THR 254 N -1.69 1.21 -4.09 6.66 -2.24 -1.26 -4.51 114.28 108.35 2g94 n THR 254 Ca -0.00 0.30 -0.15 0.00 -2.27 0.00 0.00 64.05 61.93 2g94 n THR 254 Cb 0.03 -1.12 -0.14 0.00 -2.10 0.00 0.00 70.33 67.00 2g94 n THR 254 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2g94 s GLU 255 N -2.95 0.34 -0.14 -0.78 2.02 -0.81 -5.15 118.70 111.24 2g94 s GLU 255 Ca 0.06 -0.13 -0.03 0.00 0.02 0.00 0.00 54.97 54.88 2g94 s GLU 255 Cb 0.07 -0.34 -0.03 0.00 0.10 0.00 0.00 34.13 33.93 2g94 s GLU 255 CO 0.19 0.07 -0.02 0.15 0.02 0.00 0.00 175.26 175.67 2g94 s LYS 256 N -0.01 3.48 0.07 1.61 -0.14 -1.26 -4.95 119.74 118.53 2g94 s LYS 256 Ca 0.01 -0.48 0.09 0.00 -1.36 0.00 0.00 55.97 54.23 2g94 s LYS 256 Cb -0.03 -2.89 -0.03 0.00 -1.68 0.00 0.00 37.83 33.20 2g94 s LYS 256 CO -0.00 0.38 -0.25 -0.06 -0.76 0.00 0.00 175.35 174.66 2g94 s PHE 257 N -0.02 2.20 0.70 3.18 0.40 -1.26 -5.13 117.98 118.05 2g94 s PHE 257 Ca 0.02 -0.40 -0.16 0.00 -0.60 0.00 0.00 56.93 55.79 2g94 s PHE 257 Cb -0.13 -1.27 0.02 0.00 0.51 0.00 0.00 43.02 42.15 2g94 s PHE 257 CO 0.02 0.18 1.22 -1.25 0.70 0.00 0.00 175.22 176.10 2g94 s PRO 258 N -1.49 2.30 0.33 0.24 0.04 -1.26 -4.89 135.00 130.27 2g94 s PRO 258 Ca 0.11 1.83 0.07 0.00 0.04 0.00 0.00 61.00 63.05 2g94 s PRO 258 Cb -0.10 -1.84 0.76 0.00 0.04 0.00 0.00 34.50 33.36 2g94 s PRO 258 CO 0.03 -1.73 1.83 -0.44 0.04 0.00 0.00 177.00 176.73 2g94 h ASP 259 N -0.01 0.74 -0.73 6.66 3.32 -2.00 0.81 116.42 125.21 2g94 h ASP 259 Ca -0.49 0.06 0.13 0.00 0.02 0.00 0.00 57.03 56.76 2g94 h ASP 259 Cb 1.30 -0.08 -0.05 0.00 0.22 0.00 0.00 39.33 40.73 2g94 h ASP 259 CO 0.51 0.33 0.48 1.23 -1.72 0.00 0.00 179.24 180.08 2g94 h GLY 260 N 0.76 0.71 0.77 2.75 0.00 -1.95 -0.59 103.07 105.52 2g94 h GLY 260 Ca 0.51 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.65 2g94 h GLY 260 CO -0.27 0.08 -0.01 -2.75 0.00 0.00 0.00 176.54 173.58 2g94 h PHE 261 N 0.44 -0.03 0.00 5.60 3.57 -1.01 -1.88 116.94 123.63 2g94 h PHE 261 Ca 0.35 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.85 2g94 h PHE 261 Cb 0.75 0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.51 2g94 h PHE 261 CO -0.00 0.20 0.00 -1.49 -2.23 0.00 0.00 178.31 174.79 2g94 h TRP 262 N -0.27 0.00 -0.01 0.41 4.06 -1.20 -0.07 115.95 118.88 2g94 h TRP 262 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2g94 h TRP 262 Cb 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.41 2g94 h TRP 262 CO 0.00 0.00 -0.01 1.28 -3.56 0.00 0.00 178.44 176.15 2g94 n LEU 263 N -2.76 0.63 -0.09 -4.49 4.77 -0.35 -4.90 117.00 109.82 2g94 n LEU 263 Ca 0.00 -0.19 -0.01 0.00 -0.03 0.00 0.00 56.01 55.78 2g94 n LEU 263 Cb 0.20 -0.03 -0.01 0.00 -2.33 0.00 0.00 43.42 41.26 2g94 n LEU 263 CO 0.22 0.11 -0.01 0.61 -1.33 0.00 0.00 177.39 176.98 2g94 n GLY 264 N 1.11 0.44 0.13 -0.72 0.00 -0.04 -4.91 105.19 101.21 2g94 n GLY 264 Ca 0.21 -0.14 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 2g94 n GLY 264 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2g94 n GLU 265 N -1.96 0.69 -4.29 1.61 1.02 -0.75 -4.72 120.64 112.25 2g94 n GLU 265 Ca -0.01 0.20 -0.26 0.00 -0.02 0.00 0.00 57.16 57.07 2g94 n GLU 265 Cb 0.16 -1.60 -0.09 0.00 -0.02 0.00 0.00 31.44 29.90 2g94 n GLU 265 CO 0.00 0.00 0.00 1.14 1.18 0.00 0.00 177.13 179.45 2g94 s GLN 266 N -2.53 2.11 0.53 3.49 -2.07 -0.95 -5.00 119.66 115.24 2g94 s GLN 266 Ca -0.30 -1.27 -0.05 0.00 -1.82 0.00 0.00 55.36 51.91 2g94 s GLN 266 Cb 0.08 -2.17 -0.01 0.00 -1.09 0.00 0.00 33.01 29.82 2g94 s GLN 266 CO 0.66 0.43 0.83 -0.48 -1.32 0.00 0.00 175.29 175.41 2g94 s LEU 267 N -2.93 3.43 -0.04 2.60 2.34 -1.26 -4.23 118.68 118.60 2g94 s LEU 267 Ca 0.26 0.77 0.05 0.00 0.06 0.00 0.00 54.13 55.27 2g94 s LEU 267 Cb -0.09 -3.65 -0.01 0.00 -0.56 0.00 0.00 46.19 41.88 2g94 s LEU 267 CO 0.16 -0.83 -0.18 -0.69 -1.06 0.00 0.00 176.35 173.75 2g94 s VAL 268 N -2.85 1.50 0.10 1.48 1.01 -0.70 -4.93 120.40 116.01 2g94 s VAL 268 Ca 0.51 -0.78 0.07 0.00 0.00 0.00 0.00 61.98 61.78 2g94 s VAL 268 Cb -0.10 -1.27 -0.03 0.00 0.00 0.00 0.00 36.38 34.97 2g94 s VAL 268 CO 0.44 0.43 -0.18 0.00 0.00 0.00 0.00 175.10 175.79 2g94 s TRP 270 N -1.30 1.20 0.45 0.00 0.51 -0.43 -4.98 118.94 114.39 2g94 s TRP 270 Ca 0.05 -0.70 -0.25 0.00 -2.12 0.00 0.00 56.10 53.08 2g94 s TRP 270 Cb -0.09 -0.63 -0.09 0.00 -0.81 0.00 0.00 33.47 31.85 2g94 s TRP 270 CO 0.04 0.05 1.25 1.04 -0.51 0.00 0.00 176.95 178.82 2g94 n GLN 271 N 0.17 1.83 -1.66 4.98 6.02 -1.26 -1.19 117.38 126.26 2g94 n GLN 271 Ca -0.13 0.65 -0.63 0.00 -0.01 0.00 0.00 57.00 56.88 2g94 n GLN 271 Cb 0.59 -2.38 -0.09 0.00 1.02 0.00 0.00 30.24 29.38 2g94 n GLN 271 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2g94 n ALA 272 N -0.39 -1.95 -0.19 -1.58 0.00 -1.23 -0.84 120.51 114.32 2g94 n ALA 272 Ca 0.07 0.52 0.00 0.00 0.00 0.00 0.00 53.44 54.04 2g94 n ALA 272 Cb 0.41 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 17.95 2g94 n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g94 n GLY 273 N 3.16 2.41 1.44 0.00 0.00 -1.26 -4.91 105.19 106.03 2g94 n GLY 273 Ca 0.26 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.38 2g94 n GLY 273 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2g94 n THR 274 N -2.00 1.50 -1.67 2.61 -2.24 -0.02 -4.97 114.28 107.49 2g94 n THR 274 Ca 0.00 -1.04 -0.50 0.00 -2.27 0.00 0.00 64.05 60.24 2g94 n THR 274 Cb 0.00 0.17 -0.05 0.00 -2.10 0.00 0.00 70.33 68.35 2g94 n THR 274 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 2g94 n THR 275 N 1.14 0.29 -1.66 4.28 -1.04 -1.26 -4.81 114.28 111.22 2g94 n THR 275 Ca 0.24 -0.05 -0.41 0.00 -2.04 0.00 0.00 64.05 61.79 2g94 n THR 275 Cb 0.77 -1.51 -0.01 0.00 -1.82 0.00 0.00 70.33 67.76 2g94 n THR 275 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2g94 n PRO 276 N 4.96 3.45 -0.28 -2.82 -0.04 -1.26 -4.75 135.00 134.25 2g94 n PRO 276 Ca 0.21 -2.63 0.10 0.00 -0.04 0.00 0.00 63.50 61.14 2g94 n PRO 276 Cb 0.25 -2.99 0.24 0.00 -0.04 0.00 0.00 33.50 30.96 2g94 n PRO 276 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2g94 h TRP 277 N 5.44 0.31 -0.02 0.54 4.06 -1.96 -1.70 115.95 122.62 2g94 h TRP 277 Ca 0.69 0.05 0.01 0.00 2.06 0.00 0.00 58.89 61.69 2g94 h TRP 277 Cb 0.46 -0.01 -0.00 0.00 -1.00 0.00 0.00 29.16 28.61 2g94 h TRP 277 CO 1.62 -0.15 0.08 -2.95 -3.56 0.00 0.00 178.44 173.48 2g94 h ASN 278 N 0.24 0.00 1.74 -3.49 7.08 -2.01 -1.46 115.58 117.69 2g94 h ASN 278 Ca 0.49 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.71 2g94 h ASN 278 Cb 0.93 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.17 2g94 h ASN 278 CO -0.60 0.00 -0.01 0.16 -2.08 0.00 0.00 177.43 174.90 2g94 h ILE 279 N 0.00 0.00 -3.19 6.14 3.07 -1.67 -3.44 117.51 118.42 2g94 h ILE 279 Ca 0.01 -0.76 -0.58 0.00 1.55 0.00 0.00 64.86 65.08 2g94 h ILE 279 Cb 0.18 1.75 -0.05 0.00 -0.27 0.00 0.00 36.82 38.43 2g94 h ILE 279 CO -0.00 0.00 -0.07 -0.36 -1.05 0.00 0.00 178.15 176.66 2g94 s PHE 280 N -3.16 3.78 0.58 0.16 0.08 -0.55 -3.70 117.98 115.18 2g94 s PHE 280 Ca 0.09 1.20 -0.10 0.00 0.12 0.00 0.00 56.93 58.24 2g94 s PHE 280 Cb 0.08 -2.44 -0.04 0.00 -0.57 0.00 0.00 43.02 40.05 2g94 s PHE 280 CO 0.64 0.59 0.97 -1.25 -0.10 0.00 0.00 175.22 176.07 2g94 s PRO 281 N -1.15 3.61 0.51 0.24 0.04 -1.26 -4.80 135.00 132.19 2g94 s PRO 281 Ca 0.28 0.65 -0.10 0.00 0.04 0.00 0.00 61.00 61.87 2g94 s PRO 281 Cb -0.19 -2.15 -0.05 0.00 0.04 0.00 0.00 34.50 32.15 2g94 s PRO 281 CO 0.18 -0.47 0.88 0.14 0.04 0.00 0.00 177.00 177.77 2g94 s VAL 282 N -3.04 4.76 -0.10 -0.36 -7.23 -1.26 -4.32 120.40 108.86 2g94 s VAL 282 Ca 0.54 0.65 0.03 0.00 -1.81 0.00 0.00 61.98 61.39 2g94 s VAL 282 Cb -0.11 -3.81 0.01 0.00 0.56 0.00 0.00 36.38 33.03 2g94 s VAL 282 CO 0.50 -0.83 -0.20 -0.63 -0.31 0.00 0.00 175.10 173.63 2g94 s ILE 283 N -2.76 1.77 -0.12 -0.62 1.01 -0.53 -0.82 121.20 119.13 2g94 s ILE 283 Ca 0.52 -0.84 0.02 0.00 0.00 0.00 0.00 60.65 60.35 2g94 s ILE 283 Cb -0.10 -1.56 -0.00 0.00 0.01 0.00 0.00 42.46 40.81 2g94 s ILE 283 CO 0.42 0.50 -0.20 -0.44 0.00 0.00 0.00 174.94 175.22 2g94 s SER 284 N 0.53 3.37 -0.20 3.58 0.01 -0.32 -0.69 113.70 119.99 2g94 s SER 284 Ca -0.16 -0.50 -0.03 0.00 1.31 0.00 0.00 55.95 56.57 2g94 s SER 284 Cb -0.17 -1.48 -0.01 0.00 0.21 0.00 0.00 66.02 64.57 2g94 s SER 284 CO 0.06 0.14 -0.05 -0.76 0.41 0.00 0.00 173.24 173.04 2g94 s LEU 285 N 0.45 2.92 -0.09 2.44 1.43 0.40 -1.20 118.68 125.03 2g94 s LEU 285 Ca -0.14 -0.34 -0.15 0.00 -1.03 0.00 0.00 54.13 52.46 2g94 s LEU 285 Cb -0.17 -1.73 -0.05 0.00 0.03 0.00 0.00 46.19 44.28 2g94 s LEU 285 CO 0.06 0.04 0.39 -0.31 0.23 0.00 0.00 176.35 176.76 2g94 s TYR 286 N 1.15 3.58 0.11 0.29 1.51 0.30 -0.75 117.35 123.52 2g94 s TYR 286 Ca 0.02 0.84 0.10 0.00 -1.01 0.00 0.00 57.07 57.01 2g94 s TYR 286 Cb -0.14 -2.38 -0.04 0.00 -0.11 0.00 0.00 41.96 39.29 2g94 s TYR 286 CO -0.01 0.37 -0.23 -0.51 -1.11 0.00 0.00 175.55 174.06 2g94 s LEU 287 N -0.08 2.45 0.34 -1.29 1.43 0.15 -0.89 118.68 120.79 2g94 s LEU 287 Ca 0.22 -0.64 -0.29 0.00 -1.03 0.00 0.00 54.13 52.40 2g94 s LEU 287 Cb -0.15 -1.36 -0.11 0.00 0.03 0.00 0.00 46.19 44.60 2g94 s LEU 287 CO 0.09 0.20 1.55 0.80 0.23 0.00 0.00 176.35 179.22 2g94 n MET 288 N 1.05 2.73 -2.71 1.70 0.00 -0.97 -1.95 117.12 116.96 2g94 n MET 288 Ca -0.17 0.96 -0.22 0.00 -0.00 0.00 0.00 57.70 58.27 2g94 n MET 288 Cb 0.53 -2.73 0.08 0.00 0.00 0.00 0.00 33.22 31.10 2g94 n MET 288 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2g94 s GLY 289 N 0.19 1.77 0.38 -5.12 0.00 0.11 -4.08 107.32 100.57 2g94 s GLY 289 Ca 0.58 -1.77 0.21 0.00 0.00 0.00 0.00 44.72 43.74 2g94 s GLY 289 CO 0.56 -1.28 1.53 0.83 0.00 0.00 0.00 173.10 174.75 2g94 h GLU 290 N -0.24 0.00 -6.11 2.90 5.08 -1.81 -3.43 114.58 110.98 2g94 h GLU 290 Ca -0.36 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.43 2g94 h GLU 290 Cb 1.28 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.48 2g94 h GLU 290 CO 0.42 0.15 -0.06 0.08 -1.00 0.00 0.00 179.01 178.60 2g94 s VAL 291 N -3.14 4.88 0.25 3.13 1.01 -1.26 -5.01 120.40 120.25 2g94 s VAL 291 Ca 0.06 1.15 -0.30 0.00 0.00 0.00 0.00 61.98 62.89 2g94 s VAL 291 Cb 0.06 -3.88 -0.15 0.00 0.00 0.00 0.00 36.38 32.42 2g94 s VAL 291 CO 0.70 0.49 1.07 0.41 0.00 0.00 0.00 175.10 177.76 2g94 n THR 292 N 2.26 1.59 -1.97 3.92 -1.04 -1.26 -1.31 114.28 116.47 2g94 n THR 292 Ca -0.09 -0.40 -0.16 0.00 -2.04 0.00 0.00 64.05 61.36 2g94 n THR 292 Cb 0.51 -0.95 -0.04 0.00 -1.82 0.00 0.00 70.33 68.04 2g94 n THR 292 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2g94 n ASN 293 N 1.55 -4.47 -4.32 8.00 3.02 -1.26 -4.97 115.26 112.81 2g94 n ASN 293 Ca 0.12 0.24 -0.30 0.00 -0.03 0.00 0.00 54.58 54.61 2g94 n ASN 293 Cb 0.29 -3.90 -0.15 0.00 -0.61 0.00 0.00 39.78 35.42 2g94 n ASN 293 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 2g94 s GLN 294 N -4.24 1.81 0.11 3.52 0.74 -0.43 -0.51 119.66 120.66 2g94 s GLN 294 Ca 0.00 -1.05 -0.04 0.00 0.05 0.00 0.00 55.36 54.32 2g94 s GLN 294 Cb 0.00 -1.93 -0.03 0.00 1.10 0.00 0.00 33.01 32.16 2g94 s GLN 294 CO 0.00 0.50 0.10 -1.54 -0.55 0.00 0.00 175.29 173.81 2g94 s SER 295 N -1.09 0.27 0.34 6.67 1.04 -0.50 0.08 113.70 120.51 2g94 s SER 295 Ca 0.11 -1.01 0.05 0.00 0.48 0.00 0.00 55.95 55.58 2g94 s SER 295 Cb -0.10 0.31 -0.03 0.00 0.10 0.00 0.00 66.02 66.30 2g94 s SER 295 CO 0.01 -0.73 0.19 0.72 0.98 0.00 0.00 173.24 174.41 2g94 s PHE 296 N -3.97 1.70 0.04 5.02 -0.12 -0.82 -0.17 117.98 119.65 2g94 s PHE 296 Ca 0.16 -1.44 0.02 0.00 -0.05 0.00 0.00 56.93 55.62 2g94 s PHE 296 Cb 0.06 -0.91 -0.02 0.00 -0.63 0.00 0.00 43.02 41.52 2g94 s PHE 296 CO -0.03 -0.56 -0.07 -0.98 -0.05 0.00 0.00 175.22 173.53 2g94 s ARG 297 N -3.67 0.50 -0.05 1.99 1.70 0.41 -0.68 118.95 119.15 2g94 s ARG 297 Ca 0.33 -0.74 0.05 0.00 -0.47 0.00 0.00 55.73 54.90 2g94 s ARG 297 Cb 0.03 -0.24 -0.02 0.00 -0.57 0.00 0.00 34.95 34.16 2g94 s ARG 297 CO 0.20 0.04 -0.21 0.96 -1.08 0.00 0.00 175.30 175.20 2g94 s ILE 298 N -1.41 2.45 -0.11 4.99 -4.36 0.07 -1.37 121.20 121.46 2g94 s ILE 298 Ca -0.11 -0.94 0.01 0.00 -0.26 0.00 0.00 60.65 59.36 2g94 s ILE 298 Cb -0.10 -1.92 0.02 0.00 1.25 0.00 0.00 42.46 41.71 2g94 s ILE 298 CO 0.00 0.57 -0.14 -0.89 0.24 0.00 0.00 174.94 174.73 2g94 s THR 299 N -0.39 1.42 0.31 8.37 2.01 0.63 -0.46 115.64 127.53 2g94 s THR 299 Ca 0.04 -0.58 0.08 0.00 0.31 0.00 0.00 61.69 61.54 2g94 s THR 299 Cb -0.12 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 71.04 2g94 s THR 299 CO 0.02 0.43 0.16 0.27 -0.69 0.00 0.00 174.62 174.81 2g94 s ILE 300 N 1.13 3.42 0.43 1.82 -4.36 0.14 -1.85 121.20 121.92 2g94 s ILE 300 Ca -0.04 -1.61 0.07 0.00 -0.26 0.00 0.00 60.65 58.81 2g94 s ILE 300 Cb -0.14 -3.07 -0.03 0.00 1.25 0.00 0.00 42.46 40.47 2g94 s ILE 300 CO -0.03 -0.24 0.30 -0.76 0.24 0.00 0.00 174.94 174.45 2g94 s LEU 301 N -3.85 3.22 0.58 0.37 1.43 -1.26 -1.46 118.68 117.70 2g94 s LEU 301 Ca 0.37 -0.93 0.33 0.00 -1.03 0.00 0.00 54.13 52.87 2g94 s LEU 301 Cb -0.05 -1.72 1.78 0.00 0.03 0.00 0.00 46.19 46.23 2g94 s LEU 301 CO 0.23 -0.65 2.18 1.55 0.23 0.00 0.00 176.35 179.89 2g94 h PRO 302 N 1.17 0.00 0.00 1.29 0.13 -1.87 0.15 132.00 132.87 2g94 h PRO 302 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2g94 h PRO 302 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2g94 h PRO 302 CO 0.63 0.05 0.00 1.96 -0.23 0.00 0.00 178.00 180.41 2g94 h GLN 303 N 0.00 0.00 0.03 0.86 7.50 -1.86 0.99 115.11 122.64 2g94 h GLN 303 Ca -0.00 0.00 -0.35 0.00 0.50 0.00 0.00 58.65 58.80 2g94 h GLN 303 Cb 0.21 0.00 -0.04 0.00 0.05 0.00 0.00 27.48 27.70 2g94 h GLN 303 CO 0.01 0.00 -1.96 1.04 -1.50 0.00 0.00 178.83 176.41 2g94 n GLN 304 N -2.61 0.64 0.00 1.46 3.00 0.51 -4.53 117.38 115.84 2g94 n GLN 304 Ca -0.01 0.35 0.14 0.00 -0.01 0.00 0.00 57.00 57.47 2g94 n GLN 304 Cb 0.13 -1.64 0.55 0.00 0.00 0.00 0.00 30.24 29.28 2g94 n GLN 304 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.06 179.54 2g94 n TYR 305 N -3.94 0.00 -3.78 1.08 0.18 -1.02 -4.54 117.16 105.14 2g94 n TYR 305 Ca -0.40 0.00 -0.36 0.00 1.88 0.00 0.00 57.90 59.02 2g94 n TYR 305 Cb 0.88 -0.01 -0.12 0.00 -0.38 0.00 0.00 39.34 39.71 2g94 n TYR 305 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 2g94 s LEU 306 N -2.03 4.91 -0.18 -3.48 1.43 0.31 -0.37 118.68 119.28 2g94 s LEU 306 Ca 0.38 -1.77 -0.26 0.00 -1.03 0.00 0.00 54.13 51.45 2g94 s LEU 306 Cb 0.21 -1.82 -0.01 0.00 0.03 0.00 0.00 46.19 44.60 2g94 s LEU 306 CO 0.35 -0.47 0.88 -0.60 0.23 0.00 0.00 176.35 176.74 2g94 s ARG 307 N 1.21 4.29 0.23 1.70 3.52 -0.11 -4.78 118.95 125.02 2g94 s ARG 307 Ca 0.04 1.10 -0.31 0.00 -0.13 0.00 0.00 55.73 56.44 2g94 s ARG 307 Cb -0.22 -3.59 -0.11 0.00 -1.56 0.00 0.00 34.95 29.47 2g94 s ARG 307 CO -0.03 -0.39 1.57 -2.14 -0.81 0.00 0.00 175.30 173.51 2g94 s PRO 308 N 2.36 4.18 0.01 5.12 0.02 -1.26 -1.10 135.00 144.32 2g94 s PRO 308 Ca 0.40 2.46 -0.01 0.00 0.02 0.00 0.00 61.00 63.87 2g94 s PRO 308 Cb -0.16 -3.09 -0.01 0.00 0.02 0.00 0.00 34.50 31.26 2g94 s PRO 308 CO 0.12 -0.60 0.01 0.14 -0.33 0.00 0.00 177.00 176.34 2g94 s VAL 309 N 0.50 0.07 0.29 3.83 -7.23 -0.62 -4.62 120.40 112.61 2g94 s VAL 309 Ca 0.66 -0.56 -0.29 0.00 -1.81 0.00 0.00 61.98 59.98 2g94 s VAL 309 Cb -0.46 -0.21 -0.10 0.00 0.56 0.00 0.00 36.38 36.18 2g94 s VAL 309 CO 0.40 -0.31 1.16 -0.70 -0.31 0.00 0.00 175.10 175.34 2g94 s GLU 310 N -0.92 4.56 0.02 4.82 2.56 -1.26 -4.00 118.70 124.48 2g94 s GLU 310 Ca -0.10 1.92 -0.24 0.00 0.00 0.00 0.00 54.97 56.55 2g94 s GLU 310 Cb -0.06 -3.16 -0.05 0.00 2.00 0.00 0.00 34.13 32.85 2g94 s GLU 310 CO -0.00 0.09 0.73 0.34 -0.56 0.00 0.00 175.26 175.86 2g94 s ASP 311 N -0.71 7.15 0.11 -1.70 2.15 -1.26 -4.98 116.67 117.42 2g94 s ASP 311 Ca 0.46 1.37 -0.29 0.00 0.43 0.00 0.00 52.55 54.52 2g94 s ASP 311 Cb -0.34 -2.44 -0.11 0.00 -0.30 0.00 0.00 42.92 39.73 2g94 s ASP 311 CO 0.44 0.01 1.48 -0.37 -0.17 0.00 0.00 175.17 176.56 2g94 h VAL 312 N 4.20 0.00 -2.75 1.11 -1.51 -1.97 -3.42 116.25 111.92 2g94 h VAL 312 Ca -0.44 0.00 -0.59 0.00 -1.23 0.00 0.00 66.70 64.44 2g94 h VAL 312 Cb 1.20 0.00 0.13 0.00 -2.13 0.00 0.00 31.29 30.49 2g94 h VAL 312 CO 0.71 0.00 0.04 0.00 -1.23 0.00 0.00 177.57 177.09 2g94 n ALA 313 N -2.98 -0.28 0.00 5.19 0.00 -1.26 -4.73 120.51 116.46 2g94 n ALA 313 Ca -0.05 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2g94 n ALA 313 Cb 0.32 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 17.77 2g94 n ALA 313 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2g94 n THR 314 N -0.38 0.00 -1.23 0.00 -1.04 -1.26 -4.77 114.28 105.60 2g94 n THR 314 Ca 0.10 0.00 -0.38 0.00 -2.04 0.00 0.00 64.05 61.73 2g94 n THR 314 Cb 0.37 -0.84 0.03 0.00 -1.82 0.00 0.00 70.33 68.08 2g94 n THR 314 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2g94 n SER 315 N -0.77 -3.12 -1.67 8.00 3.41 -1.26 -4.85 113.62 113.35 2g94 n SER 315 Ca 0.00 0.56 0.07 0.00 -0.26 0.00 0.00 58.87 59.24 2g94 n SER 315 Cb 0.00 -0.97 0.35 0.00 -0.26 0.00 0.00 64.21 63.33 2g94 n SER 315 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2g94 n GLN 316 N 0.89 4.19 -1.93 4.33 1.13 -1.26 -4.91 117.38 119.82 2g94 n GLN 316 Ca 0.07 -2.76 -0.34 0.00 -1.94 0.00 0.00 57.00 52.04 2g94 n GLN 316 Cb 0.49 -2.08 0.03 0.00 0.11 0.00 0.00 30.24 28.79 2g94 n GLN 316 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2g94 s ASP 317 N -0.74 5.30 -0.33 1.08 1.11 -1.26 -3.51 116.67 118.30 2g94 s ASP 317 Ca 0.48 2.09 -0.10 0.00 0.18 0.00 0.00 52.55 55.19 2g94 s ASP 317 Cb 0.35 -2.56 0.00 0.00 1.07 0.00 0.00 42.92 41.78 2g94 s ASP 317 CO 0.17 -1.51 0.18 -1.81 1.18 0.00 0.00 175.17 173.38 2g94 s ASP 318 N -2.25 5.67 0.18 0.27 -0.00 -0.34 -4.73 116.67 115.47 2g94 s ASP 318 Ca 0.70 -0.64 0.10 0.00 -0.00 0.00 0.00 52.55 52.70 2g94 s ASP 318 Cb -0.22 -2.03 -0.04 0.00 -0.00 0.00 0.00 42.92 40.63 2g94 s ASP 318 CO 0.36 -0.26 -0.16 0.00 -0.00 0.00 0.00 175.17 175.12 2g94 s TYR 320 N -1.62 0.08 0.07 0.00 1.51 -0.48 -1.59 117.35 115.32 2g94 s TYR 320 Ca 0.23 -0.43 0.07 0.00 -1.01 0.00 0.00 57.07 55.92 2g94 s TYR 320 Cb -0.09 -0.02 -0.04 0.00 -0.11 0.00 0.00 41.96 41.71 2g94 s TYR 320 CO 0.13 -0.52 -0.13 0.15 -1.11 0.00 0.00 175.55 174.07 2g94 s LYS 321 N -3.41 2.14 -0.30 -0.62 1.02 -0.26 -1.72 119.74 116.58 2g94 s LYS 321 Ca 0.01 -0.97 -0.29 0.00 0.02 0.00 0.00 55.97 54.74 2g94 s LYS 321 Cb 0.03 -2.28 -0.00 0.00 -0.52 0.00 0.00 37.83 35.06 2g94 s LYS 321 CO -0.09 0.53 1.41 0.12 -0.92 0.00 0.00 175.35 176.40 2g94 s PHE 322 N -1.07 2.47 -0.34 3.18 5.36 -1.26 -0.93 117.98 125.39 2g94 s PHE 322 Ca 0.18 0.75 0.01 0.00 -0.96 0.00 0.00 56.93 56.91 2g94 s PHE 322 Cb -0.11 -4.01 0.40 0.00 -0.34 0.00 0.00 43.02 38.96 2g94 s PHE 322 CO 0.09 -2.07 1.74 0.00 -1.46 0.00 0.00 175.22 173.51 2g94 n ALA 323 N 8.12 4.85 -3.39 11.12 0.00 0.51 -4.31 120.51 137.40 2g94 n ALA 323 Ca 0.16 -2.02 -0.30 0.00 0.00 0.00 0.00 53.44 51.28 2g94 n ALA 323 Cb 0.47 -1.36 -0.17 0.00 0.00 0.00 0.00 19.45 18.38 2g94 n ALA 323 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2g94 s ILE 324 N -2.48 1.74 0.16 0.00 1.01 -1.26 -1.70 121.20 118.67 2g94 s ILE 324 Ca 0.39 -0.82 -0.03 0.00 0.00 0.00 0.00 60.65 60.19 2g94 s ILE 324 Cb 0.32 -1.53 -0.03 0.00 0.01 0.00 0.00 42.46 41.23 2g94 s ILE 324 CO 0.05 0.49 0.15 -0.94 0.00 0.00 0.00 174.94 174.69 2g94 s SER 325 N 0.57 0.19 0.44 3.58 1.04 -0.80 -4.72 113.70 114.00 2g94 s SER 325 Ca -0.15 -1.17 -0.17 0.00 0.48 0.00 0.00 55.95 54.95 2g94 s SER 325 Cb -0.17 0.37 -0.09 0.00 0.10 0.00 0.00 66.02 66.23 2g94 s SER 325 CO 0.05 -0.82 0.90 0.00 0.98 0.00 0.00 173.24 174.35 2g94 s GLN 326 N -4.06 4.01 0.02 4.02 -2.07 -1.26 -0.69 119.66 119.63 2g94 s GLN 326 Ca 0.26 0.88 0.03 0.00 -1.82 0.00 0.00 55.36 54.71 2g94 s GLN 326 Cb 0.06 -2.24 -0.01 0.00 -1.09 0.00 0.00 33.01 29.73 2g94 s GLN 326 CO 0.04 -0.10 -0.09 0.45 -1.32 0.00 0.00 175.29 174.28 2g94 s SER 327 N -2.70 1.00 0.00 12.60 0.15 0.12 -4.72 113.70 120.15 2g94 s SER 327 Ca 0.58 -0.34 0.16 0.00 0.70 0.00 0.00 55.95 57.05 2g94 s SER 327 Cb -0.10 -0.05 0.28 0.00 -1.71 0.00 0.00 66.02 64.44 2g94 s SER 327 CO 0.24 -0.02 1.18 -1.54 1.20 0.00 0.00 173.24 174.30 2g94 n SER 328 N 2.21 2.81 -1.54 5.45 3.41 -1.26 -2.69 113.62 122.02 2g94 n SER 328 Ca -0.17 -1.83 -0.06 0.00 -0.26 0.00 0.00 58.87 56.56 2g94 n SER 328 Cb 0.56 -0.16 0.09 0.00 -0.26 0.00 0.00 64.21 64.44 2g94 n SER 328 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2g94 n THR 329 N 0.93 1.86 0.00 6.66 -2.24 -1.26 -5.07 114.28 115.17 2g94 n THR 329 Ca 0.13 -3.20 0.00 0.00 -2.27 0.00 0.00 64.05 58.70 2g94 n THR 329 Cb 0.45 -0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 2g94 n THR 329 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2g94 n GLY 330 N -0.66 -0.09 3.75 3.38 0.00 -1.24 -4.58 105.19 105.76 2g94 n GLY 330 Ca 0.24 -1.88 -0.40 0.00 0.00 0.00 0.00 46.02 43.98 2g94 n GLY 330 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g94 s THR 331 N -1.33 3.62 -0.20 2.61 2.01 0.75 -4.35 115.64 118.76 2g94 s THR 331 Ca 0.00 1.60 0.00 0.00 0.31 0.00 0.00 61.69 63.60 2g94 s THR 331 Cb 0.00 -4.02 0.05 0.00 0.01 0.00 0.00 72.50 68.54 2g94 s THR 331 CO 0.00 0.37 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.54 2g94 s VAL 332 N -1.04 1.40 -0.86 3.82 1.01 0.52 -1.57 120.40 123.69 2g94 s VAL 332 Ca 0.45 -0.95 -0.20 0.00 0.00 0.00 0.00 61.98 61.27 2g94 s VAL 332 Cb -0.31 -1.59 0.10 0.00 0.00 0.00 0.00 36.38 34.59 2g94 s VAL 332 CO 0.39 0.05 1.12 -0.04 0.00 0.00 0.00 175.10 176.62 2g94 s MET 333 N 1.48 3.45 0.00 2.72 -1.94 0.07 -1.02 119.30 124.07 2g94 s MET 333 Ca -0.02 -1.40 0.00 0.00 -1.71 0.00 0.00 55.69 52.56 2g94 s MET 333 Cb -0.17 -4.77 0.00 0.00 2.01 0.00 0.00 34.83 31.91 2g94 s MET 333 CO -0.07 -1.84 0.00 0.41 -0.01 0.00 0.00 175.02 173.50 2g94 n GLY 334 N 5.62 0.90 0.27 -0.03 0.00 -1.09 -1.24 105.19 109.62 2g94 n GLY 334 Ca 0.17 -1.74 0.10 0.00 0.00 0.00 0.00 46.02 44.55 2g94 n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g94 h ALA 335 N -1.56 1.92 -0.70 4.61 0.00 -0.26 -0.42 119.26 122.85 2g94 h ALA 335 Ca 0.00 -0.00 0.10 0.00 0.00 0.00 0.00 54.91 55.01 2g94 h ALA 335 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2g94 h ALA 335 CO 0.00 -0.02 0.46 0.28 0.00 0.00 0.00 179.25 179.97 2g94 h VAL 336 N 0.00 0.93 0.03 0.00 2.07 -1.57 0.25 116.25 117.95 2g94 h VAL 336 Ca 0.01 -0.20 -0.20 0.00 0.82 0.00 0.00 66.70 67.13 2g94 h VAL 336 Cb 0.03 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.07 2g94 h VAL 336 CO -0.00 0.11 -1.07 0.40 0.02 0.00 0.00 177.57 177.03 2g94 h ILE 337 N 0.58 1.10 0.00 4.57 1.08 -1.55 -3.40 117.51 119.90 2g94 h ILE 337 Ca 0.32 -2.26 -0.03 0.00 -0.39 0.00 0.00 64.86 62.50 2g94 h ILE 337 Cb 0.49 2.55 -0.00 0.00 -3.07 0.00 0.00 36.82 36.78 2g94 h ILE 337 CO -0.11 0.47 -0.16 0.24 -0.69 0.00 0.00 178.15 177.90 2g94 h MET 338 N -0.83 0.00 0.00 2.37 2.86 -0.72 -1.57 114.93 117.05 2g94 h MET 338 Ca -0.28 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.36 2g94 h MET 338 Cb 1.36 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.02 2g94 h MET 338 CO -0.11 0.16 0.00 0.39 1.06 0.00 0.00 176.91 178.41 2g94 n GLU 339 N -4.14 0.10 0.08 1.72 1.02 0.85 -2.30 120.64 117.97 2g94 n GLU 339 Ca -0.02 0.29 0.11 0.00 -0.02 0.00 0.00 57.16 57.52 2g94 n GLU 339 Cb 0.23 -1.67 0.01 0.00 -0.02 0.00 0.00 31.44 29.99 2g94 n GLU 339 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2g94 n GLY 340 N 0.25 -1.38 3.13 0.62 0.00 -0.59 -4.25 105.19 102.97 2g94 n GLY 340 Ca 0.03 -0.28 -0.10 0.00 0.00 0.00 0.00 46.02 45.67 2g94 n GLY 340 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2g94 s PHE 341 N -3.33 0.75 -0.16 1.61 0.40 -0.97 -1.82 117.98 114.45 2g94 s PHE 341 Ca 0.00 -0.92 -0.21 0.00 -0.60 0.00 0.00 56.93 55.20 2g94 s PHE 341 Cb 0.11 -0.46 -0.03 0.00 0.51 0.00 0.00 43.02 43.15 2g94 s PHE 341 CO 0.79 -0.21 0.63 -0.47 0.70 0.00 0.00 175.22 176.66 2g94 s TYR 342 N -3.51 3.43 -0.17 0.36 5.04 0.15 -4.55 117.35 118.10 2g94 s TYR 342 Ca 0.08 0.99 -0.01 0.00 -2.44 0.00 0.00 57.07 55.70 2g94 s TYR 342 Cb 0.05 -2.77 -0.00 0.00 0.35 0.00 0.00 41.96 39.59 2g94 s TYR 342 CO -0.06 -0.08 -0.14 0.08 -1.34 0.00 0.00 175.55 174.01 2g94 s VAL 343 N 1.54 2.74 -0.33 3.14 1.01 -0.10 -2.10 120.40 126.31 2g94 s VAL 343 Ca 0.30 -0.73 -0.11 0.00 0.00 0.00 0.00 61.98 61.44 2g94 s VAL 343 Cb -0.16 -2.18 -0.00 0.00 0.00 0.00 0.00 36.38 34.04 2g94 s VAL 343 CO 0.12 0.50 0.19 -0.69 0.00 0.00 0.00 175.10 175.21 2g94 s VAL 344 N 1.00 4.79 -1.12 2.92 1.01 0.29 -0.35 120.40 128.94 2g94 s VAL 344 Ca -0.02 -0.43 -0.12 0.00 0.00 0.00 0.00 61.98 61.41 2g94 s VAL 344 Cb -0.15 -3.48 0.21 0.00 0.00 0.00 0.00 36.38 32.96 2g94 s VAL 344 CO -0.03 0.00 1.23 -0.36 0.00 0.00 0.00 175.10 175.94 2g94 s PHE 345 N 1.64 3.79 -1.27 5.22 0.08 0.44 -0.11 117.98 127.77 2g94 s PHE 345 Ca 0.05 -2.28 -0.17 0.00 0.12 0.00 0.00 56.93 54.65 2g94 s PHE 345 Cb -0.17 -4.09 0.10 0.00 -0.57 0.00 0.00 43.02 38.29 2g94 s PHE 345 CO 0.07 -1.20 1.66 0.34 -0.10 0.00 0.00 175.22 175.99 2g94 s ASP 346 N 2.26 6.90 0.26 1.36 -1.08 -0.41 -2.67 116.67 123.29 2g94 s ASP 346 Ca 0.35 -2.59 -0.04 0.00 -0.52 0.00 0.00 52.55 49.76 2g94 s ASP 346 Cb -0.06 -2.53 0.33 0.00 -1.46 0.00 0.00 42.92 39.19 2g94 s ASP 346 CO -0.05 -1.06 1.83 0.03 0.52 0.00 0.00 175.17 176.45 2g94 h ARG 347 N 7.48 1.00 -0.80 4.34 3.08 -1.75 -0.66 114.38 127.07 2g94 h ARG 347 Ca 0.41 -0.17 0.09 0.00 0.07 0.00 0.00 59.98 60.38 2g94 h ARG 347 Cb 0.87 -0.17 -0.07 0.00 0.08 0.00 0.00 29.97 30.68 2g94 h ARG 347 CO 1.40 0.82 0.45 0.00 -1.07 0.00 0.00 179.97 181.57 2g94 h ALA 348 N 1.31 1.12 -0.47 0.04 0.00 -1.54 -2.10 119.26 117.62 2g94 h ALA 348 Ca 0.23 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2g94 h ALA 348 Cb 0.19 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2g94 h ALA 348 CO -0.02 0.09 0.00 0.54 0.00 0.00 0.00 179.25 179.86 2g94 n ARG 349 N -4.75 3.68 -3.89 0.00 1.74 -1.09 -4.98 116.66 107.37 2g94 n ARG 349 Ca 0.13 -2.85 -0.31 0.00 -0.77 0.00 0.00 57.85 54.05 2g94 n ARG 349 Cb 0.26 -1.90 0.00 0.00 -1.02 0.00 0.00 32.46 29.81 2g94 n ARG 349 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2g94 n LYS 350 N 0.41 -1.96 -3.63 5.56 4.81 -0.36 -4.93 118.16 118.07 2g94 n LYS 350 Ca 0.23 0.36 -0.11 0.00 -0.87 0.00 0.00 58.31 57.92 2g94 n LYS 350 Cb 0.91 -4.04 -0.05 0.00 0.02 0.00 0.00 35.03 31.88 2g94 n LYS 350 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 2g94 s ARG 351 N -6.51 1.05 -0.12 1.64 1.70 -0.58 -1.62 118.95 114.50 2g94 s ARG 351 Ca 0.25 -0.60 0.02 0.00 -0.47 0.00 0.00 55.73 54.93 2g94 s ARG 351 Cb -0.10 0.46 0.01 0.00 -0.57 0.00 0.00 34.95 34.75 2g94 s ARG 351 CO 0.90 -0.40 -0.19 0.42 -1.08 0.00 0.00 175.30 174.95 2g94 s ILE 352 N -3.46 1.80 0.02 4.99 1.01 0.36 -1.29 121.20 124.63 2g94 s ILE 352 Ca 0.01 -0.82 -0.01 0.00 0.00 0.00 0.00 60.65 59.82 2g94 s ILE 352 Cb 0.01 -1.61 -0.04 0.00 0.01 0.00 0.00 42.46 40.83 2g94 s ILE 352 CO -0.10 0.50 0.18 -0.83 0.00 0.00 0.00 174.94 174.69 2g94 s GLY 353 N 0.89 2.16 -0.03 6.18 0.00 0.84 -1.23 107.32 116.13 2g94 s GLY 353 Ca -0.07 -0.82 0.04 0.00 0.00 0.00 0.00 44.72 43.87 2g94 s GLY 353 CO -0.02 -0.75 -0.13 -1.36 0.00 0.00 0.00 173.10 170.84 2g94 s PHE 354 N -1.39 1.32 0.03 1.90 0.40 0.23 -0.55 117.98 119.91 2g94 s PHE 354 Ca 0.30 -0.34 -0.06 0.00 -0.60 0.00 0.00 56.93 56.23 2g94 s PHE 354 Cb -0.13 -0.90 -0.01 0.00 0.51 0.00 0.00 43.02 42.50 2g94 s PHE 354 CO 0.22 -0.11 0.11 0.00 0.70 0.00 0.00 175.22 176.14 2g94 s ALA 355 N 0.03 -0.16 0.20 5.36 0.00 -0.89 -0.95 121.76 125.35 2g94 s ALA 355 Ca -0.02 -0.40 -0.32 0.00 0.00 0.00 0.00 51.96 51.22 2g94 s ALA 355 Cb -0.09 0.20 -0.12 0.00 0.00 0.00 0.00 23.12 23.12 2g94 s ALA 355 CO 0.01 -0.28 1.70 0.08 0.00 0.00 0.00 175.76 177.27 2g94 s VAL 356 N -2.16 2.13 0.22 0.00 1.01 -1.24 -0.68 120.40 119.69 2g94 s VAL 356 Ca -0.09 0.09 -0.30 0.00 0.00 0.00 0.00 61.98 61.69 2g94 s VAL 356 Cb -0.04 -3.06 -0.08 0.00 0.00 0.00 0.00 36.38 33.20 2g94 s VAL 356 CO -0.02 0.01 1.13 -0.55 0.00 0.00 0.00 175.10 175.66 2g94 s SER 357 N 1.19 7.21 0.09 3.32 0.15 -0.76 -1.85 113.70 123.05 2g94 s SER 357 Ca 0.74 2.20 0.14 0.00 0.70 0.00 0.00 55.95 59.73 2g94 s SER 357 Cb -0.49 -2.61 0.61 0.00 -1.71 0.00 0.00 66.02 61.82 2g94 s SER 357 CO 0.32 -0.24 1.43 0.00 1.20 0.00 0.00 173.24 175.95 2g94 n ALA 358 N 1.96 1.44 -1.17 5.45 0.00 -0.19 -2.70 120.51 125.31 2g94 n ALA 358 Ca 0.02 0.02 0.09 0.00 0.00 0.00 0.00 53.44 53.57 2g94 n ALA 358 Cb 0.45 -1.22 0.15 0.00 0.00 0.00 0.00 19.45 18.83 2g94 n ALA 358 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g94 s HIS 360 N -2.90 3.45 0.06 0.00 -0.00 -1.10 -4.55 115.29 110.26 2g94 s HIS 360 Ca 0.33 1.68 -0.27 0.00 -0.00 0.00 0.00 55.06 56.80 2g94 s HIS 360 Cb 0.29 -2.90 -0.05 0.00 -0.00 0.00 0.00 32.58 29.91 2g94 s HIS 360 CO 0.01 -0.03 0.84 0.08 -0.00 0.00 0.00 174.74 175.64 2g94 s VAL 361 N -1.91 4.67 0.00 -5.38 1.01 -1.26 -5.03 120.40 112.50 2g94 s VAL 361 Ca 0.57 1.80 0.00 0.00 0.00 0.00 0.00 61.98 64.35 2g94 s VAL 361 Cb -0.14 -4.19 0.00 0.00 0.00 0.00 0.00 36.38 32.05 2g94 s VAL 361 CO 0.18 0.33 0.00 0.00 0.00 0.00 0.00 175.10 175.62 2g94 n HIS 362 N 2.90 -0.35 -4.14 5.22 -0.00 -1.26 -4.71 115.22 112.88 2g94 n HIS 362 Ca -0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.64 2g94 n HIS 362 Cb 0.50 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.46 2g94 n HIS 362 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 2g94 n ASP 363 N -0.59 0.45 0.07 4.39 5.68 -1.19 -5.04 116.55 120.32 2g94 n ASP 363 Ca 0.00 -1.76 0.11 0.00 -0.50 0.00 0.00 54.79 52.64 2g94 n ASP 363 Cb 0.00 0.46 0.45 0.00 -1.14 0.00 0.00 41.12 40.89 2g94 n ASP 363 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 2g94 n GLU 364 N -0.28 0.13 -0.07 0.11 2.13 -1.26 -3.70 120.64 117.70 2g94 n GLU 364 Ca 0.00 0.28 -0.04 0.00 0.66 0.00 0.00 57.16 58.06 2g94 n GLU 364 Cb 0.21 -1.71 -0.16 0.00 0.27 0.00 0.00 31.44 30.05 2g94 n GLU 364 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 2g94 n PHE 365 N -1.96 0.00 -3.96 4.31 3.01 -1.26 -5.02 117.46 112.57 2g94 n PHE 365 Ca 0.04 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.41 2g94 n PHE 365 Cb 0.27 -0.84 -0.10 0.00 -0.01 0.00 0.00 39.48 38.80 2g94 n PHE 365 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2g94 s ARG 366 N -2.79 0.53 0.09 -1.08 0.52 -1.24 -5.17 118.95 109.80 2g94 s ARG 366 Ca -0.09 -0.79 0.01 0.00 -0.52 0.00 0.00 55.73 54.34 2g94 s ARG 366 Cb 0.08 0.20 -0.04 0.00 0.52 0.00 0.00 34.95 35.71 2g94 s ARG 366 CO 0.85 -0.12 -0.05 0.95 0.02 0.00 0.00 175.30 176.95 2g94 s THR 367 N -2.54 0.57 0.83 0.02 -4.23 -1.26 -3.16 115.64 105.86 2g94 s THR 367 Ca -0.06 -1.91 -0.11 0.00 -1.18 0.00 0.00 61.69 58.44 2g94 s THR 367 Cb -0.02 -1.68 0.09 0.00 1.34 0.00 0.00 72.50 72.23 2g94 s THR 367 CO -0.05 -0.87 1.10 0.00 -0.54 0.00 0.00 174.62 174.26 2g94 s ALA 368 N -3.71 1.93 0.07 3.99 0.00 -1.26 -4.91 121.76 117.87 2g94 s ALA 368 Ca 0.12 0.21 -0.13 0.00 0.00 0.00 0.00 51.96 52.15 2g94 s ALA 368 Cb 0.06 -3.27 0.02 0.00 0.00 0.00 0.00 23.12 19.93 2g94 s ALA 368 CO -0.05 -2.07 0.29 0.00 0.00 0.00 0.00 175.76 173.93 2g94 s ALA 369 N -2.88 -0.62 -0.13 0.00 0.00 -0.77 -4.97 121.76 112.39 2g94 s ALA 369 Ca 0.62 -0.14 -0.02 0.00 0.00 0.00 0.00 51.96 52.42 2g94 s ALA 369 Cb -0.18 0.42 0.04 0.00 0.00 0.00 0.00 23.12 23.40 2g94 s ALA 369 CO 0.57 -0.47 0.02 0.08 0.00 0.00 0.00 175.76 175.96 2g94 s VAL 370 N -3.04 0.44 0.05 0.00 1.01 -1.26 -0.27 120.40 117.33 2g94 s VAL 370 Ca -0.02 -0.22 -0.00 0.00 0.00 0.00 0.00 61.98 61.74 2g94 s VAL 370 Cb 0.01 -0.78 -0.03 0.00 0.00 0.00 0.00 36.38 35.57 2g94 s VAL 370 CO -0.06 0.02 -0.04 -1.61 0.00 0.00 0.00 175.10 173.40 2g94 s GLU 371 N 1.92 0.57 0.00 2.72 2.02 -0.47 -4.89 118.70 120.58 2g94 s GLU 371 Ca 0.02 -1.07 0.00 0.00 0.02 0.00 0.00 54.97 53.94 2g94 s GLU 371 Cb -0.15 0.09 0.00 0.00 0.10 0.00 0.00 34.13 34.18 2g94 s GLU 371 CO -0.07 -0.07 0.00 0.41 0.02 0.00 0.00 175.26 175.55 2g94 n GLY 372 N 0.50 -1.28 3.97 -1.39 0.00 -1.26 -0.44 105.19 105.29 2g94 n GLY 372 Ca -0.17 -1.00 -0.21 0.00 0.00 0.00 0.00 46.02 44.65 2g94 n GLY 372 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2g94 s PRO 373 N -1.55 2.75 -0.04 1.61 0.04 -1.26 -5.08 135.00 131.46 2g94 s PRO 373 Ca 0.00 -0.75 0.04 0.00 0.04 0.00 0.00 61.00 60.32 2g94 s PRO 373 Cb 0.00 -2.55 0.00 0.00 0.04 0.00 0.00 34.50 31.99 2g94 s PRO 373 CO 0.00 -0.50 -0.14 -0.06 0.04 0.00 0.00 177.00 176.33 2g94 s PHE 374 N -2.63 1.47 -0.45 0.56 0.40 0.75 -4.94 117.98 113.14 2g94 s PHE 374 Ca 0.54 -0.43 -0.29 0.00 -0.60 0.00 0.00 56.93 56.16 2g94 s PHE 374 Cb -0.10 -1.01 0.01 0.00 0.51 0.00 0.00 43.02 42.43 2g94 s PHE 374 CO 0.37 -0.16 1.40 0.08 0.70 0.00 0.00 175.22 177.62 2g94 s VAL 375 N 0.15 3.88 -0.07 -0.44 1.01 -1.26 -1.41 120.40 122.26 2g94 s VAL 375 Ca -0.05 0.87 0.02 0.00 0.00 0.00 0.00 61.98 62.82 2g94 s VAL 375 Cb -0.11 -4.28 0.01 0.00 0.00 0.00 0.00 36.38 32.00 2g94 s VAL 375 CO 0.02 -0.87 -0.13 -0.89 0.00 0.00 0.00 175.10 173.23 2g94 s THR 376 N 5.58 1.21 0.29 3.92 2.01 0.33 -4.98 115.64 124.00 2g94 s THR 376 Ca 0.59 -0.52 0.07 0.00 0.31 0.00 0.00 61.69 62.14 2g94 s THR 376 Cb -0.12 -1.10 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 2g94 s THR 376 CO 0.31 0.37 0.24 -0.76 -0.69 0.00 0.00 174.62 174.09 2g94 s LEU 377 N 0.68 3.70 -1.35 4.42 1.43 -1.26 -3.78 118.68 122.52 2g94 s LEU 377 Ca -0.14 -0.37 -0.09 0.00 -1.03 0.00 0.00 54.13 52.49 2g94 s LEU 377 Cb -0.16 -2.27 0.06 0.00 0.03 0.00 0.00 46.19 43.86 2g94 s LEU 377 CO 0.04 -0.18 0.54 0.47 0.23 0.00 0.00 176.35 177.45 2g94 n ASP 378 N -1.26 -4.14 0.05 2.29 10.43 -1.26 -4.85 116.55 117.81 2g94 n ASP 378 Ca -0.05 -0.41 -0.01 0.00 2.57 0.00 0.00 54.79 56.89 2g94 n ASP 378 Cb 0.59 -3.40 0.28 0.00 1.84 0.00 0.00 41.12 40.43 2g94 n ASP 378 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 2g94 h MET 379 N -1.11 0.40 -0.67 -1.24 2.86 -2.00 -1.80 114.93 111.37 2g94 h MET 379 Ca -0.46 -0.12 0.18 0.00 -2.06 0.00 0.00 59.70 57.25 2g94 h MET 379 Cb 1.31 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.89 2g94 h MET 379 CO 0.55 0.56 0.47 1.49 1.06 0.00 0.00 176.91 181.04 2g94 h GLU 380 N 0.37 0.09 0.00 1.72 4.81 -1.98 0.32 114.58 119.90 2g94 h GLU 380 Ca 0.07 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 2g94 h GLU 380 Cb 0.51 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.87 2g94 h GLU 380 CO 0.03 0.06 0.00 -0.25 -0.73 0.00 0.00 179.01 178.12 2g94 n ASP 381 N -4.38 0.18 0.20 1.04 8.00 -0.68 -2.55 116.55 118.37 2g94 n ASP 381 Ca 0.13 0.54 0.13 0.00 0.71 0.00 0.00 54.79 56.30 2g94 n ASP 381 Cb 0.68 -0.58 0.27 0.00 -0.02 0.00 0.00 41.12 41.47 2g94 n ASP 381 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2g94 s GLY 383 N -4.06 2.67 -0.07 0.00 0.00 -1.06 -3.97 107.32 100.84 2g94 s GLY 383 Ca 0.07 0.84 -0.04 0.00 0.00 0.00 0.00 44.72 45.59 2g94 s GLY 383 CO 0.64 1.22 0.11 -0.47 0.00 0.00 0.00 173.10 174.60 2g94 s TYR 384 N -1.71 3.43 -0.63 1.90 5.04 -1.26 -4.92 117.35 119.20 2g94 s TYR 384 Ca 0.69 0.36 0.05 0.00 -2.44 0.00 0.00 57.07 55.73 2g94 s TYR 384 Cb -0.25 -1.84 0.04 0.00 0.35 0.00 0.00 41.96 40.26 2g94 s TYR 384 CO 0.29 0.63 0.66 0.09 -1.34 0.00 0.00 175.55 175.87