#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3mvs s VAL 2 N 0.00 2.44 0.33 1.69 0.11 -1.26 -4.95 120.40 118.76 3mvs s VAL 2 Ca 0.00 0.20 -0.29 0.00 -2.93 0.00 0.00 61.98 58.97 3mvs s VAL 2 Cb 0.00 -2.70 -0.12 0.00 -1.53 0.00 0.00 36.38 32.03 3mvs s VAL 2 CO 0.00 -0.13 1.41 -3.20 -3.33 0.00 0.00 175.10 169.85 3mvs n ASN 3 N -2.91 3.23 -4.61 3.54 5.15 -1.26 -5.03 115.26 113.37 3mvs n ASN 3 Ca 0.13 1.19 -0.32 0.00 -0.60 0.00 0.00 54.58 54.98 3mvs n ASN 3 Cb 0.51 -1.53 -0.10 0.00 -0.53 0.00 0.00 39.78 38.12 3mvs n ASN 3 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 3mvs s ARG 4 N -1.51 2.60 0.62 1.20 3.00 -1.26 -5.13 118.95 118.47 3mvs s ARG 4 Ca 0.58 -0.69 -0.15 0.00 0.00 0.00 0.00 55.73 55.47 3mvs s ARG 4 Cb -0.54 -2.53 -0.02 0.00 0.00 0.00 0.00 34.95 31.85 3mvs s ARG 4 CO 0.59 0.61 1.06 -0.51 0.00 0.00 0.00 175.30 177.05 3mvs s LEU 5 N -1.39 3.42 0.84 2.53 1.43 -1.26 -4.74 118.68 119.52 3mvs s LEU 5 Ca 0.17 1.80 -0.11 0.00 -1.03 0.00 0.00 54.13 54.96 3mvs s LEU 5 Cb -0.11 -4.53 0.10 0.00 0.03 0.00 0.00 46.19 41.68 3mvs s LEU 5 CO 0.07 -1.26 1.10 -2.16 0.23 0.00 0.00 176.35 174.33 3mvs s PRO 6 N -4.25 1.66 0.04 1.29 0.04 -1.26 -4.71 135.00 127.81 3mvs s PRO 6 Ca 0.63 1.07 0.04 0.00 0.04 0.00 0.00 61.00 62.78 3mvs s PRO 6 Cb -0.16 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 3mvs s PRO 6 CO 0.40 -2.03 -0.12 -0.59 0.04 0.00 0.00 177.00 174.71 3mvs s PHE 7 N -2.87 1.02 0.51 0.56 -0.12 -0.35 -4.86 117.98 111.86 3mvs s PHE 7 Ca 0.63 -0.35 -0.18 0.00 -0.05 0.00 0.00 56.93 56.97 3mvs s PHE 7 Cb -0.18 -0.61 -0.08 0.00 -0.63 0.00 0.00 43.02 41.52 3mvs s PHE 7 CO 0.57 0.01 1.00 -0.06 -0.05 0.00 0.00 175.22 176.69 3mvs s PHE 8 N -0.89 3.23 0.00 3.49 0.08 -1.26 -1.06 117.98 121.57 3mvs s PHE 8 Ca -0.01 1.53 0.00 0.00 0.12 0.00 0.00 56.93 58.57 3mvs s PHE 8 Cb -0.08 -2.91 0.00 0.00 -0.57 0.00 0.00 43.02 39.47 3mvs s PHE 8 CO 0.01 -0.56 0.26 0.25 -0.10 0.00 0.00 175.22 175.08 3mvs n THR 9 N -1.34 0.00 -2.12 0.64 -2.24 0.18 -4.89 114.28 104.51 3mvs n THR 9 Ca 0.08 -0.50 -0.41 0.00 -2.27 0.00 0.00 64.05 60.95 3mvs n THR 9 Cb 0.53 1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 69.74 3mvs n THR 9 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 3mvs s ASN 10 N -0.47 6.78 0.45 3.42 0.01 -1.26 -4.91 114.94 118.96 3mvs s ASN 10 Ca 0.00 2.57 0.12 0.00 -0.71 0.00 0.00 52.86 54.83 3mvs s ASN 10 Cb 0.00 -2.62 1.03 0.00 0.41 0.00 0.00 41.25 40.07 3mvs s ASN 10 CO 0.00 -0.59 2.07 -0.74 -1.51 0.00 0.00 177.10 176.33 3mvs h HIS 11 N 4.77 0.33 0.00 2.20 -0.00 -1.99 -2.51 115.15 117.95 3mvs h HIS 11 Ca -0.46 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 59.92 3mvs h HIS 11 Cb 1.22 -0.11 0.00 0.00 -0.00 0.00 0.00 27.41 28.52 3mvs h HIS 11 CO 0.60 0.20 0.00 0.27 -0.00 0.00 0.00 177.93 179.00 3mvs h PHE 12 N 0.35 0.00 0.00 5.26 -5.15 -1.91 0.15 116.94 115.64 3mvs h PHE 12 Ca 0.13 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.90 3mvs h PHE 12 Cb 0.11 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.28 3mvs h PHE 12 CO -0.00 0.00 0.00 1.19 -2.00 0.00 0.00 178.31 177.50 3mvs n PHE 13 N -2.34 0.49 -0.07 6.09 3.72 -0.95 -3.00 117.46 121.40 3mvs n PHE 13 Ca 0.00 0.21 -0.04 0.00 -0.05 0.00 0.00 57.45 57.56 3mvs n PHE 13 Cb 0.14 -0.83 -0.15 0.00 -0.94 0.00 0.00 39.48 37.70 3mvs n PHE 13 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3mvs n ASP 14 N -1.96 0.53 0.00 4.37 8.00 0.03 -4.90 116.55 122.62 3mvs n ASP 14 Ca 0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.52 3mvs n ASP 14 Cb 0.17 1.18 0.00 0.00 -0.02 0.00 0.00 41.12 42.44 3mvs n ASP 14 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3mvs n THR 15 N -2.55 0.00 -3.67 -3.53 -2.24 -1.16 -5.11 114.28 96.02 3mvs n THR 15 Ca -0.23 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.50 3mvs n THR 15 Cb 0.95 -0.07 -0.02 0.00 -2.10 0.00 0.00 70.33 69.10 3mvs n THR 15 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 3mvs s TYR 16 N 0.54 -0.21 -0.22 4.78 -0.85 -1.20 -4.59 117.35 115.61 3mvs s TYR 16 Ca 0.00 -0.04 -0.00 0.00 -0.52 0.00 0.00 57.07 56.51 3mvs s TYR 16 Cb 0.00 0.61 0.03 0.00 0.38 0.00 0.00 41.96 42.97 3mvs s TYR 16 CO 0.00 -0.73 -0.11 -1.17 -1.52 0.00 0.00 175.55 172.01 3mvs s LEU 17 N -2.79 2.85 -0.22 -3.49 2.96 0.35 -4.64 118.68 113.70 3mvs s LEU 17 Ca 0.10 -0.85 -0.16 0.00 -0.22 0.00 0.00 54.13 53.00 3mvs s LEU 17 Cb -0.01 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 45.05 3mvs s LEU 17 CO -0.02 -0.09 0.41 -0.22 -1.32 0.00 0.00 176.35 175.12 3mvs s LEU 18 N 1.29 4.13 -0.13 -0.68 2.96 -1.26 -1.42 118.68 123.57 3mvs s LEU 18 Ca 0.01 0.49 0.01 0.00 -0.22 0.00 0.00 54.13 54.42 3mvs s LEU 18 Cb -0.16 -2.52 0.02 0.00 0.50 0.00 0.00 46.19 44.03 3mvs s LEU 18 CO -0.07 -0.12 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.06 3mvs s ILE 19 N 1.54 1.52 0.34 6.68 1.01 -0.16 -4.95 121.20 127.17 3mvs s ILE 19 Ca 0.19 -0.62 -0.29 0.00 0.00 0.00 0.00 60.65 59.93 3mvs s ILE 19 Cb -0.15 -1.42 -0.11 0.00 0.01 0.00 0.00 42.46 40.80 3mvs s ILE 19 CO 0.08 0.45 1.38 -0.55 0.00 0.00 0.00 174.94 176.30 3mvs s SER 20 N 1.29 6.62 0.39 3.58 0.15 -1.26 -0.65 113.70 123.80 3mvs s SER 20 Ca 0.00 2.81 0.28 0.00 0.70 0.00 0.00 55.95 59.74 3mvs s SER 20 Cb -0.14 -2.65 1.30 0.00 -1.71 0.00 0.00 66.02 62.82 3mvs s SER 20 CO -0.07 -0.66 1.84 1.05 1.20 0.00 0.00 173.24 176.60 3mvs h GLU 21 N 3.38 0.00 -0.12 5.44 4.11 -1.39 -1.97 114.58 124.02 3mvs h GLU 21 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 3mvs h GLU 21 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 3mvs h GLU 21 CO 0.66 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.34 3mvs n ASP 22 N -2.52 0.78 -4.67 3.06 5.75 -1.26 -4.49 116.55 113.20 3mvs n ASP 22 Ca 0.00 -1.81 -0.42 0.00 -0.01 0.00 0.00 54.79 52.55 3mvs n ASP 22 Cb 0.17 -0.08 -0.03 0.00 -1.03 0.00 0.00 41.12 40.15 3mvs n ASP 22 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3mvs s THR 23 N -1.84 2.88 0.38 2.12 2.01 -0.74 -4.93 115.64 115.51 3mvs s THR 23 Ca 0.18 0.07 -0.27 0.00 0.31 0.00 0.00 61.69 61.99 3mvs s THR 23 Cb 0.09 -3.05 -0.09 0.00 0.01 0.00 0.00 72.50 69.47 3mvs s THR 23 CO 0.14 -0.00 1.25 -2.84 -0.69 0.00 0.00 174.62 172.48 3mvs s PRO 24 N 3.84 4.13 0.32 4.92 0.02 -1.26 -4.77 135.00 142.19 3mvs s PRO 24 Ca 0.85 2.06 -0.29 0.00 0.02 0.00 0.00 61.00 63.64 3mvs s PRO 24 Cb -0.43 -2.84 -0.12 0.00 0.02 0.00 0.00 34.50 31.13 3mvs s PRO 24 CO 0.39 -0.33 1.35 0.28 -0.33 0.00 0.00 177.00 178.37 3mvs n VAL 25 N 0.34 1.70 0.00 3.83 0.31 -1.26 -1.41 118.33 121.83 3mvs n VAL 25 Ca 0.03 -0.42 0.00 0.00 -0.01 0.00 0.00 64.34 63.93 3mvs n VAL 25 Cb 0.44 -1.61 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 3mvs n VAL 25 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3mvs n GLY 26 N 1.16 1.84 3.79 2.92 0.00 0.49 -5.00 105.19 110.38 3mvs n GLY 26 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 3mvs n GLY 26 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mvs s SER 27 N -2.11 6.88 0.34 1.61 0.01 -0.50 -4.75 113.70 115.18 3mvs s SER 27 Ca 0.00 1.95 -0.26 0.00 1.31 0.00 0.00 55.95 58.95 3mvs s SER 27 Cb 0.00 -2.58 -0.09 0.00 0.21 0.00 0.00 66.02 63.56 3mvs s SER 27 CO 0.00 -0.40 1.00 -0.94 0.41 0.00 0.00 173.24 173.31 3mvs s SER 28 N -1.67 7.16 -0.10 2.44 1.04 -1.26 -1.48 113.70 119.84 3mvs s SER 28 Ca 0.57 1.97 0.12 0.00 0.48 0.00 0.00 55.95 59.09 3mvs s SER 28 Cb -0.19 -2.59 -0.18 0.00 0.10 0.00 0.00 66.02 63.16 3mvs s SER 28 CO 0.25 -0.20 0.12 1.33 0.98 0.00 0.00 173.24 175.72 3mvs n VAL 29 N 0.50 0.64 -3.91 5.02 0.24 0.76 -4.93 118.33 116.66 3mvs n VAL 29 Ca 0.02 -0.49 -0.01 0.00 -2.04 0.00 0.00 64.34 61.83 3mvs n VAL 29 Cb 0.49 -0.42 0.02 0.00 -1.47 0.00 0.00 33.84 32.45 3mvs n VAL 29 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 3mvs n THR 30 N -2.34 0.00 -4.32 3.34 5.66 -1.23 -5.03 114.28 110.36 3mvs n THR 30 Ca -0.16 -0.36 -0.28 0.00 -3.05 0.00 0.00 64.05 60.20 3mvs n THR 30 Cb 0.77 0.62 -0.17 0.00 -1.55 0.00 0.00 70.33 70.00 3mvs n THR 30 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 3mvs s GLN 31 N -2.03 2.03 0.26 1.09 0.74 -1.26 -1.27 119.66 119.22 3mvs s GLN 31 Ca 0.23 -0.48 -0.30 0.00 0.05 0.00 0.00 55.36 54.86 3mvs s GLN 31 Cb -0.02 -1.79 -0.10 0.00 1.10 0.00 0.00 33.01 32.20 3mvs s GLN 31 CO 0.03 -0.11 1.41 -0.51 -0.55 0.00 0.00 175.29 175.55 3mvs s LEU 32 N 1.14 4.39 -0.04 3.68 1.43 0.44 -4.94 118.68 124.78 3mvs s LEU 32 Ca -0.04 2.66 0.05 0.00 -1.03 0.00 0.00 54.13 55.77 3mvs s LEU 32 Cb -0.14 -3.63 -0.00 0.00 0.03 0.00 0.00 46.19 42.44 3mvs s LEU 32 CO -0.03 -0.66 -0.18 -0.76 0.23 0.00 0.00 176.35 174.95 3mvs s LEU 33 N -0.68 1.93 0.07 1.79 1.43 -1.26 -4.56 118.68 117.41 3mvs s LEU 33 Ca 0.57 -0.37 -0.09 0.00 -1.03 0.00 0.00 54.13 53.21 3mvs s LEU 33 Cb -0.41 -1.00 0.00 0.00 0.03 0.00 0.00 46.19 44.81 3mvs s LEU 33 CO 0.45 0.16 0.20 0.00 0.23 0.00 0.00 176.35 177.40 3mvs s ALA 34 N -0.00 -0.29 -0.03 4.21 0.00 -1.26 -0.64 121.76 123.74 3mvs s ALA 34 Ca -0.03 -0.49 0.04 0.00 0.00 0.00 0.00 51.96 51.48 3mvs s ALA 34 Cb -0.11 0.43 -0.01 0.00 0.00 0.00 0.00 23.12 23.43 3mvs s ALA 34 CO 0.02 -0.47 -0.16 0.50 0.00 0.00 0.00 175.76 175.66 3mvs s ARG 35 N -3.46 1.46 -0.15 0.00 6.06 -0.23 -4.94 118.95 117.69 3mvs s ARG 35 Ca 0.02 -0.56 0.00 0.00 -2.50 0.00 0.00 55.73 52.69 3mvs s ARG 35 Cb 0.03 -1.34 0.02 0.00 0.06 0.00 0.00 34.95 33.73 3mvs s ARG 35 CO -0.09 0.28 -0.14 0.34 -2.50 0.00 0.00 175.30 173.19 3mvs s ASP 36 N -0.14 2.72 0.18 -2.12 2.15 -1.26 -1.21 116.67 116.98 3mvs s ASP 36 Ca 0.01 -0.51 0.21 0.00 0.43 0.00 0.00 52.55 52.69 3mvs s ASP 36 Cb -0.09 -1.17 0.86 0.00 -0.30 0.00 0.00 42.92 42.23 3mvs s ASP 36 CO 0.01 -0.06 1.63 0.23 -0.17 0.00 0.00 175.17 176.80 3mvs n MET 37 N 4.77 0.13 0.00 4.34 2.81 -1.26 -0.46 117.12 127.46 3mvs n MET 37 Ca -0.17 0.37 0.14 0.00 -1.81 0.00 0.00 57.70 56.23 3mvs n MET 37 Cb 0.50 -1.75 0.58 0.00 -0.71 0.00 0.00 33.22 31.83 3mvs n MET 37 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3mvs n ASP 38 N -2.00 0.98 -1.85 7.83 8.00 -1.26 -4.94 116.55 123.31 3mvs n ASP 38 Ca 0.03 -1.12 -0.17 0.00 0.71 0.00 0.00 54.79 54.23 3mvs n ASP 38 Cb 0.21 0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.30 3mvs n ASP 38 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3mvs n ASN 39 N -0.39 -5.03 -4.77 -2.24 3.02 0.40 -4.98 115.26 101.26 3mvs n ASN 39 Ca 0.17 0.05 -0.37 0.00 -0.03 0.00 0.00 54.58 54.41 3mvs n ASN 39 Cb 0.30 -4.11 -0.01 0.00 -0.61 0.00 0.00 39.78 35.35 3mvs n ASN 39 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 3mvs s ASP 40 N -2.32 6.12 0.46 6.41 1.01 -1.26 -5.00 116.67 122.08 3mvs s ASP 40 Ca 0.00 2.30 -0.25 0.00 0.71 0.00 0.00 52.55 55.31 3mvs s ASP 40 Cb 0.00 -2.60 -0.08 0.00 1.01 0.00 0.00 42.92 41.25 3mvs s ASP 40 CO 0.00 -0.95 1.35 -2.84 0.21 0.00 0.00 175.17 172.94 3mvs s PRO 41 N -2.76 3.66 0.18 8.23 0.02 -1.26 -4.84 135.00 138.23 3mvs s PRO 41 Ca 0.64 2.25 0.10 0.00 0.02 0.00 0.00 61.00 64.01 3mvs s PRO 41 Cb -0.28 -2.58 -0.04 0.00 0.02 0.00 0.00 34.50 31.61 3mvs s PRO 41 CO 0.34 -0.77 -0.17 -0.51 -0.33 0.00 0.00 177.00 175.56 3mvs s LEU 42 N -2.82 2.69 -0.08 -5.54 1.43 -1.26 -4.35 118.68 108.75 3mvs s LEU 42 Ca 0.62 -0.70 0.02 0.00 -1.03 0.00 0.00 54.13 53.04 3mvs s LEU 42 Cb -0.40 -1.43 0.01 0.00 0.03 0.00 0.00 46.19 44.41 3mvs s LEU 42 CO 0.50 0.12 -0.14 -0.69 0.23 0.00 0.00 176.35 176.38 3mvs s VAL 43 N -1.61 1.30 0.08 -1.59 1.01 0.20 -4.70 120.40 115.10 3mvs s VAL 43 Ca 0.22 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.67 3mvs s VAL 43 Cb -0.09 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 3mvs s VAL 43 CO 0.12 0.39 0.05 -0.36 0.00 0.00 0.00 175.10 175.30 3mvs s PHE 44 N 0.71 3.12 0.27 5.22 0.08 0.17 -0.76 117.98 126.79 3mvs s PHE 44 Ca -0.13 0.05 -0.07 0.00 0.12 0.00 0.00 56.93 56.89 3mvs s PHE 44 Cb -0.16 -1.60 0.03 0.00 -0.57 0.00 0.00 43.02 40.72 3mvs s PHE 44 CO 0.03 0.51 0.49 0.41 -0.10 0.00 0.00 175.22 176.56 3mvs n GLY 45 N 0.54 1.65 3.07 4.36 0.00 -0.44 -4.16 105.19 110.21 3mvs n GLY 45 Ca -0.10 -1.30 -0.23 0.00 0.00 0.00 0.00 46.02 44.40 3mvs n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mvs s VAL 46 N -2.48 1.06 -0.17 1.61 0.11 -1.26 -0.94 120.40 118.33 3mvs s VAL 46 Ca 0.14 -0.53 0.01 0.00 -2.93 0.00 0.00 61.98 58.67 3mvs s VAL 46 Cb -0.03 -0.92 0.01 0.00 -1.53 0.00 0.00 36.38 33.92 3mvs s VAL 46 CO 0.10 0.31 -0.19 -0.55 -3.33 0.00 0.00 175.10 171.45 3mvs s SER 47 N -0.00 3.25 0.00 3.54 0.15 0.01 -4.89 113.70 115.77 3mvs s SER 47 Ca -0.01 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.03 3mvs s SER 47 Cb -0.08 -1.50 0.00 0.00 -1.71 0.00 0.00 66.02 62.73 3mvs s SER 47 CO 0.01 0.02 0.00 0.61 1.20 0.00 0.00 173.24 175.08 3mvs n GLY 48 N 4.49 3.55 0.24 9.45 0.00 -1.26 -3.65 105.19 118.01 3mvs n GLY 48 Ca -0.20 -1.59 -0.15 0.00 0.00 0.00 0.00 46.02 44.08 3mvs n GLY 48 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3mvs h GLU 49 N 0.00 -0.51 -0.34 1.61 9.09 -1.99 -1.64 114.58 120.81 3mvs h GLU 49 Ca 0.00 0.03 -0.04 0.00 0.05 0.00 0.00 59.36 59.41 3mvs h GLU 49 Cb 0.00 0.12 -0.01 0.00 -1.65 0.00 0.00 28.75 27.20 3mvs h GLU 49 CO 0.00 -0.25 0.06 0.93 0.05 0.00 0.00 179.01 179.80 3mvs h GLU 50 N -0.71 0.56 -0.91 1.06 3.07 -1.98 -2.41 114.58 113.27 3mvs h GLU 50 Ca -0.05 -0.15 0.07 0.00 -0.50 0.00 0.00 59.36 58.73 3mvs h GLU 50 Cb 0.50 -0.07 -0.07 0.00 -0.84 0.00 0.00 28.75 28.28 3mvs h GLU 50 CO 0.09 0.63 0.57 0.00 -1.40 0.00 0.00 179.01 178.90 3mvs h ALA 51 N 0.90 1.27 0.00 3.43 0.00 -1.87 -1.70 119.26 121.29 3mvs h ALA 51 Ca 0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 3mvs h ALA 51 Cb 0.34 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.88 3mvs h ALA 51 CO 0.01 0.32 -0.09 0.66 0.00 0.00 0.00 179.25 180.14 3mvs h SER 52 N 1.03 0.00 -0.01 0.00 4.64 -1.07 -0.11 113.55 118.03 3mvs h SER 52 Ca 0.40 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.60 3mvs h SER 52 Cb 0.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 3mvs h SER 52 CO -0.18 0.09 -0.35 -0.09 -0.87 0.00 0.00 176.83 175.43 3mvs h ARG 53 N 0.00 0.49 0.00 4.77 9.65 -0.81 -3.33 114.38 125.15 3mvs h ARG 53 Ca -0.00 -0.23 -0.31 0.00 -1.10 0.00 0.00 59.98 58.34 3mvs h ARG 53 Cb 0.74 -0.01 -0.06 0.00 -1.39 0.00 0.00 29.97 29.25 3mvs h ARG 53 CO 0.01 0.78 -2.11 1.19 2.80 0.00 0.00 179.97 182.64 3mvs n PHE 54 N -4.06 0.35 -4.97 2.20 3.72 -1.01 -4.27 117.46 109.41 3mvs n PHE 54 Ca -0.01 0.12 -0.27 0.00 -0.05 0.00 0.00 57.45 57.24 3mvs n PHE 54 Cb 0.47 -1.03 -0.16 0.00 -0.94 0.00 0.00 39.48 37.83 3mvs n PHE 54 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 3mvs s PHE 55 N -2.61 1.84 0.06 1.38 0.08 -0.09 -0.38 117.98 118.27 3mvs s PHE 55 Ca -0.08 -0.41 0.05 0.00 0.12 0.00 0.00 56.93 56.61 3mvs s PHE 55 Cb 0.07 -1.20 -0.04 0.00 -0.57 0.00 0.00 43.02 41.29 3mvs s PHE 55 CO 0.83 -0.08 -0.07 0.00 -0.10 0.00 0.00 175.22 175.80 3mvs s ALA 56 N -0.32 3.02 -0.10 5.36 0.00 -0.13 -4.36 121.76 125.23 3mvs s ALA 56 Ca 0.04 -1.14 0.02 0.00 0.00 0.00 0.00 51.96 50.88 3mvs s ALA 56 Cb -0.09 -1.03 0.01 0.00 0.00 0.00 0.00 23.12 22.02 3mvs s ALA 56 CO 0.00 0.64 -0.16 0.08 0.00 0.00 0.00 175.76 176.33 3mvs s VAL 57 N -1.14 1.51 -0.06 0.00 1.01 -1.26 -0.68 120.40 119.78 3mvs s VAL 57 Ca 0.20 -0.66 -0.30 0.00 0.00 0.00 0.00 61.98 61.23 3mvs s VAL 57 Cb -0.11 -1.37 -0.05 0.00 0.00 0.00 0.00 36.38 34.84 3mvs s VAL 57 CO 0.12 0.44 1.66 -1.61 0.00 0.00 0.00 175.10 175.71 3mvs s GLU 58 N 0.91 4.16 0.33 2.72 2.02 0.05 -4.85 118.70 124.03 3mvs s GLU 58 Ca -0.08 2.17 0.04 0.00 0.02 0.00 0.00 54.97 57.12 3mvs s GLU 58 Cb -0.15 -3.99 0.58 0.00 0.10 0.00 0.00 34.13 30.66 3mvs s GLU 58 CO -0.00 -0.87 1.85 -1.00 0.02 0.00 0.00 175.26 175.25 3mvs h PRO 59 N 9.63 0.49 -0.00 0.39 0.13 -1.91 0.52 132.00 141.26 3mvs h PRO 59 Ca -0.39 -0.12 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 3mvs h PRO 59 Cb 1.18 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.24 3mvs h PRO 59 CO 0.96 0.57 -0.21 -0.40 -0.23 0.00 0.00 178.00 178.68 3mvs n ASP 60 N -4.25 0.23 0.00 1.44 5.75 -1.26 -0.65 116.55 117.81 3mvs n ASP 60 Ca 0.01 0.14 0.00 0.00 -0.01 0.00 0.00 54.79 54.93 3mvs n ASP 60 Cb 0.28 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 3mvs n ASP 60 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 3mvs n THR 61 N -1.48 0.00 -0.79 2.12 -1.04 -1.05 -4.97 114.28 107.07 3mvs n THR 61 Ca 0.07 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 3mvs n THR 61 Cb 0.34 -0.66 0.00 0.00 -1.82 0.00 0.00 70.33 68.19 3mvs n THR 61 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3mvs n GLY 62 N 2.16 0.79 3.72 3.41 0.00 0.15 -4.65 105.19 110.78 3mvs n GLY 62 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3mvs n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3mvs s VAL 63 N -3.03 2.70 -0.20 1.61 1.01 -1.26 -0.42 120.40 120.81 3mvs s VAL 63 Ca 0.00 0.52 -0.07 0.00 0.00 0.00 0.00 61.98 62.43 3mvs s VAL 63 Cb 0.00 -3.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 3mvs s VAL 63 CO 0.00 0.05 0.06 -0.69 0.00 0.00 0.00 175.10 174.52 3mvs s VAL 64 N 0.83 4.56 0.15 2.92 1.01 -0.40 -0.77 120.40 128.70 3mvs s VAL 64 Ca 0.67 -0.11 0.06 0.00 0.00 0.00 0.00 61.98 62.60 3mvs s VAL 64 Cb -0.43 -3.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 3mvs s VAL 64 CO 0.34 0.42 -0.13 -1.66 0.00 0.00 0.00 175.10 174.08 3mvs s TRP 65 N 0.74 1.41 -0.18 5.22 1.48 0.15 -0.17 118.94 127.60 3mvs s TRP 65 Ca 0.03 -0.63 -0.24 0.00 -1.06 0.00 0.00 56.10 54.19 3mvs s TRP 65 Cb -0.13 -0.71 -0.02 0.00 -1.16 0.00 0.00 33.47 31.45 3mvs s TRP 65 CO 0.02 0.17 0.78 -1.17 -4.06 0.00 0.00 176.95 172.69 3mvs s LEU 66 N -2.89 4.17 -0.05 -4.66 2.96 -0.55 -0.95 118.68 116.71 3mvs s LEU 66 Ca 0.14 1.09 0.17 0.00 -0.22 0.00 0.00 54.13 55.32 3mvs s LEU 66 Cb -0.01 -3.15 -0.21 0.00 0.50 0.00 0.00 46.19 43.31 3mvs s LEU 66 CO 0.03 -0.37 0.53 0.54 -1.32 0.00 0.00 176.35 175.76 3mvs n ARG 67 N 5.19 0.65 -3.91 1.98 1.74 0.49 -0.38 116.66 122.42 3mvs n ARG 67 Ca 0.03 0.12 -0.10 0.00 -0.77 0.00 0.00 57.85 57.13 3mvs n ARG 67 Cb 0.49 -1.69 -0.10 0.00 -1.02 0.00 0.00 32.46 30.14 3mvs n ARG 67 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 3mvs s GLN 68 N -2.79 0.40 0.44 5.56 -1.52 -1.25 -4.87 119.66 115.64 3mvs s GLN 68 Ca -0.06 -0.44 -0.25 0.00 -1.95 0.00 0.00 55.36 52.65 3mvs s GLN 68 Cb 0.08 0.16 -0.08 0.00 -0.22 0.00 0.00 33.01 32.95 3mvs s GLN 68 CO 0.83 -0.09 1.38 -2.14 -0.25 0.00 0.00 175.29 175.02 3mvs s PRO 69 N -1.33 3.74 0.32 2.91 0.02 -1.26 -4.89 135.00 134.51 3mvs s PRO 69 Ca -0.14 2.31 -0.12 0.00 0.02 0.00 0.00 61.00 63.06 3mvs s PRO 69 Cb -0.08 -2.66 -0.08 0.00 0.02 0.00 0.00 34.50 31.71 3mvs s PRO 69 CO 0.01 -0.73 0.69 -0.51 -0.33 0.00 0.00 177.00 176.13 3mvs s LEU 70 N -2.69 4.03 -0.23 -5.54 1.43 -1.26 -5.08 118.68 109.35 3mvs s LEU 70 Ca 0.60 1.14 -0.03 0.00 -1.03 0.00 0.00 54.13 54.81 3mvs s LEU 70 Cb -0.41 -3.96 0.10 0.00 0.03 0.00 0.00 46.19 41.95 3mvs s LEU 70 CO 0.53 -0.22 0.21 -0.62 0.23 0.00 0.00 176.35 176.48 3mvs s ASP 71 N -2.52 1.86 0.44 2.29 2.15 -1.26 -4.82 116.67 114.80 3mvs s ASP 71 Ca 0.52 -0.53 0.13 0.00 0.43 0.00 0.00 52.55 53.10 3mvs s ASP 71 Cb -0.10 0.23 1.03 0.00 -0.30 0.00 0.00 42.92 43.77 3mvs s ASP 71 CO 0.22 -0.36 2.01 -0.09 -0.17 0.00 0.00 175.17 176.77 3mvs h ARG 72 N 8.33 0.38 0.00 4.34 1.12 -1.87 -0.88 114.38 125.81 3mvs h ARG 72 Ca -0.16 -0.02 0.00 0.00 -1.11 0.00 0.00 59.98 58.68 3mvs h ARG 72 Cb 1.12 -0.09 0.00 0.00 -0.01 0.00 0.00 29.97 30.99 3mvs h ARG 72 CO 0.32 0.25 0.00 0.39 -3.11 0.00 0.00 179.97 177.82 3mvs n GLU 73 N -4.47 0.14 -0.11 0.20 4.71 -1.26 -3.68 120.64 116.18 3mvs n GLU 73 Ca 0.08 0.33 -0.22 0.00 -0.01 0.00 0.00 57.16 57.33 3mvs n GLU 73 Cb 0.31 -1.75 -0.08 0.00 -1.01 0.00 0.00 31.44 28.91 3mvs n GLU 73 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 3mvs n THR 74 N -2.01 1.16 -3.64 2.62 -1.04 -0.44 -5.02 114.28 105.91 3mvs n THR 74 Ca 0.03 -0.31 -0.09 0.00 -2.04 0.00 0.00 64.05 61.65 3mvs n THR 74 Cb 0.25 -1.75 -0.09 0.00 -1.82 0.00 0.00 70.33 66.91 3mvs n THR 74 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 3mvs s LYS 75 N -2.39 0.32 0.00 -2.82 2.36 -0.56 -5.05 119.74 111.60 3mvs s LYS 75 Ca -0.29 1.01 0.13 0.00 -2.55 0.00 0.00 55.97 54.27 3mvs s LYS 75 Cb 0.11 0.29 -0.09 0.00 -1.05 0.00 0.00 37.83 37.10 3mvs s LYS 75 CO 0.38 -0.27 0.65 -1.13 1.55 0.00 0.00 175.35 176.53 3mvs n SER 76 N 5.39 0.97 -3.73 1.43 3.41 -1.25 -4.27 113.62 115.56 3mvs n SER 76 Ca -0.08 -0.99 -0.13 0.00 -0.26 0.00 0.00 58.87 57.41 3mvs n SER 76 Cb 0.49 0.78 -0.10 0.00 -0.26 0.00 0.00 64.21 65.13 3mvs n SER 76 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 3mvs s GLU 77 N -2.02 0.53 0.23 4.33 4.04 -1.26 -0.68 118.70 123.87 3mvs s GLU 77 Ca 0.08 0.41 -0.22 0.00 0.04 0.00 0.00 54.97 55.28 3mvs s GLU 77 Cb 0.10 0.25 0.05 0.00 0.02 0.00 0.00 34.13 34.56 3mvs s GLU 77 CO 0.46 -0.09 0.86 -0.59 -1.84 0.00 0.00 175.26 174.06 3mvs s PHE 78 N -0.13 -0.10 0.07 4.83 -0.12 -0.57 -5.02 117.98 116.94 3mvs s PHE 78 Ca -0.03 -0.32 0.07 0.00 -0.05 0.00 0.00 56.93 56.60 3mvs s PHE 78 Cb -0.03 0.70 -0.04 0.00 -0.63 0.00 0.00 43.02 43.02 3mvs s PHE 78 CO 0.02 -1.08 -0.15 0.99 -0.05 0.00 0.00 175.22 174.95 3mvs s THR 79 N -3.30 3.05 0.24 -4.49 2.01 -1.26 -0.22 115.64 111.67 3mvs s THR 79 Ca 0.13 -1.22 0.03 0.00 0.31 0.00 0.00 61.69 60.95 3mvs s THR 79 Cb -0.04 -2.35 -0.05 0.00 0.01 0.00 0.00 72.50 70.07 3mvs s THR 79 CO 0.05 0.24 0.01 0.68 -0.69 0.00 0.00 174.62 174.92 3mvs s VAL 80 N -1.05 1.01 -0.06 3.82 -7.23 -0.57 -4.81 120.40 111.51 3mvs s VAL 80 Ca 0.17 -2.03 0.05 0.00 -1.81 0.00 0.00 61.98 58.37 3mvs s VAL 80 Cb -0.11 -2.42 -0.01 0.00 0.56 0.00 0.00 36.38 34.41 3mvs s VAL 80 CO 0.08 -0.26 -0.23 -1.61 -0.31 0.00 0.00 175.10 172.78 3mvs s GLU 81 N -3.88 2.45 0.19 4.82 2.02 -1.24 -0.84 118.70 122.22 3mvs s GLU 81 Ca 0.30 -0.82 0.07 0.00 0.02 0.00 0.00 54.97 54.54 3mvs s GLU 81 Cb 0.06 -2.03 -0.04 0.00 0.10 0.00 0.00 34.13 32.22 3mvs s GLU 81 CO 0.10 0.30 0.04 -0.06 0.02 0.00 0.00 175.26 175.66 3mvs s PHE 82 N 0.00 2.90 0.11 1.61 0.08 -0.34 -0.81 117.98 121.55 3mvs s PHE 82 Ca -0.07 -0.12 0.07 0.00 0.12 0.00 0.00 56.93 56.93 3mvs s PHE 82 Cb -0.14 -1.38 -0.04 0.00 -0.57 0.00 0.00 43.02 40.89 3mvs s PHE 82 CO 0.04 0.53 -0.17 -1.54 -0.10 0.00 0.00 175.22 173.98 3mvs s SER 83 N -3.13 2.23 -0.06 1.36 1.04 -0.11 -0.82 113.70 114.20 3mvs s SER 83 Ca 0.29 -0.74 -0.05 0.00 0.48 0.00 0.00 55.95 55.93 3mvs s SER 83 Cb -0.09 -0.10 0.02 0.00 0.10 0.00 0.00 66.02 65.95 3mvs s SER 83 CO 0.20 -0.05 0.15 0.54 0.98 0.00 0.00 173.24 175.06 3mvs s VAL 84 N -1.64 -0.01 0.06 5.02 0.11 -0.71 -1.32 120.40 121.90 3mvs s VAL 84 Ca 0.07 0.04 0.05 0.00 -2.93 0.00 0.00 61.98 59.21 3mvs s VAL 84 Cb -0.08 -0.22 -0.03 0.00 -1.53 0.00 0.00 36.38 34.53 3mvs s VAL 84 CO 0.04 0.02 -0.13 -0.55 -3.33 0.00 0.00 175.10 171.15 3mvs s SER 85 N 0.35 1.54 -0.26 3.54 0.15 0.06 -1.39 113.70 117.70 3mvs s SER 85 Ca -0.02 -0.57 0.13 0.00 0.70 0.00 0.00 55.95 56.18 3mvs s SER 85 Cb -0.04 -0.05 0.70 0.00 -1.71 0.00 0.00 66.02 64.92 3mvs s SER 85 CO -0.01 -0.07 1.67 -0.90 1.20 0.00 0.00 173.24 175.12 3mvs n ASP 86 N 1.44 4.67 0.00 5.45 5.68 -1.10 -0.62 116.55 132.07 3mvs n ASP 86 Ca -0.21 -3.14 0.00 0.00 -0.50 0.00 0.00 54.79 50.94 3mvs n ASP 86 Cb 0.54 -0.67 0.00 0.00 -1.14 0.00 0.00 41.12 39.85 3mvs n ASP 86 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3mvs n HIS 87 N -0.11 0.00 -0.04 2.11 8.25 -1.26 -4.76 115.22 119.41 3mvs n HIS 87 Ca 0.32 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.69 3mvs n HIS 87 Cb 1.19 -0.40 -0.03 0.00 1.12 0.00 0.00 29.99 31.87 3mvs n HIS 87 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 3mvs n GLN 88 N -2.00 0.24 -3.53 -0.41 6.02 -1.26 -5.09 117.38 111.34 3mvs n GLN 88 Ca 0.00 0.10 -0.16 0.00 -0.01 0.00 0.00 57.00 56.93 3mvs n GLN 88 Cb 0.00 -0.90 -0.05 0.00 1.02 0.00 0.00 30.24 30.31 3mvs n GLN 88 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3mvs n GLY 89 N 2.44 3.52 3.24 1.08 0.00 -1.26 -5.17 105.19 109.03 3mvs n GLY 89 Ca -0.15 -2.02 -0.13 0.00 0.00 0.00 0.00 46.02 43.72 3mvs n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3mvs s VAL 90 N -2.57 0.00 0.10 1.61 0.11 -1.26 -2.72 120.40 115.67 3mvs s VAL 90 Ca 0.15 -0.03 0.07 0.00 -2.93 0.00 0.00 61.98 59.24 3mvs s VAL 90 Cb 0.01 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.32 3mvs s VAL 90 CO 0.10 -0.02 -0.11 0.27 -3.33 0.00 0.00 175.10 172.02 3mvs s ILE 91 N 0.09 3.29 -0.01 7.04 -4.36 -0.48 -4.99 121.20 121.78 3mvs s ILE 91 Ca -0.01 -1.27 0.06 0.00 -0.26 0.00 0.00 60.65 59.16 3mvs s ILE 91 Cb -0.03 -2.53 -0.02 0.00 1.25 0.00 0.00 42.46 41.14 3mvs s ILE 91 CO 0.01 0.13 -0.18 0.42 0.24 0.00 0.00 174.94 175.56 3mvs s THR 92 N -1.19 1.44 -0.01 8.37 -4.23 -1.26 -1.74 115.64 117.01 3mvs s THR 92 Ca 0.20 -0.82 -0.01 0.00 -1.18 0.00 0.00 61.69 59.89 3mvs s THR 92 Cb -0.11 -1.20 0.01 0.00 1.34 0.00 0.00 72.50 72.54 3mvs s THR 92 CO 0.13 0.37 0.03 -0.13 -0.54 0.00 0.00 174.62 174.47 3mvs s ARG 93 N -0.52 0.02 0.32 3.99 1.81 -0.01 -4.96 118.95 119.60 3mvs s ARG 93 Ca 0.07 0.07 -0.26 0.00 -1.72 0.00 0.00 55.73 53.89 3mvs s ARG 93 Cb -0.07 -0.04 -0.10 0.00 -0.45 0.00 0.00 34.95 34.29 3mvs s ARG 93 CO -0.00 -0.04 0.95 0.15 -0.68 0.00 0.00 175.30 175.68 3mvs s LYS 94 N 0.26 4.59 -0.03 3.54 3.01 -1.26 -1.19 119.74 128.65 3mvs s LYS 94 Ca -0.02 1.36 0.03 0.00 -1.01 0.00 0.00 55.97 56.33 3mvs s LYS 94 Cb -0.03 -2.83 -0.00 0.00 -1.01 0.00 0.00 37.83 33.96 3mvs s LYS 94 CO -0.01 0.28 -0.13 0.54 0.51 0.00 0.00 175.35 176.54 3mvs s VAL 95 N -1.58 1.06 -0.14 3.17 0.11 -0.02 -4.81 120.40 118.20 3mvs s VAL 95 Ca 0.50 -0.52 -0.27 0.00 -2.93 0.00 0.00 61.98 58.76 3mvs s VAL 95 Cb -0.20 -0.92 -0.01 0.00 -1.53 0.00 0.00 36.38 33.72 3mvs s VAL 95 CO 0.25 0.32 0.89 0.20 -3.33 0.00 0.00 175.10 173.43 3mvs s ASN 96 N 0.07 7.07 -0.18 3.54 0.01 -1.26 -1.51 114.94 122.67 3mvs s ASN 96 Ca -0.02 1.31 -0.07 0.00 -0.71 0.00 0.00 52.86 53.37 3mvs s ASN 96 Cb -0.09 -2.49 -0.04 0.00 0.41 0.00 0.00 41.25 39.04 3mvs s ASN 96 CO 0.01 -0.40 0.04 -0.63 -1.51 0.00 0.00 177.10 174.61 3mvs s ILE 97 N 2.04 4.56 -0.09 0.60 -1.09 0.69 -0.49 121.20 127.42 3mvs s ILE 97 Ca 0.42 -0.11 0.01 0.00 -2.23 0.00 0.00 60.65 58.74 3mvs s ILE 97 Cb -0.17 -3.05 -0.02 0.00 -1.58 0.00 0.00 42.46 37.63 3mvs s ILE 97 CO 0.15 0.46 -0.12 -1.58 -1.23 0.00 0.00 174.94 172.62 3mvs s GLN 98 N 0.45 2.99 -0.22 2.79 0.74 -0.50 -1.52 119.66 124.39 3mvs s GLN 98 Ca 0.02 -0.65 -0.17 0.00 0.05 0.00 0.00 55.36 54.61 3mvs s GLN 98 Cb -0.13 -2.56 -0.03 0.00 1.10 0.00 0.00 33.01 31.39 3mvs s GLN 98 CO 0.01 0.44 0.45 0.08 -0.55 0.00 0.00 175.29 175.73 3mvs s VAL 99 N -0.24 5.14 0.16 1.34 1.01 0.14 -0.99 120.40 126.96 3mvs s VAL 99 Ca 0.02 0.80 -0.27 0.00 0.00 0.00 0.00 61.98 62.52 3mvs s VAL 99 Cb -0.13 -3.78 -0.08 0.00 0.00 0.00 0.00 36.38 32.39 3mvs s VAL 99 CO 0.03 0.18 0.84 -0.83 0.00 0.00 0.00 175.10 175.33 3mvs s GLY 100 N 1.25 2.97 0.29 4.51 0.00 0.17 -4.86 107.32 111.66 3mvs s GLY 100 Ca 0.20 0.45 -0.28 0.00 0.00 0.00 0.00 44.72 45.10 3mvs s GLY 100 CO 0.09 1.06 0.95 -0.35 0.00 0.00 0.00 173.10 174.85 3mvs s ASP 101 N -0.87 7.43 0.30 1.64 2.15 -1.26 -1.01 116.67 125.06 3mvs s ASP 101 Ca 0.39 1.90 0.05 0.00 0.43 0.00 0.00 52.55 55.32 3mvs s ASP 101 Cb -0.24 -2.59 -0.06 0.00 -0.30 0.00 0.00 42.92 39.73 3mvs s ASP 101 CO 0.28 -0.00 0.00 0.68 -0.17 0.00 0.00 175.17 175.96 3mvs s VAL 102 N -1.44 1.42 -0.80 1.11 -7.23 -1.26 -4.88 120.40 107.31 3mvs s VAL 102 Ca 0.47 -2.05 -0.25 0.00 -1.81 0.00 0.00 61.98 58.34 3mvs s VAL 102 Cb -0.22 -2.63 0.05 0.00 0.56 0.00 0.00 36.38 34.14 3mvs s VAL 102 CO 0.27 -0.15 1.26 0.21 -0.31 0.00 0.00 175.10 176.39 3mvs s ASN 103 N -3.47 6.27 0.00 4.85 2.47 -1.26 -4.72 114.94 119.08 3mvs s ASN 103 Ca 0.33 -0.86 0.00 0.00 0.42 0.00 0.00 52.86 52.75 3mvs s ASN 103 Cb 0.07 -2.53 0.00 0.00 -1.45 0.00 0.00 41.25 37.33 3mvs s ASN 103 CO 0.14 -1.66 0.80 -0.90 -3.72 0.00 0.00 177.10 171.76 3mvs n ASP 104 N 8.86 1.24 -4.27 -4.21 5.75 -1.26 -4.98 116.55 117.68 3mvs n ASP 104 Ca 0.10 -1.61 -0.31 0.00 -0.01 0.00 0.00 54.79 52.96 3mvs n ASP 104 Cb 0.49 0.00 -0.16 0.00 -1.03 0.00 0.00 41.12 40.42 3mvs n ASP 104 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 3mvs s ASN 105 N -0.61 3.04 0.58 -1.12 0.01 -1.26 -5.13 114.94 110.44 3mvs s ASN 105 Ca 0.00 -0.50 -0.06 0.00 -0.71 0.00 0.00 52.86 51.59 3mvs s ASN 105 Cb 0.00 -0.79 0.01 0.00 0.41 0.00 0.00 41.25 40.88 3mvs s ASN 105 CO 0.00 0.25 0.89 0.00 -1.51 0.00 0.00 177.10 176.73 3mvs s ALA 106 N -0.20 3.32 0.59 0.60 0.00 -1.26 -4.82 121.76 120.00 3mvs s ALA 106 Ca -0.02 -0.70 -0.19 0.00 0.00 0.00 0.00 51.96 51.05 3mvs s ALA 106 Cb -0.13 -2.59 -0.03 0.00 0.00 0.00 0.00 23.12 20.36 3mvs s ALA 106 CO 0.03 -0.76 1.22 -2.14 0.00 0.00 0.00 175.76 174.11 3mvs s PRO 107 N -4.96 2.95 -0.18 0.00 0.02 -1.26 -4.85 135.00 126.72 3mvs s PRO 107 Ca 0.53 1.86 -0.01 0.00 0.02 0.00 0.00 61.00 63.40 3mvs s PRO 107 Cb -0.10 -1.94 -0.00 0.00 0.02 0.00 0.00 34.50 32.48 3mvs s PRO 107 CO 0.45 -1.23 -0.11 0.99 -0.33 0.00 0.00 177.00 176.76 3mvs s THR 108 N -1.56 2.91 0.39 0.99 2.01 0.04 -4.66 115.64 115.76 3mvs s THR 108 Ca 0.78 -0.67 -0.24 0.00 0.31 0.00 0.00 61.69 61.87 3mvs s THR 108 Cb -0.31 -2.27 -0.09 0.00 0.01 0.00 0.00 72.50 69.83 3mvs s THR 108 CO 0.34 0.49 1.01 -0.36 -0.69 0.00 0.00 174.62 175.40 3mvs s PHE 109 N 1.04 3.35 0.09 4.92 0.08 -1.26 -1.49 117.98 124.72 3mvs s PHE 109 Ca -0.01 1.67 0.09 0.00 0.12 0.00 0.00 56.93 58.80 3mvs s PHE 109 Cb -0.15 -3.03 -0.04 0.00 -0.57 0.00 0.00 43.02 39.24 3mvs s PHE 109 CO -0.02 -0.36 -0.21 -1.01 -0.10 0.00 0.00 175.22 173.52 3mvs s HIS 110 N -1.75 2.47 -1.08 0.36 3.76 0.33 -4.72 115.29 114.66 3mvs s HIS 110 Ca 0.57 -0.30 0.00 0.00 -0.15 0.00 0.00 55.06 55.18 3mvs s HIS 110 Cb -0.19 -1.36 0.00 0.00 1.11 0.00 0.00 32.58 32.14 3mvs s HIS 110 CO 0.24 0.32 0.00 0.09 -0.85 0.00 0.00 174.74 174.54 3mvs n ASN 111 N 1.11 -3.96 -4.78 1.40 3.02 -1.26 -4.56 115.26 106.23 3mvs n ASN 111 Ca -0.16 0.06 -0.33 0.00 -0.03 0.00 0.00 54.58 54.12 3mvs n ASN 111 Cb 0.53 -3.03 0.04 0.00 -0.61 0.00 0.00 39.78 36.71 3mvs n ASN 111 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3mvs s GLN 112 N -4.26 2.88 0.53 3.52 -0.21 -1.26 -4.48 119.66 116.37 3mvs s GLN 112 Ca 0.00 1.28 -0.18 0.00 0.02 0.00 0.00 55.36 56.48 3mvs s GLN 112 Cb 0.00 -1.97 -0.07 0.00 1.00 0.00 0.00 33.01 31.97 3mvs s GLN 112 CO 0.00 -1.17 1.03 -1.25 -2.12 0.00 0.00 175.29 171.78 3mvs s PRO 113 N -4.26 3.67 -0.27 2.91 0.04 -1.26 -5.15 135.00 130.68 3mvs s PRO 113 Ca 0.65 1.23 -0.11 0.00 0.04 0.00 0.00 61.00 62.80 3mvs s PRO 113 Cb -0.18 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 3mvs s PRO 113 CO 0.43 -0.52 0.20 0.71 0.04 0.00 0.00 177.00 177.86 3mvs s TYR 114 N -2.26 3.25 -0.04 0.56 2.02 -1.26 -5.07 117.35 114.55 3mvs s TYR 114 Ca 0.64 0.17 -0.18 0.00 -0.37 0.00 0.00 57.07 57.34 3mvs s TYR 114 Cb -0.15 -2.37 0.03 0.00 -0.40 0.00 0.00 41.96 39.08 3mvs s TYR 114 CO 0.27 -0.10 0.40 0.45 -1.57 0.00 0.00 175.55 175.00 3mvs s SER 115 N 1.56 -0.32 -0.14 2.29 0.15 -1.26 -1.47 113.70 114.52 3mvs s SER 115 Ca 0.08 0.30 -0.15 0.00 0.70 0.00 0.00 55.95 56.88 3mvs s SER 115 Cb -0.15 0.42 0.04 0.00 -1.71 0.00 0.00 66.02 64.62 3mvs s SER 115 CO 0.09 -0.45 0.42 0.54 1.20 0.00 0.00 173.24 175.05 3mvs s VAL 116 N -1.12 0.01 -0.18 4.45 0.11 -0.31 -4.96 120.40 118.40 3mvs s VAL 116 Ca -0.12 -0.06 -0.09 0.00 -2.93 0.00 0.00 61.98 58.79 3mvs s VAL 116 Cb -0.04 -0.62 -0.05 0.00 -1.53 0.00 0.00 36.38 34.15 3mvs s VAL 116 CO 0.05 -0.04 0.11 -0.60 -3.33 0.00 0.00 175.10 171.29 3mvs s ARG 117 N -0.04 3.99 0.02 1.54 3.52 -1.26 -0.32 118.95 126.41 3mvs s ARG 117 Ca -0.02 -0.25 0.01 0.00 -0.13 0.00 0.00 55.73 55.34 3mvs s ARG 117 Cb -0.03 -3.31 -0.02 0.00 -1.56 0.00 0.00 34.95 30.03 3mvs s ARG 117 CO 0.01 0.37 -0.05 0.96 -0.81 0.00 0.00 175.30 175.79 3mvs s ILE 118 N 0.12 0.31 0.53 4.11 -4.36 -0.11 -4.96 121.20 116.84 3mvs s ILE 118 Ca 0.08 -0.77 -0.21 0.00 -0.26 0.00 0.00 60.65 59.49 3mvs s ILE 118 Cb -0.12 -0.38 -0.05 0.00 1.25 0.00 0.00 42.46 43.16 3mvs s ILE 118 CO -0.00 -0.31 1.20 -2.84 0.24 0.00 0.00 174.94 173.22 3mvs s PRO 119 N -1.15 3.34 0.60 0.37 0.02 -1.26 -0.82 135.00 136.10 3mvs s PRO 119 Ca -0.09 1.82 0.40 0.00 0.02 0.00 0.00 61.00 63.14 3mvs s PRO 119 Cb -0.08 -2.14 2.06 0.00 0.02 0.00 0.00 34.50 34.36 3mvs s PRO 119 CO -0.00 -0.91 2.21 1.05 -0.33 0.00 0.00 177.00 179.02 3mvs h GLU 120 N 1.41 0.00 -0.64 5.54 4.11 -1.63 -1.58 114.58 121.80 3mvs h GLU 120 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.93 3mvs h GLU 120 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 3mvs h GLU 120 CO 0.57 0.00 0.00 0.27 0.07 0.00 0.00 179.01 179.92 3mvs n ASN 121 N -2.99 5.07 -4.69 3.06 6.94 -1.26 -3.83 115.26 117.57 3mvs n ASN 121 Ca -0.02 -2.77 -0.43 0.00 -0.02 0.00 0.00 54.58 51.33 3mvs n ASN 121 Cb 0.12 -0.65 -0.03 0.00 -2.36 0.00 0.00 39.78 36.86 3mvs n ASN 121 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 3mvs n THR 122 N 0.59 0.36 -1.98 5.53 -1.04 -0.60 -4.90 114.28 112.24 3mvs n THR 122 Ca 0.24 -0.06 -0.41 0.00 -2.04 0.00 0.00 64.05 61.78 3mvs n THR 122 Cb 1.05 -2.03 -0.01 0.00 -1.82 0.00 0.00 70.33 67.52 3mvs n THR 122 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3mvs s PRO 123 N 2.72 4.25 0.26 -2.82 0.02 -1.26 -4.74 135.00 133.43 3mvs s PRO 123 Ca 0.83 2.36 -0.30 0.00 0.02 0.00 0.00 61.00 63.91 3mvs s PRO 123 Cb -0.53 -3.03 -0.13 0.00 0.02 0.00 0.00 34.50 30.82 3mvs s PRO 123 CO 0.39 -0.34 1.33 0.28 -0.33 0.00 0.00 177.00 178.33 3mvs n VAL 124 N 0.80 1.25 0.00 3.83 0.31 -1.26 -1.92 118.33 121.33 3mvs n VAL 124 Ca 0.01 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 64.03 3mvs n VAL 124 Cb 0.41 -1.41 0.00 0.00 -0.91 0.00 0.00 33.84 31.93 3mvs n VAL 124 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3mvs n GLY 125 N 1.78 2.09 3.71 2.92 0.00 0.48 -5.01 105.19 111.16 3mvs n GLY 125 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 3mvs n GLY 125 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3mvs s THR 126 N -2.46 4.02 0.22 2.61 2.01 -0.81 -4.73 115.64 116.50 3mvs s THR 126 Ca 0.00 1.43 -0.30 0.00 0.31 0.00 0.00 61.69 63.13 3mvs s THR 126 Cb 0.00 -3.92 -0.08 0.00 0.01 0.00 0.00 72.50 68.51 3mvs s THR 126 CO 0.00 0.08 1.05 -2.16 -0.69 0.00 0.00 174.62 172.90 3mvs s PRO 127 N 1.42 4.68 0.00 4.92 0.04 -1.26 -1.65 135.00 143.15 3mvs s PRO 127 Ca 0.59 1.68 0.00 0.00 0.04 0.00 0.00 61.00 63.31 3mvs s PRO 127 Cb -0.29 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.00 3mvs s PRO 127 CO 0.27 0.23 0.00 0.44 0.04 0.00 0.00 177.00 177.99 3mvs n ILE 128 N 1.79 0.00 -3.47 0.56 -5.35 0.43 -4.98 119.36 108.34 3mvs n ILE 128 Ca 0.00 -0.12 -0.12 0.00 -0.27 0.00 0.00 62.75 62.24 3mvs n ILE 128 Cb 0.46 0.60 -0.03 0.00 -1.74 0.00 0.00 39.64 38.93 3mvs n ILE 128 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 3mvs s PHE 129 N -0.85 -0.49 -0.12 4.28 5.36 -1.23 -4.99 117.98 119.94 3mvs s PHE 129 Ca 0.00 0.45 -0.01 0.00 -0.96 0.00 0.00 56.93 56.41 3mvs s PHE 129 Cb 0.00 0.52 0.04 0.00 -0.34 0.00 0.00 43.02 43.24 3mvs s PHE 129 CO 0.00 -0.68 -0.01 0.42 -1.46 0.00 0.00 175.22 173.49 3mvs s ILE 130 N -2.93 0.65 0.61 3.12 1.01 -1.26 -0.57 121.20 121.82 3mvs s ILE 130 Ca -0.00 -0.22 -0.07 0.00 0.00 0.00 0.00 60.65 60.36 3mvs s ILE 130 Cb -0.01 -0.85 0.01 0.00 0.01 0.00 0.00 42.46 41.62 3mvs s ILE 130 CO -0.07 0.16 0.93 0.68 0.00 0.00 0.00 174.94 176.65 3mvs s VAL 131 N 1.84 3.62 -0.15 2.92 -7.23 -0.46 -4.99 120.40 115.95 3mvs s VAL 131 Ca 0.03 0.08 -0.06 0.00 -1.81 0.00 0.00 61.98 60.22 3mvs s VAL 131 Cb -0.14 -3.45 0.07 0.00 0.56 0.00 0.00 36.38 33.42 3mvs s VAL 131 CO -0.07 -0.49 0.32 0.21 -0.31 0.00 0.00 175.10 174.77 3mvs s ASN 132 N -4.31 -0.03 0.11 4.85 3.84 -1.26 -4.65 114.94 113.47 3mvs s ASN 132 Ca 0.55 0.73 0.03 0.00 0.21 0.00 0.00 52.86 54.38 3mvs s ASN 132 Cb -0.11 0.84 -0.04 0.00 -0.55 0.00 0.00 41.25 41.40 3mvs s ASN 132 CO 0.46 -0.22 -0.09 0.00 -2.79 0.00 0.00 177.10 174.46 3mvs s ALA 133 N 2.14 1.16 0.21 1.71 0.00 -1.26 -0.52 121.76 125.20 3mvs s ALA 133 Ca -0.03 -1.29 0.02 0.00 0.00 0.00 0.00 51.96 50.66 3mvs s ALA 133 Cb -0.11 0.06 -0.05 0.00 0.00 0.00 0.00 23.12 23.02 3mvs s ALA 133 CO -0.10 -0.09 0.05 0.95 0.00 0.00 0.00 175.76 176.56 3mvs s THR 134 N -2.88 0.61 -0.18 0.00 -4.23 -0.55 -4.92 115.64 103.49 3mvs s THR 134 Ca 0.09 -1.99 -0.08 0.00 -1.18 0.00 0.00 61.69 58.53 3mvs s THR 134 Cb 0.00 -2.37 0.07 0.00 1.34 0.00 0.00 72.50 71.55 3mvs s THR 134 CO -0.01 -0.25 0.41 -0.62 -0.54 0.00 0.00 174.62 173.61 3mvs s ASP 135 N -3.24 -0.36 0.00 3.99 -1.08 -1.26 -0.78 116.67 113.94 3mvs s ASP 135 Ca 0.31 0.92 0.27 0.00 -0.52 0.00 0.00 52.55 53.53 3mvs s ASP 135 Cb 0.07 1.01 0.96 0.00 -1.46 0.00 0.00 42.92 43.50 3mvs s ASP 135 CO 0.09 -0.21 1.70 -0.81 0.52 0.00 0.00 175.17 176.45 3mvs n PRO 136 N 4.80 0.60 -1.26 4.34 -0.04 -1.26 -4.60 135.00 137.58 3mvs n PRO 136 Ca -0.16 -0.28 -0.32 0.00 -0.04 0.00 0.00 63.50 62.70 3mvs n PRO 136 Cb 0.52 -1.49 0.10 0.00 -0.04 0.00 0.00 33.50 32.59 3mvs n PRO 136 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3mvs s ASP 137 N -2.59 4.18 0.49 3.54 1.01 -1.26 -4.95 116.67 117.09 3mvs s ASP 137 Ca 0.24 2.06 -0.14 0.00 0.71 0.00 0.00 52.55 55.42 3mvs s ASP 137 Cb 0.19 -2.55 -0.07 0.00 1.01 0.00 0.00 42.92 41.50 3mvs s ASP 137 CO 0.52 -2.26 0.92 -0.76 0.21 0.00 0.00 175.17 173.80 3mvs s LEU 138 N -5.71 3.66 0.00 1.23 1.43 -1.26 -2.93 118.68 115.10 3mvs s LEU 138 Ca 0.66 1.40 0.00 0.00 -1.03 0.00 0.00 54.13 55.17 3mvs s LEU 138 Cb -0.22 -4.33 0.00 0.00 0.03 0.00 0.00 46.19 41.67 3mvs s LEU 138 CO 0.51 -0.55 0.00 0.61 0.23 0.00 0.00 176.35 177.15 3mvs n GLY 139 N -1.61 2.91 0.25 -3.19 0.00 -1.26 -2.65 105.19 99.64 3mvs n GLY 139 Ca 0.05 -0.38 0.08 0.00 0.00 0.00 0.00 46.02 45.77 3mvs n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3mvs h ALA 140 N -0.96 1.80 0.00 4.61 0.00 -1.91 0.11 119.26 122.91 3mvs h ALA 140 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3mvs h ALA 140 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3mvs h ALA 140 CO 0.00 0.09 0.00 0.41 0.00 0.00 0.00 179.25 179.75 3mvs n GLY 141 N -1.27 -0.99 0.73 0.00 0.00 -1.09 -1.65 105.19 100.92 3mvs n GLY 141 Ca -0.03 0.03 0.09 0.00 0.00 0.00 0.00 46.02 46.11 3mvs n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3mvs n GLY 142 N -0.37 0.48 3.69 -0.02 0.00 0.02 -4.44 105.19 104.56 3mvs n GLY 142 Ca 0.02 -0.52 -0.38 0.00 0.00 0.00 0.00 46.02 45.14 3mvs n GLY 142 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3mvs s SER 143 N -1.47 6.47 -0.11 1.61 0.01 -0.84 -4.34 113.70 115.03 3mvs s SER 143 Ca 0.22 0.55 -0.01 0.00 1.31 0.00 0.00 55.95 58.02 3mvs s SER 143 Cb 0.15 -2.22 -0.03 0.00 0.21 0.00 0.00 66.02 64.13 3mvs s SER 143 CO 0.23 -0.02 -0.07 -0.69 0.41 0.00 0.00 173.24 173.11 3mvs s VAL 144 N 0.98 3.69 -0.04 3.43 1.01 -1.26 -1.81 120.40 126.40 3mvs s VAL 144 Ca 0.19 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.78 3mvs s VAL 144 Cb -0.14 -2.55 -0.02 0.00 0.00 0.00 0.00 36.38 33.66 3mvs s VAL 144 CO 0.07 0.55 -0.22 -0.76 0.00 0.00 0.00 175.10 174.74 3mvs s LEU 145 N -0.25 2.28 0.03 3.92 1.43 -0.22 -4.74 118.68 121.12 3mvs s LEU 145 Ca 0.03 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 3mvs s LEU 145 Cb -0.13 -1.42 -0.04 0.00 0.03 0.00 0.00 46.19 44.64 3mvs s LEU 145 CO 0.03 0.31 0.07 -0.31 0.23 0.00 0.00 176.35 176.68 3mvs s TYR 146 N -0.57 3.22 0.12 0.29 2.02 0.14 -1.41 117.35 121.16 3mvs s TYR 146 Ca 0.08 0.14 -0.21 0.00 -0.37 0.00 0.00 57.07 56.71 3mvs s TYR 146 Cb -0.11 -1.68 0.06 0.00 -0.40 0.00 0.00 41.96 39.83 3mvs s TYR 146 CO 0.00 0.53 0.53 -1.54 -1.57 0.00 0.00 175.55 173.50 3mvs s SER 147 N -2.01 -0.44 0.20 2.29 1.04 -0.47 -4.04 113.70 110.27 3mvs s SER 147 Ca 0.25 -0.04 -0.20 0.00 0.48 0.00 0.00 55.95 56.44 3mvs s SER 147 Cb -0.12 0.54 -0.08 0.00 0.10 0.00 0.00 66.02 66.46 3mvs s SER 147 CO 0.17 -0.87 0.72 -0.36 0.98 0.00 0.00 173.24 173.88 3mvs s PHE 148 N -3.42 3.70 -0.21 5.02 0.08 -1.26 -0.39 117.98 121.51 3mvs s PHE 148 Ca -0.00 1.42 0.00 0.00 0.12 0.00 0.00 56.93 58.47 3mvs s PHE 148 Cb -0.00 -2.63 0.05 0.00 -0.57 0.00 0.00 43.02 39.87 3mvs s PHE 148 CO -0.10 0.38 -0.07 -1.14 -0.10 0.00 0.00 175.22 174.20 3mvs s GLN 149 N -1.79 1.68 1.11 0.44 0.74 -0.03 -2.85 119.66 118.96 3mvs s GLN 149 Ca 0.41 -0.81 -0.16 0.00 0.05 0.00 0.00 55.36 54.84 3mvs s GLN 149 Cb -0.18 -2.38 0.24 0.00 1.10 0.00 0.00 33.01 31.79 3mvs s GLN 149 CO 0.22 -0.50 1.12 -1.25 -0.55 0.00 0.00 175.29 174.32 3mvs s PRO 150 N 1.47 -0.46 0.33 1.67 0.04 -1.26 -4.29 135.00 132.50 3mvs s PRO 150 Ca -0.03 0.10 -0.28 0.00 0.04 0.00 0.00 61.00 60.84 3mvs s PRO 150 Cb -0.17 -1.67 -0.13 0.00 0.04 0.00 0.00 34.50 32.57 3mvs s PRO 150 CO -0.07 -3.24 1.19 -2.30 0.04 0.00 0.00 177.00 172.62 3mvs n PRO 151 N -4.46 1.85 -3.70 0.56 -0.02 -1.13 -4.96 135.00 123.15 3mvs n PRO 151 Ca 0.10 0.65 -0.37 0.00 -2.02 0.00 0.00 63.50 61.86 3mvs n PRO 151 Cb 0.59 -2.17 -0.06 0.00 -0.02 0.00 0.00 33.50 31.83 3mvs n PRO 151 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3mvs s SER 152 N -0.42 6.57 0.00 2.55 0.15 -1.26 -4.98 113.70 116.32 3mvs s SER 152 Ca 0.57 0.69 0.30 0.00 0.70 0.00 0.00 55.95 58.21 3mvs s SER 152 Cb -0.60 -2.15 1.58 0.00 -1.71 0.00 0.00 66.02 63.13 3mvs s SER 152 CO 0.61 0.36 2.04 -0.81 1.20 0.00 0.00 173.24 176.64 3mvs n PRO 153 N 1.99 1.16 -0.02 5.44 -0.04 -1.26 -3.94 135.00 138.33 3mvs n PRO 153 Ca -0.17 -0.31 0.01 0.00 -0.04 0.00 0.00 63.50 62.99 3mvs n PRO 153 Cb 0.54 -1.49 -0.08 0.00 -0.04 0.00 0.00 33.50 32.42 3mvs n PRO 153 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3mvs n PHE 154 N -0.65 0.00 -3.97 0.54 3.01 -1.26 -4.23 117.46 110.90 3mvs n PHE 154 Ca 0.21 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.53 3mvs n PHE 154 Cb 0.20 -0.35 -0.15 0.00 -0.01 0.00 0.00 39.48 39.17 3mvs n PHE 154 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 3mvs s PHE 155 N -2.54 0.22 0.19 1.38 0.08 -1.25 -0.62 117.98 115.44 3mvs s PHE 155 Ca -0.04 -0.02 0.05 0.00 0.12 0.00 0.00 56.93 57.04 3mvs s PHE 155 Cb 0.05 -0.21 -0.04 0.00 -0.57 0.00 0.00 43.02 42.26 3mvs s PHE 155 CO 0.44 -0.04 0.20 0.00 -0.10 0.00 0.00 175.22 175.72 3mvs s ALA 156 N 0.29 3.69 -0.03 5.36 0.00 -0.14 -4.27 121.76 126.66 3mvs s ALA 156 Ca -0.03 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.70 3mvs s ALA 156 Cb -0.05 -1.47 0.03 0.00 0.00 0.00 0.00 23.12 21.63 3mvs s ALA 156 CO -0.01 0.41 0.00 -1.50 0.00 0.00 0.00 175.76 174.67 3mvs s ILE 157 N -1.87 0.13 -0.00 0.00 2.07 -1.26 -1.29 121.20 118.97 3mvs s ILE 157 Ca 0.32 0.10 -0.30 0.00 -1.41 0.00 0.00 60.65 59.36 3mvs s ILE 157 Cb -0.10 -0.23 -0.06 0.00 0.13 0.00 0.00 42.46 42.21 3mvs s ILE 157 CO 0.25 0.13 1.53 -0.62 -1.91 0.00 0.00 174.94 174.32 3mvs s ASP 158 N 0.96 6.74 0.47 4.50 -1.08 -0.23 -4.82 116.67 123.21 3mvs s ASP 158 Ca -0.09 2.22 0.24 0.00 -0.52 0.00 0.00 52.55 54.40 3mvs s ASP 158 Cb -0.13 -2.55 1.16 0.00 -1.46 0.00 0.00 42.92 39.94 3mvs s ASP 158 CO -0.02 -0.82 1.95 0.77 0.52 0.00 0.00 175.17 177.57 3mvs h SER 159 N 8.43 0.00 0.07 -0.34 4.64 -1.92 -0.38 113.55 124.06 3mvs h SER 159 Ca -0.39 0.00 -0.34 0.00 -0.47 0.00 0.00 61.79 60.59 3mvs h SER 159 Cb 1.18 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.24 3mvs h SER 159 CO 0.93 0.20 -1.92 0.00 -0.87 0.00 0.00 176.83 175.17 3mvs n ALA 160 N -2.30 0.95 0.13 5.18 0.00 -1.26 -0.69 120.51 122.52 3mvs n ALA 160 Ca -0.01 -0.66 0.11 0.00 0.00 0.00 0.00 53.44 52.88 3mvs n ALA 160 Cb 0.33 -0.53 -0.07 0.00 0.00 0.00 0.00 19.45 19.18 3mvs n ALA 160 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3mvs n ARG 161 N -3.73 0.58 -1.00 0.00 1.74 -1.19 -4.93 116.66 108.13 3mvs n ARG 161 Ca -0.35 -0.03 0.00 0.00 -0.77 0.00 0.00 57.85 56.70 3mvs n ARG 161 Cb 0.94 -1.67 0.00 0.00 -1.02 0.00 0.00 32.46 30.72 3mvs n ARG 161 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3mvs n GLY 162 N 1.24 0.52 3.69 -0.13 0.00 -0.16 -4.76 105.19 105.59 3mvs n GLY 162 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 3mvs n GLY 162 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3mvs s ILE 163 N -2.10 4.86 -0.17 -0.61 1.01 -1.26 -1.36 121.20 121.58 3mvs s ILE 163 Ca 0.00 1.83 -0.11 0.00 0.00 0.00 0.00 60.65 62.37 3mvs s ILE 163 Cb 0.00 -4.22 -0.05 0.00 0.01 0.00 0.00 42.46 38.20 3mvs s ILE 163 CO 0.00 0.06 0.21 -0.69 0.00 0.00 0.00 174.94 174.52 3mvs s VAL 164 N 1.78 5.37 0.11 2.92 1.01 0.26 -1.07 120.40 130.79 3mvs s VAL 164 Ca 0.44 0.36 0.08 0.00 0.00 0.00 0.00 61.98 62.86 3mvs s VAL 164 Cb -0.18 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 3mvs s VAL 164 CO 0.17 0.45 -0.21 0.42 0.00 0.00 0.00 175.10 175.94 3mvs s THR 165 N 0.16 1.75 0.02 3.92 -4.23 -0.41 -0.42 115.64 116.42 3mvs s THR 165 Ca 0.13 -1.62 -0.30 0.00 -1.18 0.00 0.00 61.69 58.72 3mvs s THR 165 Cb -0.12 -1.62 -0.04 0.00 1.34 0.00 0.00 72.50 72.06 3mvs s THR 165 CO 0.02 -0.10 1.02 -0.69 -0.54 0.00 0.00 174.62 174.32 3mvs s VAL 166 N -1.32 4.68 0.00 2.29 1.01 -0.66 -0.97 120.40 125.43 3mvs s VAL 166 Ca 0.08 1.95 0.00 0.00 0.00 0.00 0.00 61.98 64.01 3mvs s VAL 166 Cb -0.09 -4.25 0.00 0.00 0.00 0.00 0.00 36.38 32.04 3mvs s VAL 166 CO 0.05 0.16 0.40 2.30 0.00 0.00 0.00 175.10 178.02 3mvs n ILE 167 N 3.80 0.02 -3.79 2.22 -5.35 0.21 -0.39 119.36 116.08 3mvs n ILE 167 Ca 0.06 -0.40 -0.13 0.00 -0.27 0.00 0.00 62.75 62.02 3mvs n ILE 167 Cb 0.50 1.20 -0.10 0.00 -1.74 0.00 0.00 39.64 39.50 3mvs n ILE 167 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 3mvs s GLN 168 N -0.02 0.45 0.24 6.28 0.74 -1.23 -4.92 119.66 121.20 3mvs s GLN 168 Ca 0.00 0.06 -0.31 0.00 0.05 0.00 0.00 55.36 55.15 3mvs s GLN 168 Cb 0.00 0.20 -0.13 0.00 1.10 0.00 0.00 33.01 34.18 3mvs s GLN 168 CO 0.00 -0.09 1.42 -1.91 -0.55 0.00 0.00 175.29 174.15 3mvs n GLU 169 N 2.16 2.05 -2.83 1.67 2.13 -1.26 -4.86 120.64 119.70 3mvs n GLU 169 Ca -0.17 0.73 -0.25 0.00 0.66 0.00 0.00 57.16 58.13 3mvs n GLU 169 Cb 0.57 -2.40 0.01 0.00 0.27 0.00 0.00 31.44 29.89 3mvs n GLU 169 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3mvs s LEU 170 N 0.11 3.59 -0.28 4.31 1.43 -1.25 -5.10 118.68 121.50 3mvs s LEU 170 Ca 0.69 0.53 0.01 0.00 -1.03 0.00 0.00 54.13 54.33 3mvs s LEU 170 Cb -0.65 -3.41 0.17 0.00 0.03 0.00 0.00 46.19 42.33 3mvs s LEU 170 CO 0.49 -0.71 0.47 -0.62 0.23 0.00 0.00 176.35 176.21 3mvs s ASP 171 N -4.19 -0.38 0.38 2.29 2.15 -1.26 -4.77 116.67 110.89 3mvs s ASP 171 Ca 0.48 0.09 0.09 0.00 0.43 0.00 0.00 52.55 53.65 3mvs s ASP 171 Cb -0.10 1.49 0.84 0.00 -0.30 0.00 0.00 42.92 44.85 3mvs s ASP 171 CO 0.41 -0.31 1.94 0.22 -0.17 0.00 0.00 175.17 177.25 3mvs h TYR 172 N 8.10 0.68 0.00 -5.34 3.20 -1.89 0.01 116.97 121.74 3mvs h TYR 172 Ca -0.12 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.77 3mvs h TYR 172 Cb 1.15 -0.22 0.00 0.00 1.54 0.00 0.00 36.73 39.20 3mvs h TYR 172 CO 0.20 0.32 0.00 0.93 -1.64 0.00 0.00 178.16 177.98 3mvs h GLU 173 N 0.64 0.00 0.00 1.82 3.07 -1.98 -3.14 114.58 114.99 3mvs h GLU 173 Ca 0.34 0.00 -0.27 0.00 -0.50 0.00 0.00 59.36 58.93 3mvs h GLU 173 Cb 0.47 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.34 3mvs h GLU 173 CO -0.12 0.00 -1.86 0.28 -1.40 0.00 0.00 179.01 175.91 3mvs n VAL 174 N -2.43 1.41 -3.99 3.13 0.31 -0.15 -5.01 118.33 111.61 3mvs n VAL 174 Ca -0.00 -0.16 -0.22 0.00 -0.01 0.00 0.00 64.34 63.95 3mvs n VAL 174 Cb 0.14 -2.00 -0.17 0.00 -0.91 0.00 0.00 33.84 30.91 3mvs n VAL 174 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3mvs s THR 175 N -2.59 0.52 -0.44 2.52 2.01 -0.39 -5.02 115.64 112.25 3mvs s THR 175 Ca -0.32 -0.04 0.22 0.00 0.31 0.00 0.00 61.69 61.86 3mvs s THR 175 Cb 0.10 -0.60 -0.20 0.00 0.01 0.00 0.00 72.50 71.81 3mvs s THR 175 CO 0.42 0.25 0.82 0.00 -0.69 0.00 0.00 174.62 175.42 3mvs n GLN 176 N 4.56 0.40 -3.59 4.92 3.00 -1.25 -3.94 117.38 121.47 3mvs n GLN 176 Ca -0.17 -0.06 -0.15 0.00 -0.01 0.00 0.00 57.00 56.61 3mvs n GLN 176 Cb 0.50 -1.58 -0.07 0.00 0.00 0.00 0.00 30.24 29.10 3mvs n GLN 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3mvs s ALA 177 N -3.29 -1.76 -0.02 -1.58 0.00 -1.26 -1.15 121.76 112.70 3mvs s ALA 177 Ca 0.00 1.76 0.04 0.00 0.00 0.00 0.00 51.96 53.77 3mvs s ALA 177 Cb 0.14 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.48 3mvs s ALA 177 CO 0.85 -0.35 -0.13 0.71 0.00 0.00 0.00 175.76 176.84 3mvs s TYR 178 N -0.18 2.72 -0.33 0.00 2.02 0.38 -4.98 117.35 116.97 3mvs s TYR 178 Ca -0.04 -0.15 0.04 0.00 -0.37 0.00 0.00 57.07 56.55 3mvs s TYR 178 Cb -0.03 -1.60 0.10 0.00 -0.40 0.00 0.00 41.96 40.03 3mvs s TYR 178 CO 0.04 0.24 0.04 -0.65 -1.57 0.00 0.00 175.55 173.65 3mvs s GLN 179 N -0.99 1.52 -0.15 -0.62 -1.52 -1.26 -0.71 119.66 115.92 3mvs s GLN 179 Ca 0.13 -1.84 -0.12 0.00 -1.95 0.00 0.00 55.36 51.59 3mvs s GLN 179 Cb -0.11 -3.18 -0.05 0.00 -0.22 0.00 0.00 33.01 29.46 3mvs s GLN 179 CO 0.03 -0.92 0.23 -0.51 -0.25 0.00 0.00 175.29 173.87 3mvs s LEU 180 N 0.92 4.28 -0.26 2.90 1.02 0.06 -4.92 118.68 122.68 3mvs s LEU 180 Ca 0.10 0.47 -0.21 0.00 0.02 0.00 0.00 54.13 54.50 3mvs s LEU 180 Cb -0.19 -2.27 -0.01 0.00 0.02 0.00 0.00 46.19 43.74 3mvs s LEU 180 CO -0.08 0.19 0.69 -0.89 0.02 0.00 0.00 176.35 176.28 3mvs s THR 181 N 0.06 4.93 -0.16 5.49 2.01 -1.26 -0.57 115.64 126.14 3mvs s THR 181 Ca 0.15 1.21 -0.15 0.00 0.31 0.00 0.00 61.69 63.20 3mvs s THR 181 Cb -0.13 -4.00 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 3mvs s THR 181 CO 0.03 -0.03 0.35 -0.69 -0.69 0.00 0.00 174.62 173.58 3mvs s VAL 182 N 2.63 5.27 -0.21 3.82 1.01 0.66 -0.85 120.40 132.72 3mvs s VAL 182 Ca 0.28 0.65 -0.08 0.00 0.00 0.00 0.00 61.98 62.84 3mvs s VAL 182 Cb -0.15 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 3mvs s VAL 182 CO 0.09 0.35 0.08 0.21 0.00 0.00 0.00 175.10 175.83 3mvs s ASN 183 N 0.61 5.51 -0.21 3.32 3.84 0.48 -0.85 114.94 127.63 3mvs s ASN 183 Ca 0.19 -0.02 -0.05 0.00 0.21 0.00 0.00 52.86 53.19 3mvs s ASN 183 Cb -0.14 -1.96 -0.02 0.00 -0.55 0.00 0.00 41.25 38.58 3mvs s ASN 183 CO 0.06 0.09 -0.01 0.00 -2.79 0.00 0.00 177.10 174.44 3mvs s ALA 184 N 0.88 2.93 -0.04 1.71 0.00 -0.13 -1.36 121.76 125.74 3mvs s ALA 184 Ca 0.04 -1.09 0.04 0.00 0.00 0.00 0.00 51.96 50.95 3mvs s ALA 184 Cb -0.14 -1.77 -0.00 0.00 0.00 0.00 0.00 23.12 21.22 3mvs s ALA 184 CO 0.03 -0.32 -0.16 0.99 0.00 0.00 0.00 175.76 176.29 3mvs s THR 185 N 1.31 1.35 0.91 0.00 2.01 -0.50 -0.73 115.64 119.98 3mvs s THR 185 Ca 0.04 -0.66 -0.14 0.00 0.31 0.00 0.00 61.69 61.23 3mvs s THR 185 Cb -0.14 -1.17 0.15 0.00 0.01 0.00 0.00 72.50 71.35 3mvs s THR 185 CO -0.00 0.39 1.22 1.51 -0.69 0.00 0.00 174.62 177.05 3mvs s ASP 186 N 0.11 3.59 -0.19 3.53 1.47 -0.50 -1.06 116.67 123.62 3mvs s ASP 186 Ca -0.05 0.61 0.16 0.00 1.18 0.00 0.00 52.55 54.46 3mvs s ASP 186 Cb -0.12 -0.93 0.52 0.00 -0.34 0.00 0.00 42.92 42.05 3mvs s ASP 186 CO 0.02 -2.47 1.41 0.00 0.68 0.00 0.00 175.17 174.82 3mvs n GLN 187 N -3.65 2.74 -1.70 2.11 6.02 -0.66 -4.50 117.38 117.74 3mvs n GLN 187 Ca 0.11 -2.86 -0.43 0.00 -0.01 0.00 0.00 57.00 53.81 3mvs n GLN 187 Cb 0.60 -1.83 -0.02 0.00 1.02 0.00 0.00 30.24 30.01 3mvs n GLN 187 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 3mvs n ASP 188 N -0.62 3.27 0.14 1.08 2.03 -1.18 -4.59 116.55 116.69 3mvs n ASP 188 Ca 0.22 1.14 0.01 0.00 0.52 0.00 0.00 54.79 56.67 3mvs n ASP 188 Cb 0.89 -1.50 0.17 0.00 -0.72 0.00 0.00 41.12 39.96 3mvs n ASP 188 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 3mvs h LYS 189 N 4.67 0.00 0.00 -0.67 1.57 -1.94 -3.24 116.57 116.95 3mvs h LYS 189 Ca -0.46 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 57.97 3mvs h LYS 189 Cb 1.25 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.50 3mvs h LYS 189 CO 0.79 0.58 -2.35 -2.37 -0.57 0.00 0.00 179.45 175.53 3mvs n THR 190 N -3.58 1.36 -3.16 -0.16 5.66 -1.26 -4.82 114.28 108.31 3mvs n THR 190 Ca -0.00 -0.56 -0.23 0.00 -3.05 0.00 0.00 64.05 60.21 3mvs n THR 190 Cb 0.64 -1.23 -0.06 0.00 -1.55 0.00 0.00 70.33 68.13 3mvs n THR 190 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 3mvs n ARG 191 N -3.13 0.66 -2.00 1.09 3.00 -1.26 -5.13 116.66 109.89 3mvs n ARG 191 Ca -0.41 -3.06 -0.37 0.00 -0.00 0.00 0.00 57.85 54.02 3mvs n ARG 191 Cb 0.97 -1.29 0.03 0.00 0.00 0.00 0.00 32.46 32.17 3mvs n ARG 191 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 3mvs s PRO 192 N -0.85 3.12 0.06 -0.14 0.04 -1.22 -4.82 135.00 131.19 3mvs s PRO 192 Ca 0.34 1.91 0.08 0.00 0.04 0.00 0.00 61.00 63.37 3mvs s PRO 192 Cb 0.16 -2.07 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 3mvs s PRO 192 CO -0.13 -1.11 -0.22 -0.51 0.04 0.00 0.00 177.00 175.07 3mvs s LEU 193 N -3.80 2.20 0.13 -3.56 1.43 -1.26 -4.97 118.68 108.85 3mvs s LEU 193 Ca 0.74 -0.57 0.08 0.00 -1.03 0.00 0.00 54.13 53.35 3mvs s LEU 193 Cb -0.32 -1.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.82 3mvs s LEU 193 CO 0.36 0.17 -0.18 -0.44 0.23 0.00 0.00 176.35 176.49 3mvs s SER 194 N -1.35 2.49 0.01 2.29 0.01 -1.26 -1.41 113.70 114.48 3mvs s SER 194 Ca 0.09 -0.79 0.02 0.00 1.31 0.00 0.00 55.95 56.57 3mvs s SER 194 Cb -0.09 -0.13 -0.01 0.00 0.21 0.00 0.00 66.02 65.99 3mvs s SER 194 CO 0.02 -0.02 -0.05 -0.89 0.41 0.00 0.00 173.24 172.71 3mvs s THR 195 N -1.74 0.39 0.09 1.44 2.01 0.09 -4.77 115.64 113.14 3mvs s THR 195 Ca 0.11 -0.47 0.04 0.00 0.31 0.00 0.00 61.69 61.68 3mvs s THR 195 Cb -0.07 -0.38 -0.04 0.00 0.01 0.00 0.00 72.50 72.02 3mvs s THR 195 CO 0.05 -0.07 0.03 -0.76 -0.69 0.00 0.00 174.62 173.18 3mvs s LEU 196 N -0.59 3.59 0.02 4.42 1.43 -1.26 -0.96 118.68 125.34 3mvs s LEU 196 Ca -0.02 -0.11 -0.06 0.00 -1.03 0.00 0.00 54.13 52.90 3mvs s LEU 196 Cb -0.04 -2.31 -0.01 0.00 0.03 0.00 0.00 46.19 43.86 3mvs s LEU 196 CO -0.00 0.17 0.10 0.00 0.23 0.00 0.00 176.35 176.86 3mvs s ALA 197 N -1.34 -0.16 0.07 4.21 0.00 -0.03 -4.98 121.76 119.52 3mvs s ALA 197 Ca 0.27 -0.37 -0.13 0.00 0.00 0.00 0.00 51.96 51.73 3mvs s ALA 197 Cb -0.12 0.18 -0.06 0.00 0.00 0.00 0.00 23.12 23.12 3mvs s ALA 197 CO 0.20 -0.25 0.44 1.21 0.00 0.00 0.00 175.76 177.36 3mvs s ASN 198 N -1.74 6.76 -0.20 0.00 3.84 -1.26 -0.24 114.94 122.10 3mvs s ASN 198 Ca -0.10 0.94 0.01 0.00 0.21 0.00 0.00 52.86 53.91 3mvs s ASN 198 Cb -0.05 -2.24 0.04 0.00 -0.55 0.00 0.00 41.25 38.46 3mvs s ASN 198 CO -0.01 0.21 -0.13 -0.22 -2.79 0.00 0.00 177.10 174.16 3mvs s LEU 199 N -1.60 2.42 -0.15 3.21 2.96 0.26 -4.12 118.68 121.66 3mvs s LEU 199 Ca 0.31 -0.91 -0.20 0.00 -0.22 0.00 0.00 54.13 53.11 3mvs s LEU 199 Cb -0.15 -1.34 -0.03 0.00 0.50 0.00 0.00 46.19 45.16 3mvs s LEU 199 CO 0.17 -0.12 0.56 0.00 -1.32 0.00 0.00 176.35 175.64 3mvs s ALA 200 N 1.33 3.49 -0.27 5.97 0.00 -0.54 -0.76 121.76 130.98 3mvs s ALA 200 Ca -0.01 -0.22 0.01 0.00 0.00 0.00 0.00 51.96 51.73 3mvs s ALA 200 Cb -0.16 -2.83 0.05 0.00 0.00 0.00 0.00 23.12 20.18 3mvs s ALA 200 CO -0.09 -0.29 -0.07 0.42 0.00 0.00 0.00 175.76 175.74 3mvs s ILE 201 N 1.28 2.55 -0.20 0.00 1.01 0.11 -1.16 121.20 124.80 3mvs s ILE 201 Ca 0.28 -1.46 -0.14 0.00 0.00 0.00 0.00 60.65 59.33 3mvs s ILE 201 Cb -0.16 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 3mvs s ILE 201 CO 0.11 -0.02 0.33 -0.63 0.00 0.00 0.00 174.94 174.73 3mvs s ILE 202 N 1.19 5.26 -0.21 2.92 -1.09 0.57 -0.47 121.20 129.36 3mvs s ILE 202 Ca -0.06 0.58 -0.14 0.00 -2.23 0.00 0.00 60.65 58.79 3mvs s ILE 202 Cb -0.19 -3.66 -0.04 0.00 -1.58 0.00 0.00 42.46 36.98 3mvs s ILE 202 CO -0.04 0.31 0.33 -0.63 -1.23 0.00 0.00 174.94 173.68 3mvs s ILE 203 N 1.02 5.25 -0.09 2.92 -1.09 -0.30 -0.94 121.20 127.98 3mvs s ILE 203 Ca 0.16 0.55 -0.30 0.00 -2.23 0.00 0.00 60.65 58.84 3mvs s ILE 203 Cb -0.14 -3.66 -0.02 0.00 -1.58 0.00 0.00 42.46 37.06 3mvs s ILE 203 CO 0.06 0.28 1.02 -0.89 -1.23 0.00 0.00 174.94 174.18 3mvs s THR 204 N 1.23 4.76 -0.05 2.92 2.01 0.00 -4.85 115.64 121.65 3mvs s THR 204 Ca 0.16 2.01 -0.30 0.00 0.31 0.00 0.00 61.69 63.87 3mvs s THR 204 Cb -0.14 -4.29 -0.05 0.00 0.01 0.00 0.00 72.50 68.02 3mvs s THR 204 CO 0.07 0.03 1.50 -0.62 -0.69 0.00 0.00 174.62 174.90 3mvs s ASP 205 N 1.11 6.78 0.14 3.53 2.15 -1.26 -1.55 116.67 127.57 3mvs s ASP 205 Ca 0.49 2.10 0.03 0.00 0.43 0.00 0.00 52.55 55.61 3mvs s ASP 205 Cb -0.19 -2.54 -0.04 0.00 -0.30 0.00 0.00 42.92 39.85 3mvs s ASP 205 CO 0.20 -0.83 0.23 -0.04 -0.17 0.00 0.00 175.17 174.56 3mvs s MET 206 N 3.33 3.29 -1.09 4.34 -1.94 -1.26 -4.95 119.30 121.02 3mvs s MET 206 Ca 0.67 -0.65 -0.22 0.00 -1.71 0.00 0.00 55.69 53.78 3mvs s MET 206 Cb -0.31 -2.89 0.05 0.00 2.01 0.00 0.00 34.83 33.70 3mvs s MET 206 CO 0.26 0.52 1.53 -0.65 -0.01 0.00 0.00 175.02 176.67 3mvs s GLN 207 N -3.10 3.67 -0.15 2.03 -0.21 -1.26 -4.74 119.66 115.89 3mvs s GLN 207 Ca 0.34 -1.32 0.16 0.00 0.02 0.00 0.00 55.36 54.55 3mvs s GLN 207 Cb -0.11 -5.40 0.43 0.00 1.00 0.00 0.00 33.01 28.93 3mvs s GLN 207 CO 0.27 -2.25 1.20 -0.40 -2.12 0.00 0.00 175.29 171.99 3mvs n ASP 208 N 8.87 1.68 -4.73 5.90 5.75 -1.26 -5.05 116.55 127.71 3mvs n ASP 208 Ca 0.37 -3.22 -0.42 0.00 -0.01 0.00 0.00 54.79 51.52 3mvs n ASP 208 Cb 0.50 -0.44 -0.02 0.00 -1.03 0.00 0.00 41.12 40.12 3mvs n ASP 208 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 3mvs s MET 209 N -2.24 4.18 0.00 0.11 1.75 -1.26 -5.22 119.30 116.62 3mvs s MET 209 Ca 0.37 2.47 0.30 0.00 -1.25 0.00 0.00 55.69 57.58 3mvs s MET 209 Cb 0.38 -3.09 1.79 0.00 2.84 0.00 0.00 34.83 36.75 3mvs s MET 209 CO -0.09 -0.61 2.12 -0.25 -0.65 0.00 0.00 175.02 175.54