#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hwo s ALA 14 N 0.00 3.35 0.26 -5.12 0.00 -1.26 -5.07 121.76 113.92 3hwo s ALA 14 Ca 0.00 0.59 0.09 0.00 0.00 0.00 0.00 51.96 52.64 3hwo s ALA 14 Cb 0.00 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 3hwo s ALA 14 CO 0.00 0.22 0.04 0.95 0.00 0.00 0.00 175.76 176.97 3hwo s THR 15 N -1.19 3.67 0.32 0.00 -4.23 -1.26 -5.10 115.64 107.85 3hwo s THR 15 Ca 0.41 -1.80 -0.29 0.00 -1.18 0.00 0.00 61.69 58.83 3hwo s THR 15 Cb -0.26 -2.97 -0.10 0.00 1.34 0.00 0.00 72.50 70.52 3hwo s THR 15 CO 0.31 -0.37 1.28 -0.22 -0.54 0.00 0.00 174.62 175.08 3hwo s LEU 16 N -3.71 4.44 0.35 4.79 2.96 -1.26 -4.99 118.68 121.26 3hwo s LEU 16 Ca 0.32 2.62 -0.25 0.00 -0.22 0.00 0.00 54.13 56.60 3hwo s LEU 16 Cb -0.07 -3.64 -0.10 0.00 0.50 0.00 0.00 46.19 42.88 3hwo s LEU 16 CO 0.21 -0.48 0.96 0.00 -1.32 0.00 0.00 176.35 175.72 3hwo s ALA 17 N -1.08 3.17 -0.90 5.97 0.00 -1.26 -4.03 121.76 123.62 3hwo s ALA 17 Ca 0.49 0.53 0.11 0.00 0.00 0.00 0.00 51.96 53.09 3hwo s ALA 17 Cb -0.39 -3.19 0.47 0.00 0.00 0.00 0.00 23.12 20.01 3hwo s ALA 17 CO 0.51 0.11 1.34 -0.35 0.00 0.00 0.00 175.76 177.36 3hwo n PRO 18 N 0.27 0.03 -0.71 0.00 -0.04 -1.26 -1.99 135.00 131.30 3hwo n PRO 18 Ca 0.03 0.38 0.08 0.00 -0.04 0.00 0.00 63.50 63.95 3hwo n PRO 18 Cb 0.51 -1.56 0.37 0.00 -0.04 0.00 0.00 33.50 32.77 3hwo n PRO 18 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3hwo n ASN 19 N -1.61 5.06 -4.54 3.54 6.94 -1.26 -4.36 115.26 119.03 3hwo n ASN 19 Ca 0.02 -2.70 -0.33 0.00 -0.02 0.00 0.00 54.58 51.55 3hwo n ASN 19 Cb 0.11 -0.61 -0.12 0.00 -2.36 0.00 0.00 39.78 36.80 3hwo n ASN 19 CO 0.00 0.00 0.00 -0.13 -1.03 0.00 0.00 177.26 176.10 3hwo s ARG 20 N -2.31 2.59 0.35 -3.83 0.52 -0.84 -4.65 118.95 110.78 3hwo s ARG 20 Ca 0.51 -0.66 -0.23 0.00 -0.52 0.00 0.00 55.73 54.83 3hwo s ARG 20 Cb 0.36 -2.48 -0.10 0.00 0.52 0.00 0.00 34.95 33.26 3hwo s ARG 20 CO 0.19 0.63 0.92 0.12 0.02 0.00 0.00 175.30 177.18 3hwo s PHE 21 N -0.83 3.55 -0.04 -0.53 5.36 -1.26 -4.33 117.98 119.90 3hwo s PHE 21 Ca 0.13 1.67 -0.04 0.00 -0.96 0.00 0.00 56.93 57.73 3hwo s PHE 21 Cb -0.11 -2.85 0.01 0.00 -0.34 0.00 0.00 43.02 39.73 3hwo s PHE 21 CO 0.02 0.12 0.11 0.12 -1.46 0.00 0.00 175.22 174.13 3hwo s PHE 22 N -1.80 -0.13 -0.13 10.12 2.19 -0.46 -1.42 117.98 126.35 3hwo s PHE 22 Ca 0.53 0.31 -0.05 0.00 0.33 0.00 0.00 56.93 58.06 3hwo s PHE 22 Cb -0.15 0.03 0.07 0.00 -1.31 0.00 0.00 43.02 41.66 3hwo s PHE 22 CO 0.20 -0.07 0.25 0.12 1.83 0.00 0.00 175.22 177.56 3hwo s PHE 23 N 0.13 -0.40 -0.19 10.12 5.36 -0.23 -2.00 117.98 130.77 3hwo s PHE 23 Ca -0.01 0.89 -0.00 0.00 -0.96 0.00 0.00 56.93 56.85 3hwo s PHE 23 Cb -0.01 -0.08 0.01 0.00 -0.34 0.00 0.00 43.02 42.60 3hwo s PHE 23 CO -0.00 -0.37 -0.15 1.41 -1.46 0.00 0.00 175.22 174.64 3hwo s MET 24 N 2.41 3.13 0.01 10.12 -2.45 -0.19 -1.48 119.30 130.83 3hwo s MET 24 Ca 0.02 -0.76 -0.19 0.00 -1.25 0.00 0.00 55.69 53.50 3hwo s MET 24 Cb -0.12 -2.69 0.04 0.00 1.25 0.00 0.00 34.83 33.30 3hwo s MET 24 CO -0.09 -0.17 0.43 0.45 1.05 0.00 0.00 175.02 176.69 3hwo s SER 25 N 1.27 -0.33 0.16 1.11 0.15 -1.26 -2.22 113.70 112.58 3hwo s SER 25 Ca 0.04 0.16 0.24 0.00 0.70 0.00 0.00 55.95 57.09 3hwo s SER 25 Cb -0.14 0.41 0.91 0.00 -1.71 0.00 0.00 66.02 65.50 3hwo s SER 25 CO -0.08 -0.59 1.74 -0.81 1.20 0.00 0.00 173.24 174.70 3hwo n PRO 26 N 0.82 0.16 0.00 5.44 -0.05 -1.26 -4.16 135.00 135.95 3hwo n PRO 26 Ca -0.20 0.25 0.00 0.00 -0.05 0.00 0.00 63.50 63.50 3hwo n PRO 26 Cb 0.58 -1.73 0.00 0.00 -0.05 0.00 0.00 33.50 32.30 3hwo n PRO 26 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 175.50 176.43 3hwo n TYR 27 N -2.02 0.00 -4.78 0.54 9.36 -1.26 -4.98 117.16 114.03 3hwo n TYR 27 Ca 0.04 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.95 3hwo n TYR 27 Cb 0.32 0.00 -0.17 0.00 -0.63 0.00 0.00 39.34 38.86 3hwo n TYR 27 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 3hwo s ARG 28 N 0.01 2.89 -0.23 2.98 0.52 -1.26 -5.11 118.95 118.76 3hwo s ARG 28 Ca 0.00 -0.81 -0.05 0.00 -0.52 0.00 0.00 55.73 54.35 3hwo s ARG 28 Cb 0.00 -2.31 -0.01 0.00 0.52 0.00 0.00 34.95 33.15 3hwo s ARG 28 CO 0.00 0.03 -0.01 -1.12 0.02 0.00 0.00 175.30 174.22 3hwo s SER 29 N 0.72 4.54 0.09 0.23 0.01 -1.26 -4.20 113.70 113.84 3hwo s SER 29 Ca -0.10 -0.34 -0.08 0.00 1.31 0.00 0.00 55.95 56.73 3hwo s SER 29 Cb -0.16 -1.79 -0.00 0.00 0.21 0.00 0.00 66.02 64.27 3hwo s SER 29 CO 0.01 -0.03 0.18 0.72 0.41 0.00 0.00 173.24 174.53 3hwo s PHE 30 N 1.52 0.19 0.31 2.43 -0.71 -0.55 -1.88 117.98 119.28 3hwo s PHE 30 Ca 0.06 -0.62 0.08 0.00 -1.04 0.00 0.00 56.93 55.41 3hwo s PHE 30 Cb -0.14 -0.08 -0.04 0.00 -1.21 0.00 0.00 43.02 41.55 3hwo s PHE 30 CO -0.01 -0.54 0.14 0.95 -1.34 0.00 0.00 175.22 174.41 3hwo s THR 31 N -3.87 3.44 0.30 -4.49 -4.23 -0.88 -1.07 115.64 104.84 3hwo s THR 31 Ca 0.06 -1.65 0.07 0.00 -1.18 0.00 0.00 61.69 58.99 3hwo s THR 31 Cb 0.05 -3.05 -0.06 0.00 1.34 0.00 0.00 72.50 70.78 3hwo s THR 31 CO -0.10 -0.26 -0.07 0.42 -0.54 0.00 0.00 174.62 174.07 3hwo s THR 32 N -2.33 1.80 -0.04 3.99 -4.23 -0.51 -1.19 115.64 113.13 3hwo s THR 32 Ca 0.36 -2.14 0.02 0.00 -1.18 0.00 0.00 61.69 58.74 3hwo s THR 32 Cb -0.05 -2.52 0.01 0.00 1.34 0.00 0.00 72.50 71.29 3hwo s THR 32 CO 0.23 -0.26 -0.07 -0.44 -0.54 0.00 0.00 174.62 173.54 3hwo s SER 33 N -3.49 1.09 0.64 3.99 0.01 -0.46 -4.26 113.70 111.22 3hwo s SER 33 Ca 0.31 -0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.40 3hwo s SER 33 Cb 0.03 -0.45 0.00 0.00 0.21 0.00 0.00 66.02 65.81 3hwo s SER 33 CO 0.13 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.39 3hwo n GLY 34 N 3.76 -1.36 3.19 3.44 0.00 -1.26 -0.95 105.19 112.01 3hwo n GLY 34 Ca -0.23 -1.15 -0.10 0.00 0.00 0.00 0.00 46.02 44.54 3hwo n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hwo n PHE 36 N 5.04 0.61 -3.81 0.00 -0.00 0.14 -4.63 117.46 114.81 3hwo n PHE 36 Ca -0.13 0.27 -0.14 0.00 -0.00 0.00 0.00 57.45 57.45 3hwo n PHE 36 Cb 0.51 -0.59 -0.15 0.00 -0.00 0.00 0.00 39.48 39.25 3hwo n PHE 36 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3hwo s ALA 37 N -2.82 -0.00 0.49 3.13 0.00 -1.15 -5.00 121.76 116.40 3hwo s ALA 37 Ca -0.11 0.24 -0.14 0.00 0.00 0.00 0.00 51.96 51.95 3hwo s ALA 37 Cb 0.01 -0.18 -0.07 0.00 0.00 0.00 0.00 23.12 22.88 3hwo s ALA 37 CO 0.16 -0.07 0.92 1.03 0.00 0.00 0.00 175.76 177.79 3hwo s ARG 38 N 0.65 3.87 -0.31 0.00 1.81 -1.26 -1.01 118.95 122.70 3hwo s ARG 38 Ca -0.05 0.78 -0.00 0.00 -1.72 0.00 0.00 55.73 54.73 3hwo s ARG 38 Cb -0.08 -2.22 0.13 0.00 -0.45 0.00 0.00 34.95 32.34 3hwo s ARG 38 CO -0.02 -0.21 0.28 0.12 -0.68 0.00 0.00 175.30 174.78 3hwo s PHE 39 N -2.58 -0.18 -0.67 -0.53 5.36 -0.64 -4.93 117.98 113.82 3hwo s PHE 39 Ca 0.56 -0.58 0.22 0.00 -0.96 0.00 0.00 56.93 56.17 3hwo s PHE 39 Cb -0.10 -0.57 -0.12 0.00 -0.34 0.00 0.00 43.02 41.89 3hwo s PHE 39 CO 0.33 -0.91 0.89 -0.25 -1.46 0.00 0.00 175.22 173.82 3hwo n ASP 40 N 4.94 0.63 -4.66 6.13 9.92 -1.26 -2.88 116.55 129.38 3hwo n ASP 40 Ca 0.02 -0.48 -0.54 0.00 -0.53 0.00 0.00 54.79 53.26 3hwo n ASP 40 Cb 0.44 1.09 -0.06 0.00 -0.64 0.00 0.00 41.12 41.95 3hwo n ASP 40 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 3hwo n GLU 41 N -1.82 1.35 -1.54 -1.24 4.07 -1.26 -0.68 120.64 119.52 3hwo n GLU 41 Ca 0.02 0.49 -0.40 0.00 -0.06 0.00 0.00 57.16 57.21 3hwo n GLU 41 Cb 0.42 -2.19 0.02 0.00 -0.06 0.00 0.00 31.44 29.63 3hwo n GLU 41 CO 0.00 0.00 0.00 -2.30 -0.06 0.00 0.00 177.13 174.77 3hwo n PRO 42 N 4.31 0.86 -0.11 5.31 -0.02 -1.26 -4.05 135.00 140.04 3hwo n PRO 42 Ca 0.22 0.32 0.12 0.00 -2.02 0.00 0.00 63.50 62.14 3hwo n PRO 42 Cb 0.18 -1.85 0.29 0.00 -0.02 0.00 0.00 33.50 32.10 3hwo n PRO 42 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hwo n ALA 43 N -1.10 2.48 -1.65 3.55 0.00 -0.72 -4.60 120.51 118.46 3hwo n ALA 43 Ca 0.11 -0.73 -0.43 0.00 0.00 0.00 0.00 53.44 52.40 3hwo n ALA 43 Cb 0.43 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.90 3hwo n ALA 43 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 3hwo n VAL 44 N 0.92 2.10 -3.49 0.00 3.14 -0.44 -0.82 118.33 119.74 3hwo n VAL 44 Ca 0.17 -0.50 -0.26 0.00 -2.96 0.00 0.00 64.34 60.80 3hwo n VAL 44 Cb 0.48 -1.34 0.01 0.00 -1.06 0.00 0.00 33.84 31.93 3hwo n VAL 44 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 3hwo n ASN 45 N 0.83 -4.44 0.18 6.55 5.03 -1.26 -4.79 115.26 117.36 3hwo n ASN 45 Ca 0.07 -0.50 0.13 0.00 0.87 0.00 0.00 54.58 55.15 3hwo n ASN 45 Cb 0.35 -3.61 0.39 0.00 -1.02 0.00 0.00 39.78 35.89 3hwo n ASN 45 CO 0.00 0.00 0.00 1.23 -1.83 0.00 0.00 177.26 176.66 3hwo h GLY 46 N -1.37 0.00 -5.69 7.41 0.00 -1.33 -3.33 103.07 98.76 3hwo h GLY 46 Ca -0.50 0.00 -0.71 0.00 0.00 0.00 0.00 47.33 46.13 3hwo h GLY 46 CO 0.59 0.00 3.15 2.09 0.00 0.00 0.00 176.54 182.37 3hwo n ASP 47 N -2.69 6.12 0.00 0.19 5.75 -1.26 -3.98 116.55 120.68 3hwo n ASP 47 Ca 0.04 -2.82 0.00 0.00 -0.01 0.00 0.00 54.79 52.00 3hwo n ASP 47 Cb 0.41 -1.57 0.00 0.00 -1.03 0.00 0.00 41.12 38.93 3hwo n ASP 47 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 3hwo n SER 48 N 4.49 0.00 0.01 -1.12 2.88 -1.25 -4.93 113.62 113.69 3hwo n SER 48 Ca 0.60 0.00 0.06 0.00 -1.33 0.00 0.00 58.87 58.20 3hwo n SER 48 Cb 0.32 0.00 0.25 0.00 -0.75 0.00 0.00 64.21 64.03 3hwo n SER 48 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3hwo n PRO 49 N 0.00 0.01 0.00 -1.46 -0.04 -1.26 -1.32 135.00 130.93 3hwo n PRO 49 Ca 0.00 0.33 0.14 0.00 -0.04 0.00 0.00 63.50 63.93 3hwo n PRO 49 Cb 0.00 -1.53 0.57 0.00 -0.04 0.00 0.00 33.50 32.50 3hwo n PRO 49 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3hwo n ASP 50 N -1.55 0.08 -4.77 3.54 8.00 -1.26 -4.23 116.55 116.37 3hwo n ASP 50 Ca 0.02 0.34 -0.39 0.00 0.71 0.00 0.00 54.79 55.47 3hwo n ASP 50 Cb 0.13 -0.37 -0.01 0.00 -0.02 0.00 0.00 41.12 40.85 3hwo n ASP 50 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3hwo s SER 51 N -2.97 6.41 0.50 -2.24 1.04 -0.43 -4.86 113.70 111.15 3hwo s SER 51 Ca 0.14 2.60 0.27 0.00 0.48 0.00 0.00 55.95 59.45 3hwo s SER 51 Cb 0.19 -2.64 1.36 0.00 0.10 0.00 0.00 66.02 65.03 3hwo s SER 51 CO 0.55 -0.78 1.89 1.55 0.98 0.00 0.00 173.24 177.43 3hwo h PRO 52 N 2.76 0.11 0.67 4.02 0.13 -1.90 -0.34 132.00 137.46 3hwo h PRO 52 Ca -0.49 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.60 3hwo h PRO 52 Cb 1.24 -0.03 0.01 0.00 0.13 0.00 0.00 31.00 32.35 3hwo h PRO 52 CO 0.63 0.08 -0.33 0.35 -0.23 0.00 0.00 178.00 178.50 3hwo h PHE 53 N 0.12 -0.85 -0.51 1.56 3.57 -1.87 0.23 116.94 119.20 3hwo h PHE 53 Ca 0.42 -0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.82 3hwo h PHE 53 Cb 1.49 0.28 -0.02 0.00 2.79 0.00 0.00 35.95 40.49 3hwo h PHE 53 CO -0.00 -0.53 -0.03 1.96 -2.23 0.00 0.00 178.31 177.49 3hwo h GLN 54 N -0.91 0.88 -0.17 1.11 1.08 -1.68 -0.26 115.11 115.16 3hwo h GLN 54 Ca -0.09 -0.26 -0.01 0.00 -1.45 0.00 0.00 58.65 56.84 3hwo h GLN 54 Cb 0.70 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 28.03 3hwo h GLN 54 CO 0.15 0.89 0.07 1.96 -0.95 0.00 0.00 178.83 180.95 3hwo h GLN 55 N 0.81 0.26 -0.34 1.46 4.20 -1.01 0.30 115.11 120.79 3hwo h GLN 55 Ca 0.15 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.69 3hwo h GLN 55 Cb 0.52 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.25 3hwo h GLN 55 CO 0.03 0.34 -0.28 0.87 -0.67 0.00 0.00 178.83 179.12 3hwo h LYS 56 N 0.12 0.71 0.15 1.46 1.57 -0.89 0.30 116.57 119.99 3hwo h LYS 56 Ca 0.06 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 3hwo h LYS 56 Cb 0.18 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3hwo h LYS 56 CO -0.00 0.91 -0.12 1.25 -0.57 0.00 0.00 179.45 180.91 3hwo h LEU 57 N 0.61 -0.31 0.30 2.94 5.85 -0.83 0.21 115.31 124.08 3hwo h LEU 57 Ca 0.08 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 3hwo h LEU 57 Cb 0.78 0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.91 3hwo h LEU 57 CO 0.06 -0.19 -0.22 0.00 -0.34 0.00 0.00 178.44 177.76 3hwo h ALA 58 N 0.56 -0.51 -0.53 1.25 0.00 -0.13 -0.42 119.26 119.48 3hwo h ALA 58 Ca -0.00 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.87 3hwo h ALA 58 Cb 0.25 0.29 -0.09 0.00 0.00 0.00 0.00 17.79 18.24 3hwo h ALA 58 CO -0.01 -0.80 -0.56 0.00 0.00 0.00 0.00 179.25 177.87 3hwo h ALA 59 N 0.13 -0.72 -0.64 0.00 0.00 -0.32 0.06 119.26 117.78 3hwo h ALA 59 Ca -0.02 0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.04 3hwo h ALA 59 Cb 0.45 1.17 -0.04 0.00 0.00 0.00 0.00 17.79 19.37 3hwo h ALA 59 CO 0.00 -1.03 0.43 1.25 0.00 0.00 0.00 179.25 179.90 3hwo h LEU 60 N -0.32 0.30 -0.19 0.00 5.85 -0.41 0.57 115.31 121.12 3hwo h LEU 60 Ca 0.09 0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.70 3hwo h LEU 60 Cb 0.56 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.54 3hwo h LEU 60 CO -0.67 0.17 -0.38 -0.26 -0.34 0.00 0.00 178.44 176.96 3hwo h PHE 61 N 0.33 0.75 -0.40 1.25 0.04 0.34 -0.91 116.94 118.33 3hwo h PHE 61 Ca 0.30 -0.27 -0.13 0.00 2.80 0.00 0.00 57.97 60.67 3hwo h PHE 61 Cb 0.74 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.74 3hwo h PHE 61 CO -0.00 1.02 -0.27 0.00 -0.60 0.00 0.00 178.31 178.46 3hwo h ALA 62 N 0.59 0.58 -0.72 2.45 0.00 -0.09 -1.75 119.26 120.31 3hwo h ALA 62 Ca 0.01 -0.41 0.13 0.00 0.00 0.00 0.00 54.91 54.64 3hwo h ALA 62 Cb 0.98 -0.13 -0.09 0.00 0.00 0.00 0.00 17.79 18.55 3hwo h ALA 62 CO 0.08 0.59 0.29 0.22 0.00 0.00 0.00 179.25 180.44 3hwo h ASP 63 N 0.71 0.27 -0.01 0.00 1.82 0.08 -0.67 116.42 118.63 3hwo h ASP 63 Ca 0.08 0.10 -0.17 0.00 -0.39 0.00 0.00 57.03 56.65 3hwo h ASP 63 Cb 0.85 0.08 -0.00 0.00 0.68 0.00 0.00 39.33 40.93 3hwo h ASP 63 CO 0.07 0.12 -0.58 0.00 -1.61 0.00 0.00 179.24 177.24 3hwo h ALA 64 N 1.52 0.63 -0.12 -0.78 0.00 -0.79 -2.13 119.26 117.60 3hwo h ALA 64 Ca 0.39 -0.53 -0.21 0.00 0.00 0.00 0.00 54.91 54.56 3hwo h ALA 64 Cb 0.56 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.29 3hwo h ALA 64 CO -0.38 0.69 -0.76 0.87 0.00 0.00 0.00 179.25 179.67 3hwo h LYS 65 N 0.46 0.72 -0.50 0.00 1.57 -1.16 -2.54 116.57 115.12 3hwo h LYS 65 Ca 0.00 -0.62 0.05 0.00 -1.87 0.00 0.00 60.65 58.21 3hwo h LYS 65 Cb 1.14 0.14 -0.03 0.00 0.08 0.00 0.00 32.23 33.56 3hwo h LYS 65 CO 0.11 1.23 0.33 0.00 -0.57 0.00 0.00 179.45 180.55 3hwo h ALA 66 N 0.50 1.85 0.00 3.86 0.00 -1.13 -1.78 119.26 122.57 3hwo h ALA 66 Ca -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.83 3hwo h ALA 66 Cb 1.40 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3hwo h ALA 66 CO 0.16 0.07 0.00 1.04 0.00 0.00 0.00 179.25 180.52 3hwo n GLN 67 N -4.48 0.51 0.00 0.00 1.13 -0.80 -4.90 117.38 108.84 3hwo n GLN 67 Ca 0.06 0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.14 3hwo n GLN 67 Cb 0.21 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.06 3hwo n GLN 67 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3hwo n GLY 68 N 1.06 1.07 3.63 1.08 0.00 -0.67 -5.07 105.19 106.29 3hwo n GLY 68 Ca 0.15 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.74 3hwo n GLY 68 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hwo s ILE 69 N -2.00 4.54 -0.14 -0.61 1.01 -0.97 -5.01 121.20 118.02 3hwo s ILE 69 Ca 0.00 1.66 -0.27 0.00 0.00 0.00 0.00 60.65 62.04 3hwo s ILE 69 Cb 0.00 -4.38 -0.01 0.00 0.01 0.00 0.00 42.46 38.07 3hwo s ILE 69 CO 0.00 -0.46 0.89 -0.54 0.00 0.00 0.00 174.94 174.83 3hwo s LYS 70 N 3.57 4.35 -0.67 2.79 1.02 -1.26 -4.16 119.74 125.37 3hwo s LYS 70 Ca 0.44 1.15 -0.03 0.00 0.02 0.00 0.00 55.97 57.55 3hwo s LYS 70 Cb -0.12 -3.55 -0.03 0.00 -0.52 0.00 0.00 37.83 33.60 3hwo s LYS 70 CO 0.15 -0.30 0.58 0.09 -0.92 0.00 0.00 175.35 174.95 3hwo n ASN 71 N 5.05 -4.14 -4.77 2.83 5.03 -1.26 -4.97 115.26 113.02 3hwo n ASN 71 Ca 0.06 -0.42 -0.41 0.00 0.87 0.00 0.00 54.58 54.68 3hwo n ASN 71 Cb 0.49 -3.40 0.00 0.00 -1.02 0.00 0.00 39.78 35.85 3hwo n ASN 71 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 3hwo s PRO 72 N -4.11 4.00 0.16 3.52 0.04 -1.26 -4.98 135.00 132.36 3hwo s PRO 72 Ca 0.21 2.51 0.10 0.00 0.04 0.00 0.00 61.00 63.86 3hwo s PRO 72 Cb -0.03 -2.88 -0.04 0.00 0.04 0.00 0.00 34.50 31.59 3hwo s PRO 72 CO 0.46 -0.60 -0.18 0.14 0.04 0.00 0.00 177.00 176.85 3hwo s VAL 73 N -1.15 2.72 -0.31 -0.36 -7.23 -1.26 -3.58 120.40 109.24 3hwo s VAL 73 Ca 0.55 -1.76 -0.05 0.00 -1.81 0.00 0.00 61.98 58.90 3hwo s VAL 73 Cb -0.45 -2.30 0.03 0.00 0.56 0.00 0.00 36.38 34.22 3hwo s VAL 73 CO 0.61 -0.04 0.06 -0.32 -0.31 0.00 0.00 175.10 175.10 3hwo s MET 74 N -2.53 2.79 0.36 4.82 1.75 0.18 -4.12 119.30 122.56 3hwo s MET 74 Ca 0.21 -1.05 0.08 0.00 -1.25 0.00 0.00 55.69 53.68 3hwo s MET 74 Cb -0.09 -3.33 -0.04 0.00 2.84 0.00 0.00 34.83 34.21 3hwo s MET 74 CO 0.11 -0.55 0.17 0.14 -0.65 0.00 0.00 175.02 174.25 3hwo s VAL 75 N 1.41 2.82 -2.15 10.11 -7.23 -0.89 -1.33 120.40 123.13 3hwo s VAL 75 Ca -0.00 -1.67 0.00 0.00 -1.81 0.00 0.00 61.98 58.50 3hwo s VAL 75 Cb -0.18 -2.98 0.00 0.00 0.56 0.00 0.00 36.38 33.78 3hwo s VAL 75 CO 0.01 -0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.29 3hwo n GLY 76 N -1.21 0.73 3.28 2.32 0.00 -0.78 -1.41 105.19 108.13 3hwo n GLY 76 Ca -0.02 -2.11 -0.21 0.00 0.00 0.00 0.00 46.02 43.69 3hwo n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hwo s ALA 77 N -1.57 1.73 -0.07 4.61 0.00 -0.97 -1.86 121.76 123.62 3hwo s ALA 77 Ca 0.00 -1.33 0.05 0.00 0.00 0.00 0.00 51.96 50.68 3hwo s ALA 77 Cb 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 3hwo s ALA 77 CO 0.00 0.21 -0.25 0.42 0.00 0.00 0.00 175.76 176.15 3hwo s ILE 78 N -1.83 2.05 0.87 0.00 1.01 -0.01 -0.53 121.20 122.76 3hwo s ILE 78 Ca 0.10 -1.04 -0.11 0.00 0.00 0.00 0.00 60.65 59.60 3hwo s ILE 78 Cb -0.07 -1.75 0.12 0.00 0.01 0.00 0.00 42.46 40.77 3hwo s ILE 78 CO 0.05 0.56 1.09 -2.16 0.00 0.00 0.00 174.94 174.48 3hwo s PRO 79 N 0.03 1.42 0.24 2.79 0.04 -1.26 -1.82 135.00 136.44 3hwo s PRO 79 Ca -0.09 1.04 -0.05 0.00 0.04 0.00 0.00 61.00 61.93 3hwo s PRO 79 Cb -0.15 -1.81 0.44 0.00 0.04 0.00 0.00 34.50 33.02 3hwo s PRO 79 CO 0.06 -2.19 1.70 0.35 0.04 0.00 0.00 177.00 176.96 3hwo h PHE 80 N -1.52 0.32 -3.51 0.56 3.57 -1.10 -3.36 116.94 111.90 3hwo h PHE 80 Ca -0.47 0.04 -0.72 0.00 3.53 0.00 0.00 57.97 60.35 3hwo h PHE 80 Cb 1.27 -0.03 -0.22 0.00 2.79 0.00 0.00 35.95 39.76 3hwo h PHE 80 CO 0.48 -0.05 -0.44 0.34 -2.23 0.00 0.00 178.31 176.40 3hwo s ASP 81 N -5.27 6.03 0.00 0.41 -1.08 -1.26 -4.71 116.67 110.79 3hwo s ASP 81 Ca -0.13 -0.94 0.18 0.00 -0.52 0.00 0.00 52.55 51.14 3hwo s ASP 81 Cb 0.21 -2.13 0.89 0.00 -1.46 0.00 0.00 42.92 40.43 3hwo s ASP 81 CO 0.76 -0.45 1.56 -0.81 0.52 0.00 0.00 175.17 176.75 3hwo n PRO 82 N 5.13 0.20 -0.16 4.34 -0.04 -1.26 -2.02 135.00 141.19 3hwo n PRO 82 Ca -0.11 0.13 -0.10 0.00 -0.04 0.00 0.00 63.50 63.38 3hwo n PRO 82 Cb 0.47 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.46 3hwo n PRO 82 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hwo h ARG 83 N 0.00 0.97 -7.26 0.54 3.08 -1.93 -0.94 114.38 108.83 3hwo h ARG 83 Ca 0.00 -0.38 -0.52 0.00 0.07 0.00 0.00 59.98 59.15 3hwo h ARG 83 Cb 0.20 -0.05 0.19 0.00 0.08 0.00 0.00 29.97 30.39 3hwo h ARG 83 CO 0.00 1.05 0.25 -0.65 -1.07 0.00 0.00 179.97 179.55 3hwo s GLN 84 N -4.76 1.24 0.70 0.04 -0.21 -0.86 -4.65 119.66 111.17 3hwo s GLN 84 Ca -0.11 1.55 -0.15 0.00 0.02 0.00 0.00 55.36 56.68 3hwo s GLN 84 Cb 0.13 -1.75 0.02 0.00 1.00 0.00 0.00 33.01 32.41 3hwo s GLN 84 CO 0.86 -2.47 1.16 -2.14 -2.12 0.00 0.00 175.29 170.58 3hwo s PRO 85 N -4.58 2.44 0.18 2.91 0.02 -1.26 -4.32 135.00 130.39 3hwo s PRO 85 Ca 0.67 1.57 0.04 0.00 0.02 0.00 0.00 61.00 63.31 3hwo s PRO 85 Cb -0.23 -1.89 -0.04 0.00 0.02 0.00 0.00 34.50 32.36 3hwo s PRO 85 CO 0.56 -1.56 0.23 -1.12 -0.33 0.00 0.00 177.00 174.78 3hwo s SER 86 N -2.32 5.94 -0.58 2.53 0.01 0.14 -4.50 113.70 114.92 3hwo s SER 86 Ca 0.70 -0.00 0.02 0.00 1.31 0.00 0.00 55.95 57.99 3hwo s SER 86 Cb -0.25 -1.67 0.40 0.00 0.21 0.00 0.00 66.02 64.72 3hwo s SER 86 CO 0.44 0.03 1.48 -1.20 0.41 0.00 0.00 173.24 174.40 3hwo n SER 87 N -0.66 5.85 -4.90 2.44 7.64 0.31 -4.16 113.62 120.14 3hwo n SER 87 Ca -0.08 -3.77 -0.21 0.00 1.01 0.00 0.00 58.87 55.83 3hwo n SER 87 Cb 0.55 -0.68 -0.03 0.00 -1.01 0.00 0.00 64.21 63.04 3hwo n SER 87 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 3hwo s LEU 88 N -3.74 3.91 -0.20 -3.43 1.43 -1.14 -2.30 118.68 113.22 3hwo s LEU 88 Ca 0.51 -0.22 -0.30 0.00 -1.03 0.00 0.00 54.13 53.09 3hwo s LEU 88 Cb 0.42 -2.52 0.15 0.00 0.03 0.00 0.00 46.19 44.27 3hwo s LEU 88 CO -0.23 -0.20 1.12 -0.72 0.23 0.00 0.00 176.35 176.55 3hwo s TYR 89 N -2.15 -0.26 -0.24 0.29 -0.85 -0.50 -1.62 117.35 112.03 3hwo s TYR 89 Ca 0.37 0.43 -0.18 0.00 -0.52 0.00 0.00 57.07 57.17 3hwo s TYR 89 Cb -0.08 0.47 -0.03 0.00 0.38 0.00 0.00 41.96 42.70 3hwo s TYR 89 CO 0.27 -0.24 0.54 0.42 -1.52 0.00 0.00 175.55 175.02 3hwo s ILE 90 N -1.11 5.06 0.78 -3.49 1.01 -0.18 -2.10 121.20 121.16 3hwo s ILE 90 Ca 0.02 0.94 -0.12 0.00 0.00 0.00 0.00 60.65 61.50 3hwo s ILE 90 Cb -0.01 -3.85 0.06 0.00 0.01 0.00 0.00 42.46 38.67 3hwo s ILE 90 CO -0.02 0.10 1.12 -2.16 0.00 0.00 0.00 174.94 173.98 3hwo s PRO 91 N 2.17 2.26 0.14 2.79 0.04 -1.26 0.25 135.00 141.39 3hwo s PRO 91 Ca 0.23 0.42 -0.15 0.00 0.04 0.00 0.00 61.00 61.53 3hwo s PRO 91 Cb -0.16 -1.96 0.01 0.00 0.04 0.00 0.00 34.50 32.44 3hwo s PRO 91 CO 0.09 -1.45 1.70 0.93 0.04 0.00 0.00 177.00 178.31 3hwo h GLU 92 N -0.96 0.63 0.00 4.56 4.39 -1.00 -3.38 114.58 118.82 3hwo h GLU 92 Ca -0.46 -0.10 -0.24 0.00 0.34 0.00 0.00 59.36 58.89 3hwo h GLU 92 Cb 1.28 -0.11 -0.05 0.00 -0.10 0.00 0.00 28.75 29.77 3hwo h GLU 92 CO 0.63 0.57 -0.07 -1.13 -1.16 0.00 0.00 179.01 177.85 3hwo n SER 93 N -4.64 -1.59 -4.01 1.42 3.41 -0.64 -4.98 113.62 102.59 3hwo n SER 93 Ca 0.00 -2.89 -0.10 0.00 -0.26 0.00 0.00 58.87 55.63 3hwo n SER 93 Cb 0.13 2.88 -0.08 0.00 -0.26 0.00 0.00 64.21 66.88 3hwo n SER 93 CO 0.00 0.00 0.00 -1.66 -0.16 0.00 0.00 175.04 173.22 3hwo s TRP 94 N -2.70 0.52 -0.22 7.33 1.48 -1.26 -1.35 118.94 122.74 3hwo s TRP 94 Ca 0.27 -0.88 -0.04 0.00 -1.06 0.00 0.00 56.10 54.39 3hwo s TRP 94 Cb -0.02 -0.15 0.12 0.00 -1.16 0.00 0.00 33.47 32.26 3hwo s TRP 94 CO 0.20 -0.70 0.36 -0.65 -4.06 0.00 0.00 176.95 172.10 3hwo s GLN 95 N -4.00 0.31 0.64 3.25 1.11 -0.33 -4.97 119.66 115.67 3hwo s GLN 95 Ca 0.20 0.62 -0.18 0.00 0.01 0.00 0.00 55.36 56.01 3hwo s GLN 95 Cb 0.04 -0.35 -0.01 0.00 -1.01 0.00 0.00 33.01 31.68 3hwo s GLN 95 CO 0.02 -0.54 1.25 -1.12 0.01 0.00 0.00 175.29 174.91 3hwo s SER 96 N 2.53 4.78 0.18 5.90 0.01 -1.26 -2.08 113.70 123.76 3hwo s SER 96 Ca 0.08 2.51 -0.00 0.00 1.31 0.00 0.00 55.95 59.85 3hwo s SER 96 Cb -0.15 -2.61 -0.04 0.00 0.21 0.00 0.00 66.02 63.43 3hwo s SER 96 CO -0.14 -1.88 0.07 0.72 0.41 0.00 0.00 173.24 172.42 3hwo s PHE 97 N -1.54 1.12 -0.28 2.43 -0.71 -0.79 -4.89 117.98 113.32 3hwo s PHE 97 Ca 0.80 -1.23 -0.22 0.00 -1.04 0.00 0.00 56.93 55.23 3hwo s PHE 97 Cb -0.34 -0.61 -0.01 0.00 -1.21 0.00 0.00 43.02 40.86 3hwo s PHE 97 CO 0.38 -0.47 0.72 0.45 -1.34 0.00 0.00 175.22 174.96 3hwo s SER 98 N -3.15 6.63 0.24 1.98 0.15 -1.26 -4.64 113.70 113.65 3hwo s SER 98 Ca 0.31 0.68 -0.05 0.00 0.70 0.00 0.00 55.95 57.58 3hwo s SER 98 Cb 0.07 -2.38 0.39 0.00 -1.71 0.00 0.00 66.02 62.40 3hwo s SER 98 CO 0.07 -0.51 1.78 -0.09 1.20 0.00 0.00 173.24 175.69 3hwo h ARG 99 N 8.01 0.62 -0.35 5.44 2.43 -1.91 0.17 114.38 128.78 3hwo h ARG 99 Ca -0.25 -0.04 -0.17 0.00 -0.81 0.00 0.00 59.98 58.71 3hwo h ARG 99 Cb 1.11 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.51 3hwo h ARG 99 CO 0.84 0.41 -0.45 1.96 -1.51 0.00 0.00 179.97 181.22 3hwo h GLN 100 N 0.63 0.93 -0.41 0.20 1.08 -1.97 -1.30 115.11 114.27 3hwo h GLN 100 Ca 0.39 -0.52 0.04 0.00 -1.45 0.00 0.00 58.65 57.10 3hwo h GLN 100 Cb 0.44 0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 27.86 3hwo h GLN 100 CO -0.29 1.17 0.18 0.93 -0.95 0.00 0.00 178.83 179.87 3hwo h GLU 101 N 0.74 0.36 -0.79 1.46 5.08 -1.82 -2.48 114.58 117.13 3hwo h GLU 101 Ca 0.04 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 3hwo h GLU 101 Cb 1.05 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 30.18 3hwo h GLU 101 CO 0.11 0.24 0.39 -0.22 -1.00 0.00 0.00 179.01 178.53 3hwo h LYS 102 N 0.37 1.13 -0.79 2.33 1.63 -0.59 -1.60 116.57 119.04 3hwo h LYS 102 Ca 0.18 -0.16 0.05 0.00 -0.85 0.00 0.00 60.65 59.87 3hwo h LYS 102 Cb 0.12 -0.21 -0.05 0.00 -0.60 0.00 0.00 32.23 31.49 3hwo h LYS 102 CO -0.15 0.87 0.52 1.96 -3.45 0.00 0.00 179.45 179.20 3hwo h GLN 103 N 1.11 0.88 -0.02 1.90 4.20 -1.00 -1.86 115.11 120.32 3hwo h GLN 103 Ca 0.27 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.87 3hwo h GLN 103 Cb 0.10 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 27.68 3hwo h GLN 103 CO -0.04 0.58 -0.24 0.00 -0.67 0.00 0.00 178.83 178.46 3hwo h ALA 104 N 1.56 0.06 -0.68 3.87 0.00 -0.99 -2.71 119.26 120.36 3hwo h ALA 104 Ca 0.33 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 3hwo h ALA 104 Cb 0.16 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 3hwo h ALA 104 CO -0.11 0.08 0.40 0.66 0.00 0.00 0.00 179.25 180.28 3hwo h SER 105 N -0.42 0.84 -0.69 0.00 4.64 -1.22 -2.78 113.55 113.91 3hwo h SER 105 Ca -0.02 -0.07 0.02 0.00 -0.47 0.00 0.00 61.79 61.24 3hwo h SER 105 Cb 0.95 -0.21 -0.04 0.00 -0.31 0.00 0.00 62.40 62.79 3hwo h SER 105 CO 0.05 0.67 0.44 0.00 -0.87 0.00 0.00 176.83 177.12 3hwo h ALA 106 N 1.20 0.89 0.00 5.18 0.00 -1.40 -1.09 119.26 124.05 3hwo h ALA 106 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3hwo h ALA 106 Cb -0.00 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.54 3hwo h ALA 106 CO -0.04 0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.45 3hwo h ARG 107 N 0.89 0.00 0.00 0.00 3.08 -1.20 -1.93 114.38 115.21 3hwo h ARG 107 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 3hwo h ARG 107 Cb -0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.02 3hwo h ARG 107 CO -0.09 0.00 -1.49 0.54 -1.07 0.00 0.00 179.97 177.87 3hwo n ARG 108 N -3.03 0.40 -1.68 0.04 1.74 -0.82 -4.92 116.66 108.38 3hwo n ARG 108 Ca -0.01 -0.10 -0.45 0.00 -0.77 0.00 0.00 57.85 56.52 3hwo n ARG 108 Cb 0.17 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.08 3hwo n ARG 108 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3hwo n PHE 109 N -1.87 2.46 -0.04 -1.55 7.35 -0.48 -4.86 117.46 118.47 3hwo n PHE 109 Ca -0.00 0.03 -0.06 0.00 -0.76 0.00 0.00 57.45 56.66 3hwo n PHE 109 Cb 0.44 -2.65 -0.05 0.00 0.35 0.00 0.00 39.48 37.57 3hwo n PHE 109 CO 0.00 0.00 0.00 -2.37 -0.76 0.00 0.00 176.76 173.63 3hwo n THR 110 N 4.34 0.52 -2.57 -2.13 5.66 -1.26 -4.99 114.28 113.85 3hwo n THR 110 Ca 0.18 -0.23 -0.43 0.00 -3.05 0.00 0.00 64.05 60.53 3hwo n THR 110 Cb 0.33 -0.82 -0.02 0.00 -1.55 0.00 0.00 70.33 68.27 3hwo n THR 110 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3hwo s ARG 111 N -2.18 3.86 0.07 1.09 1.04 -1.26 -5.01 118.95 116.55 3hwo s ARG 111 Ca -0.10 0.87 0.01 0.00 -1.04 0.00 0.00 55.73 55.46 3hwo s ARG 111 Cb 0.03 -3.85 0.01 0.00 -2.04 0.00 0.00 34.95 29.10 3hwo s ARG 111 CO 0.23 -1.20 0.09 0.43 -0.04 0.00 0.00 175.30 174.82 3hwo n SER 112 N 7.56 0.18 -4.19 -2.89 7.64 -1.26 -4.98 113.62 115.68 3hwo n SER 112 Ca 0.13 -1.14 -0.33 0.00 1.01 0.00 0.00 58.87 58.54 3hwo n SER 112 Cb 0.48 -0.06 -0.16 0.00 -1.01 0.00 0.00 64.21 63.46 3hwo n SER 112 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 3hwo s GLN 113 N -2.46 3.06 -0.12 1.43 0.74 -1.26 -5.09 119.66 115.96 3hwo s GLN 113 Ca 0.07 -0.83 -0.29 0.00 0.05 0.00 0.00 55.36 54.35 3hwo s GLN 113 Cb -0.00 -2.47 -0.04 0.00 1.10 0.00 0.00 33.01 31.60 3hwo s GLN 113 CO 0.04 0.00 1.54 -1.12 -0.55 0.00 0.00 175.29 175.20 3hwo s SER 114 N 0.78 6.68 -0.07 6.67 0.01 -1.26 -4.99 113.70 121.53 3hwo s SER 114 Ca -0.07 1.95 -0.01 0.00 1.31 0.00 0.00 55.95 59.13 3hwo s SER 114 Cb -0.16 -2.53 0.03 0.00 0.21 0.00 0.00 66.02 63.57 3hwo s SER 114 CO -0.01 -0.95 -0.02 -0.22 0.41 0.00 0.00 173.24 172.45 3hwo s LEU 115 N 4.14 0.85 -0.12 2.44 2.96 -1.26 -5.02 118.68 122.66 3hwo s LEU 115 Ca 0.68 -0.11 -0.01 0.00 -0.22 0.00 0.00 54.13 54.47 3hwo s LEU 115 Cb -0.28 -0.47 -0.02 0.00 0.50 0.00 0.00 46.19 45.91 3hwo s LEU 115 CO 0.25 -0.15 -0.09 0.54 -1.32 0.00 0.00 176.35 175.58 3hwo s ASN 116 N 1.65 4.36 0.07 3.68 2.20 -1.26 -5.05 114.94 120.59 3hwo s ASN 116 Ca 0.00 -0.21 -0.30 0.00 -0.94 0.00 0.00 52.86 51.42 3hwo s ASN 116 Cb -0.13 -1.54 -0.05 0.00 -2.00 0.00 0.00 41.25 37.53 3hwo s ASN 116 CO -0.04 0.21 1.00 -0.69 -2.94 0.00 0.00 177.10 174.64 3hwo s VAL 117 N 0.10 4.54 -0.03 3.54 1.01 -1.26 -1.78 120.40 126.51 3hwo s VAL 117 Ca -0.04 1.97 0.14 0.00 0.00 0.00 0.00 61.98 64.05 3hwo s VAL 117 Cb -0.14 -4.26 -0.21 0.00 0.00 0.00 0.00 36.38 31.77 3hwo s VAL 117 CO 0.04 0.24 0.27 1.33 0.00 0.00 0.00 175.10 176.98 3hwo n VAL 118 N 3.26 0.10 -3.81 2.92 0.24 0.13 -4.92 118.33 116.26 3hwo n VAL 118 Ca 0.04 -0.34 -0.12 0.00 -2.04 0.00 0.00 64.34 61.88 3hwo n VAL 118 Cb 0.49 0.09 -0.12 0.00 -1.47 0.00 0.00 33.84 32.83 3hwo n VAL 118 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 3hwo s GLU 119 N -2.88 0.23 -0.10 7.34 2.12 -1.11 -4.99 118.70 119.31 3hwo s GLU 119 Ca -0.05 0.23 -0.01 0.00 0.36 0.00 0.00 54.97 55.50 3hwo s GLU 119 Cb 0.08 0.11 0.03 0.00 0.26 0.00 0.00 34.13 34.61 3hwo s GLU 119 CO 0.57 -0.03 -0.01 0.50 -0.54 0.00 0.00 175.26 175.74 3hwo s ARG 120 N 0.04 0.84 -0.15 4.30 3.52 -1.26 -0.94 118.95 125.30 3hwo s ARG 120 Ca -0.01 -0.08 0.01 0.00 -0.13 0.00 0.00 55.73 55.53 3hwo s ARG 120 Cb -0.02 -1.32 0.02 0.00 -1.56 0.00 0.00 34.95 32.07 3hwo s ARG 120 CO 0.00 -0.35 -0.16 -0.65 -0.81 0.00 0.00 175.30 173.33 3hwo s GLN 121 N 1.89 2.50 -0.07 5.12 -1.52 0.28 -4.98 119.66 122.87 3hwo s GLN 121 Ca 0.04 -0.64 -0.26 0.00 -1.95 0.00 0.00 55.36 52.54 3hwo s GLN 121 Cb -0.13 -2.21 -0.03 0.00 -0.22 0.00 0.00 33.01 30.42 3hwo s GLN 121 CO -0.06 -0.20 0.84 0.00 -0.25 0.00 0.00 175.29 175.63 3hwo s ALA 122 N 1.34 3.33 -0.26 6.09 0.00 -1.26 -0.28 121.76 130.72 3hwo s ALA 122 Ca 0.03 0.26 -0.01 0.00 0.00 0.00 0.00 51.96 52.24 3hwo s ALA 122 Cb -0.13 -3.18 0.08 0.00 0.00 0.00 0.00 23.12 19.88 3hwo s ALA 122 CO -0.10 -0.32 0.03 0.42 0.00 0.00 0.00 175.76 175.79 3hwo s ILE 123 N 1.30 1.09 0.21 0.00 1.01 -0.68 -3.67 121.20 120.46 3hwo s ILE 123 Ca 0.43 -1.18 -0.03 0.00 0.00 0.00 0.00 60.65 59.87 3hwo s ILE 123 Cb -0.18 -1.61 0.05 0.00 0.01 0.00 0.00 42.46 40.72 3hwo s ILE 123 CO 0.20 -0.36 0.29 -0.81 0.00 0.00 0.00 174.94 174.26 3hwo n PRO 124 N 4.80 -0.10 -2.09 2.79 -0.04 -1.26 -0.89 135.00 138.21 3hwo n PRO 124 Ca -0.07 -0.52 -0.19 0.00 -0.04 0.00 0.00 63.50 62.69 3hwo n PRO 124 Cb 0.44 -0.27 0.11 0.00 -0.04 0.00 0.00 33.50 33.73 3hwo n PRO 124 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 3hwo n GLU 125 N -1.59 -0.12 -0.12 0.54 1.02 -1.24 -4.84 120.64 114.29 3hwo n GLU 125 Ca 0.04 -2.11 -0.04 0.00 -0.02 0.00 0.00 57.16 55.03 3hwo n GLU 125 Cb 0.13 -0.61 0.03 0.00 -0.02 0.00 0.00 31.44 30.97 3hwo n GLU 125 CO 0.00 0.00 0.00 0.37 1.18 0.00 0.00 177.13 178.68 3hwo h GLN 126 N 0.00 0.06 0.23 3.49 4.15 -1.99 -1.89 115.11 119.15 3hwo h GLN 126 Ca -0.28 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.13 3hwo h GLN 126 Cb 0.98 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.66 3hwo h GLN 126 CO 0.28 0.04 -0.11 1.15 -1.93 0.00 0.00 178.83 178.26 3hwo h THR 127 N 0.06 0.84 -0.67 2.39 2.02 -1.99 -0.60 112.91 114.95 3hwo h THR 127 Ca 0.20 -0.65 0.09 0.00 0.77 0.00 0.00 66.41 66.83 3hwo h THR 127 Cb 0.30 1.21 -0.07 0.00 -1.74 0.00 0.00 68.15 67.84 3hwo h THR 127 CO -0.38 0.14 0.32 0.74 0.37 0.00 0.00 175.52 176.71 3hwo h THR 128 N -0.64 0.83 -0.01 3.16 2.02 -1.94 -2.43 112.91 113.89 3hwo h THR 128 Ca -0.03 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 66.97 3hwo h THR 128 Cb 0.46 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.10 3hwo h THR 128 CO 0.05 0.10 -0.05 0.15 0.37 0.00 0.00 175.52 176.15 3hwo h PHE 129 N 0.54 -0.11 -0.74 3.16 3.57 -1.16 -1.59 116.94 120.61 3hwo h PHE 129 Ca 0.33 0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.97 3hwo h PHE 129 Cb 0.36 0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.10 3hwo h PHE 129 CO -0.12 -0.07 0.49 0.93 -2.23 0.00 0.00 178.31 177.31 3hwo h GLU 130 N -0.08 0.45 -0.09 1.11 5.08 -0.76 -0.22 114.58 120.06 3hwo h GLU 130 Ca 0.02 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 3hwo h GLU 130 Cb 0.11 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 3hwo h GLU 130 CO -0.05 0.29 -0.63 1.96 -1.00 0.00 0.00 179.01 179.58 3hwo h GLN 131 N 0.46 0.33 -0.29 2.33 4.20 -0.96 -1.07 115.11 120.11 3hwo h GLN 131 Ca 0.36 -0.24 -0.08 0.00 0.06 0.00 0.00 58.65 58.75 3hwo h GLN 131 Cb 0.75 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.56 3hwo h GLN 131 CO -0.12 0.85 -0.16 0.52 -0.67 0.00 0.00 178.83 179.25 3hwo h MET 132 N 0.24 0.50 -0.16 1.46 2.86 -0.13 -0.90 114.93 118.80 3hwo h MET 132 Ca -0.01 -0.16 -0.13 0.00 -2.06 0.00 0.00 59.70 57.35 3hwo h MET 132 Cb 1.16 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.77 3hwo h MET 132 CO 0.10 0.65 -0.39 0.28 1.06 0.00 0.00 176.91 178.61 3hwo h VAL 133 N 0.46 1.35 -0.52 -2.22 2.07 -0.94 -2.21 116.25 114.24 3hwo h VAL 133 Ca 0.08 -1.65 -0.00 0.00 0.82 0.00 0.00 66.70 65.95 3hwo h VAL 133 Cb 0.55 1.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 3hwo h VAL 133 CO 0.03 0.50 0.31 0.00 0.02 0.00 0.00 177.57 178.43 3hwo h ALA 134 N 0.56 0.66 0.00 1.67 0.00 -1.12 0.20 119.26 121.23 3hwo h ALA 134 Ca -0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 3hwo h ALA 134 Cb 1.00 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 3hwo h ALA 134 CO 0.08 0.15 -0.08 -0.09 0.00 0.00 0.00 179.25 179.31 3hwo h ARG 135 N 0.69 0.00 0.12 0.00 2.43 -1.17 -2.64 114.38 113.82 3hwo h ARG 135 Ca 0.18 0.00 -0.36 0.00 -0.81 0.00 0.00 59.98 59.00 3hwo h ARG 135 Cb -0.00 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 3hwo h ARG 135 CO -0.03 0.08 -1.93 0.00 -1.51 0.00 0.00 179.97 176.58 3hwo h ALA 136 N 1.92 0.42 -0.82 2.80 0.00 -1.14 -3.22 119.26 119.21 3hwo h ALA 136 Ca -0.00 -1.36 0.08 0.00 0.00 0.00 0.00 54.91 53.63 3hwo h ALA 136 Cb 0.61 0.64 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 3hwo h ALA 136 CO 0.01 1.29 0.48 0.00 0.00 0.00 0.00 179.25 181.04 3hwo h ALA 137 N 0.17 1.15 -0.37 0.00 0.00 -0.90 -2.30 119.26 117.01 3hwo h ALA 137 Ca -0.40 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.45 3hwo h ALA 137 Cb 2.04 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.65 3hwo h ALA 137 CO 0.10 0.15 -0.12 0.00 0.00 0.00 0.00 179.25 179.38 3hwo h ALA 138 N 1.43 1.10 0.00 0.00 0.00 -1.61 -2.60 119.26 117.59 3hwo h ALA 138 Ca 0.38 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3hwo h ALA 138 Cb 0.29 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3hwo h ALA 138 CO -0.22 0.56 0.00 -0.07 0.00 0.00 0.00 179.25 179.52 3hwo h LEU 139 N 0.59 0.00 0.00 0.00 3.38 -1.45 -2.89 115.31 114.94 3hwo h LEU 139 Ca 0.10 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 3hwo h LEU 139 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3hwo h LEU 139 CO 0.03 0.00 -0.57 0.71 0.09 0.00 0.00 178.44 178.71 3hwo h THR 140 N 0.00 0.52 0.00 0.22 1.35 -1.06 -3.17 112.91 110.77 3hwo h THR 140 Ca 0.00 -1.77 -0.08 0.00 -0.55 0.00 0.00 66.41 64.01 3hwo h THR 140 Cb 0.74 2.17 -0.01 0.00 -1.73 0.00 0.00 68.15 69.32 3hwo h THR 140 CO 0.00 0.29 -0.37 0.00 -0.25 0.00 0.00 175.52 175.20 3hwo h ALA 141 N 1.66 0.94 -2.38 6.62 0.00 -1.28 -3.41 119.26 121.42 3hwo h ALA 141 Ca -0.03 -0.33 -0.46 0.00 0.00 0.00 0.00 54.91 54.09 3hwo h ALA 141 Cb 1.29 -0.06 0.09 0.00 0.00 0.00 0.00 17.79 19.11 3hwo h ALA 141 CO 0.04 0.46 0.31 0.95 0.00 0.00 0.00 179.25 181.01 3hwo s THR 142 N -3.50 2.14 0.29 0.00 -4.23 -1.16 -4.98 115.64 104.19 3hwo s THR 142 Ca 0.01 -0.15 0.35 0.00 -1.18 0.00 0.00 61.69 60.72 3hwo s THR 142 Cb 0.10 -2.99 0.38 0.00 1.34 0.00 0.00 72.50 71.34 3hwo s THR 142 CO 0.69 0.00 2.08 1.55 -0.54 0.00 0.00 174.62 178.40 3hwo h PRO 143 N -0.87 0.00 -0.75 3.99 0.13 -1.87 -3.35 132.00 129.28 3hwo h PRO 143 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 3hwo h PRO 143 Cb 1.31 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.41 3hwo h PRO 143 CO 0.60 0.03 0.47 -0.56 -0.23 0.00 0.00 178.00 178.32 3hwo h GLN 144 N 0.00 1.01 -3.72 0.86 3.07 -1.93 -3.45 115.11 110.95 3hwo h GLN 144 Ca -0.00 -0.08 -0.13 0.00 0.09 0.00 0.00 58.65 58.54 3hwo h GLN 144 Cb 0.38 -0.22 -0.18 0.00 0.08 0.00 0.00 27.48 27.54 3hwo h GLN 144 CO 0.00 0.69 -0.50 0.14 0.09 0.00 0.00 178.83 179.25 3hwo s VAL 145 N -6.05 0.12 -0.21 1.86 -7.23 -1.20 -4.76 120.40 102.94 3hwo s VAL 145 Ca -0.13 -0.99 0.09 0.00 -1.81 0.00 0.00 61.98 59.13 3hwo s VAL 145 Cb 0.15 -0.81 -0.19 0.00 0.56 0.00 0.00 36.38 36.10 3hwo s VAL 145 CO 0.79 -0.55 -0.07 0.47 -0.31 0.00 0.00 175.10 175.42 3hwo n ASP 146 N 0.88 1.40 -3.72 4.85 10.43 0.96 -3.82 116.55 127.53 3hwo n ASP 146 Ca -0.20 -0.06 -0.12 0.00 2.57 0.00 0.00 54.79 56.98 3hwo n ASP 146 Cb 0.58 0.28 -0.12 0.00 1.84 0.00 0.00 41.12 43.69 3hwo n ASP 146 CO 0.00 0.00 0.00 -0.75 -1.07 0.00 0.00 177.20 175.38 3hwo s LYS 147 N -2.45 0.27 -0.03 -1.24 2.20 -0.58 -4.69 119.74 113.22 3hwo s LYS 147 Ca -0.20 0.61 0.06 0.00 -0.36 0.00 0.00 55.97 56.08 3hwo s LYS 147 Cb 0.07 -0.09 -0.01 0.00 -1.51 0.00 0.00 37.83 36.29 3hwo s LYS 147 CO 0.63 -0.16 -0.22 0.14 -0.36 0.00 0.00 175.35 175.39 3hwo s VAL 148 N 1.28 1.73 -0.19 4.02 -7.23 -1.12 0.68 120.40 119.57 3hwo s VAL 148 Ca -0.09 -0.92 -0.10 0.00 -1.81 0.00 0.00 61.98 59.07 3hwo s VAL 148 Cb -0.10 -1.45 -0.05 0.00 0.56 0.00 0.00 36.38 35.34 3hwo s VAL 148 CO -0.10 0.49 0.12 0.54 -0.31 0.00 0.00 175.10 175.85 3hwo s VAL 149 N -0.32 5.35 -0.08 1.32 0.11 0.22 -2.66 120.40 124.34 3hwo s VAL 149 Ca 0.03 0.17 0.02 0.00 -2.93 0.00 0.00 61.98 59.27 3hwo s VAL 149 Cb -0.10 -3.43 -0.02 0.00 -1.53 0.00 0.00 36.38 31.29 3hwo s VAL 149 CO 0.01 0.45 -0.14 -0.76 -3.33 0.00 0.00 175.10 171.33 3hwo s LEU 150 N 0.30 2.72 0.35 2.54 1.02 0.41 -4.84 118.68 121.18 3hwo s LEU 150 Ca 0.08 -0.25 0.09 0.00 0.02 0.00 0.00 54.13 54.07 3hwo s LEU 150 Cb -0.11 -1.57 -0.07 0.00 0.02 0.00 0.00 46.19 44.46 3hwo s LEU 150 CO -0.02 0.27 -0.07 -0.94 0.02 0.00 0.00 176.35 175.62 3hwo s SER 151 N -0.30 3.69 0.23 2.29 1.04 -1.26 -1.44 113.70 117.95 3hwo s SER 151 Ca 0.02 -1.23 0.01 0.00 0.48 0.00 0.00 55.95 55.23 3hwo s SER 151 Cb -0.13 -0.35 -0.04 0.00 0.10 0.00 0.00 66.02 65.61 3hwo s SER 151 CO 0.03 -0.26 0.16 0.00 0.98 0.00 0.00 173.24 174.14 3hwo s ARG 152 N -3.64 1.34 0.17 4.02 1.70 -0.16 -4.89 118.95 117.49 3hwo s ARG 152 Ca 0.33 -1.73 0.08 0.00 -0.47 0.00 0.00 55.73 53.94 3hwo s ARG 152 Cb 0.04 0.24 -0.04 0.00 -0.57 0.00 0.00 34.95 34.62 3hwo s ARG 152 CO 0.17 -0.44 -0.16 -0.51 -1.08 0.00 0.00 175.30 173.28 3hwo s LEU 153 N -3.22 2.47 -0.17 -1.89 1.02 -0.07 -2.33 118.68 114.50 3hwo s LEU 153 Ca 0.39 -0.91 0.00 0.00 0.02 0.00 0.00 54.13 53.64 3hwo s LEU 153 Cb 0.06 -0.70 0.03 0.00 0.02 0.00 0.00 46.19 45.60 3hwo s LEU 153 CO 0.15 -0.11 -0.10 -0.63 0.02 0.00 0.00 176.35 175.69 3hwo s ILE 154 N -2.42 1.40 -0.14 -0.59 1.01 -0.87 -1.69 121.20 117.90 3hwo s ILE 154 Ca 0.16 -0.71 -0.14 0.00 0.00 0.00 0.00 60.65 59.97 3hwo s ILE 154 Cb -0.04 -1.45 -0.05 0.00 0.01 0.00 0.00 42.46 40.94 3hwo s ILE 154 CO 0.06 0.26 0.30 -1.81 0.00 0.00 0.00 174.94 173.75 3hwo s ASP 155 N 1.52 6.48 -0.09 3.58 1.11 0.61 -0.07 116.67 129.81 3hwo s ASP 155 Ca 0.02 0.56 0.02 0.00 0.18 0.00 0.00 52.55 53.32 3hwo s ASP 155 Cb -0.15 -2.19 0.02 0.00 1.07 0.00 0.00 42.92 41.67 3hwo s ASP 155 CO -0.09 0.13 -0.13 -0.63 1.18 0.00 0.00 175.17 175.63 3hwo s ILE 156 N 0.25 1.30 -0.10 0.77 1.01 0.12 -0.56 121.20 123.99 3hwo s ILE 156 Ca 0.17 -0.54 -0.00 0.00 0.00 0.00 0.00 60.65 60.28 3hwo s ILE 156 Cb -0.13 -1.21 -0.03 0.00 0.01 0.00 0.00 42.46 41.10 3hwo s ILE 156 CO 0.05 0.40 -0.07 -0.89 0.00 0.00 0.00 174.94 174.43 3hwo s THR 157 N 0.96 3.62 0.37 2.92 2.01 -0.12 -0.69 115.64 124.72 3hwo s THR 157 Ca -0.08 -0.49 0.08 0.00 0.31 0.00 0.00 61.69 61.52 3hwo s THR 157 Cb -0.15 -2.51 -0.07 0.00 0.01 0.00 0.00 72.50 69.78 3hwo s THR 157 CO -0.00 0.56 -0.04 0.28 -0.69 0.00 0.00 174.62 174.72 3hwo s THR 158 N -0.28 2.17 -2.39 -0.82 -1.32 -0.28 0.21 115.64 112.92 3hwo s THR 158 Ca 0.04 -2.10 0.22 0.00 -1.21 0.00 0.00 61.69 58.64 3hwo s THR 158 Cb -0.13 -2.80 0.44 0.00 -1.51 0.00 0.00 72.50 68.50 3hwo s THR 158 CO 0.02 -0.12 1.51 -0.90 -2.21 0.00 0.00 174.62 172.93 3hwo n ASP 159 N -0.88 2.16 -3.77 8.08 5.75 -0.74 -4.76 116.55 122.40 3hwo n ASP 159 Ca -0.05 -1.78 -0.11 0.00 -0.01 0.00 0.00 54.79 52.84 3hwo n ASP 159 Cb 0.65 -0.12 -0.08 0.00 -1.03 0.00 0.00 41.12 40.54 3hwo n ASP 159 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3hwo s ALA 160 N -1.75 -0.62 0.25 2.12 0.00 -1.26 -5.07 121.76 115.43 3hwo s ALA 160 Ca 0.34 -0.03 -0.31 0.00 0.00 0.00 0.00 51.96 51.96 3hwo s ALA 160 Cb 0.19 0.30 -0.13 0.00 0.00 0.00 0.00 23.12 23.48 3hwo s ALA 160 CO 0.28 -0.40 1.46 0.00 0.00 0.00 0.00 175.76 177.11 3hwo n ALA 161 N 0.63 1.48 -2.67 0.00 0.00 -1.26 -4.47 120.51 114.22 3hwo n ALA 161 Ca -0.19 0.40 -0.42 0.00 0.00 0.00 0.00 53.44 53.23 3hwo n ALA 161 Cb 0.59 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.69 3hwo n ALA 161 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3hwo s ILE 162 N -0.03 4.81 -0.43 0.00 1.01 -0.46 -4.91 121.20 121.19 3hwo s ILE 162 Ca 0.67 1.83 -0.28 0.00 0.00 0.00 0.00 60.65 62.87 3hwo s ILE 162 Cb -0.61 -4.22 -0.01 0.00 0.01 0.00 0.00 42.46 37.63 3hwo s ILE 162 CO 0.49 -0.02 1.65 -0.62 0.00 0.00 0.00 174.94 176.44 3hwo s ASP 163 N 1.15 5.94 0.50 3.58 -1.08 -1.26 -4.84 116.67 120.67 3hwo s ASP 163 Ca 0.42 0.88 0.30 0.00 -0.52 0.00 0.00 52.55 53.64 3hwo s ASP 163 Cb -0.17 -2.53 1.05 0.00 -1.46 0.00 0.00 42.92 39.81 3hwo s ASP 163 CO 0.13 -1.74 1.86 0.77 0.52 0.00 0.00 175.17 176.71 3hwo h SER 164 N 12.40 0.00 -0.02 -0.34 4.64 -1.94 -3.04 113.55 125.25 3hwo h SER 164 Ca -0.30 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 60.92 3hwo h SER 164 Cb 1.14 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.24 3hwo h SER 164 CO 1.10 0.00 -0.38 1.23 -0.87 0.00 0.00 176.83 177.91 3hwo h GLY 165 N 2.67 0.32 1.16 -0.77 0.00 -1.91 -2.07 103.07 102.48 3hwo h GLY 165 Ca 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 46.77 3hwo h GLY 165 CO 0.00 0.47 0.34 -2.08 0.00 0.00 0.00 176.54 175.27 3hwo h VAL 166 N -0.29 1.24 -0.55 4.60 2.07 -1.88 -2.28 116.25 119.16 3hwo h VAL 166 Ca -0.04 -0.70 -0.09 0.00 0.82 0.00 0.00 66.70 66.69 3hwo h VAL 166 Cb 1.09 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 3hwo h VAL 166 CO 0.08 0.29 0.01 0.25 0.02 0.00 0.00 177.57 178.21 3hwo h LEU 167 N 1.07 0.94 -0.91 2.57 5.85 -1.56 -2.38 115.31 120.88 3hwo h LEU 167 Ca 0.26 -0.30 0.01 0.00 0.84 0.00 0.00 57.88 58.68 3hwo h LEU 167 Cb 0.13 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 40.87 3hwo h LEU 167 CO -0.03 1.02 0.59 0.25 -0.34 0.00 0.00 178.44 179.92 3hwo h LEU 168 N 0.84 1.06 -0.19 2.25 5.85 -0.95 -0.37 115.31 123.80 3hwo h LEU 168 Ca 0.16 -0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.88 3hwo h LEU 168 Cb 0.53 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 3hwo h LEU 168 CO 0.03 0.78 -0.10 -0.08 -0.34 0.00 0.00 178.44 178.73 3hwo h GLU 169 N 1.24 -0.08 -0.86 1.25 4.57 -1.19 -1.88 114.58 117.63 3hwo h GLU 169 Ca 0.33 0.01 0.01 0.00 -1.18 0.00 0.00 59.36 58.52 3hwo h GLU 169 Cb -0.12 0.02 -0.04 0.00 -0.16 0.00 0.00 28.75 28.45 3hwo h GLU 169 CO -0.07 -0.05 0.56 0.00 -1.18 0.00 0.00 179.01 178.27 3hwo h ARG 170 N -0.09 1.14 -0.63 1.92 3.08 -0.92 -1.72 114.38 117.17 3hwo h ARG 170 Ca 0.10 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 3hwo h ARG 170 Cb 0.24 -0.25 -0.03 0.00 0.08 0.00 0.00 29.97 30.01 3hwo h ARG 170 CO -0.24 0.76 0.24 1.25 -1.07 0.00 0.00 179.97 180.91 3hwo h LEU 171 N 1.17 0.87 -0.41 3.04 6.46 -0.79 -1.02 115.31 124.64 3hwo h LEU 171 Ca 0.31 -0.18 -0.06 0.00 -0.12 0.00 0.00 57.88 57.84 3hwo h LEU 171 Cb -0.12 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 39.56 3hwo h LEU 171 CO -0.07 0.82 0.02 0.40 -0.62 0.00 0.00 178.44 178.99 3hwo h ILE 172 N 0.88 1.25 -0.84 4.05 2.04 -1.18 0.10 117.51 123.82 3hwo h ILE 172 Ca 0.21 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 65.11 3hwo h ILE 172 Cb 0.22 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 3hwo h ILE 172 CO -0.02 0.33 0.56 0.00 0.00 0.00 0.00 178.15 179.02 3hwo h ALA 173 N 0.90 1.07 0.00 1.87 0.00 -1.11 -2.36 119.26 119.63 3hwo h ALA 173 Ca 0.12 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3hwo h ALA 173 Cb 0.44 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 3hwo h ALA 173 CO 0.02 0.46 -0.21 1.96 0.00 0.00 0.00 179.25 181.48 3hwo h GLN 174 N 1.13 0.00 -2.05 0.00 4.20 -1.02 -3.39 115.11 113.98 3hwo h GLN 174 Ca 0.31 0.00 -0.54 0.00 0.06 0.00 0.00 58.65 58.48 3hwo h GLN 174 Cb -0.12 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 27.27 3hwo h GLN 174 CO -0.07 0.02 -1.03 0.09 -0.67 0.00 0.00 178.83 177.17 3hwo n ASN 175 N -3.03 1.20 0.12 1.46 3.02 0.35 -4.83 115.26 113.54 3hwo n ASN 175 Ca 0.03 -2.97 0.04 0.00 -0.03 0.00 0.00 54.58 51.65 3hwo n ASN 175 Cb 0.55 -0.63 0.45 0.00 -0.61 0.00 0.00 39.78 39.53 3hwo n ASN 175 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3hwo h PRO 176 N 3.62 0.26 0.00 3.52 0.13 -1.65 -3.28 132.00 134.60 3hwo h PRO 176 Ca 0.10 -0.04 -0.11 0.00 -0.87 0.00 0.00 66.00 65.08 3hwo h PRO 176 Cb 0.85 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.91 3hwo h PRO 176 CO 0.55 0.29 -1.29 0.28 -0.23 0.00 0.00 178.00 177.61 3hwo n VAL 177 N -4.38 1.01 -1.72 1.56 0.31 -1.26 -4.99 118.33 108.86 3hwo n VAL 177 Ca -0.00 -0.65 -0.29 0.00 -0.01 0.00 0.00 64.34 63.39 3hwo n VAL 177 Cb 0.18 -0.61 0.15 0.00 -0.91 0.00 0.00 33.84 32.66 3hwo n VAL 177 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3hwo s SER 178 N -5.64 3.32 -0.78 4.52 1.04 -1.24 -4.92 113.70 110.00 3hwo s SER 178 Ca -0.02 0.63 -0.26 0.00 0.48 0.00 0.00 55.95 56.78 3hwo s SER 178 Cb 0.09 -0.95 0.03 0.00 0.10 0.00 0.00 66.02 65.29 3hwo s SER 178 CO 0.81 -2.64 1.34 -0.31 0.98 0.00 0.00 173.24 173.41 3hwo s TYR 179 N -3.54 2.30 -0.20 5.02 2.02 0.78 -4.70 117.35 119.02 3hwo s TYR 179 Ca 0.68 -0.15 -0.16 0.00 -0.37 0.00 0.00 57.07 57.07 3hwo s TYR 179 Cb -0.09 -4.62 -0.04 0.00 -0.40 0.00 0.00 41.96 36.81 3hwo s TYR 179 CO 0.52 -2.06 0.38 -0.80 -1.57 0.00 0.00 175.55 172.03 3hwo s ASN 180 N 4.14 6.42 0.15 2.29 0.01 -0.94 -0.86 114.94 126.15 3hwo s ASN 180 Ca 0.38 0.49 0.06 0.00 -0.71 0.00 0.00 52.86 53.08 3hwo s ASN 180 Cb -0.07 -2.22 -0.04 0.00 0.41 0.00 0.00 41.25 39.33 3hwo s ASN 180 CO 0.11 -0.06 -0.12 0.72 -1.51 0.00 0.00 177.10 176.23 3hwo s PHE 181 N 1.27 1.39 -0.28 2.20 -0.12 -0.39 -1.03 117.98 121.02 3hwo s PHE 181 Ca 0.18 -0.65 0.01 0.00 -0.05 0.00 0.00 56.93 56.43 3hwo s PHE 181 Cb -0.15 -0.70 0.16 0.00 -0.63 0.00 0.00 43.02 41.70 3hwo s PHE 181 CO 0.08 0.15 0.40 -1.58 -0.05 0.00 0.00 175.22 174.22 3hwo s HIS 182 N -2.80 -0.98 -0.13 3.49 2.46 -0.85 -1.92 115.29 114.57 3hwo s HIS 182 Ca 0.14 0.42 0.02 0.00 0.47 0.00 0.00 55.06 56.11 3hwo s HIS 182 Cb -0.01 -0.12 -0.00 0.00 -0.13 0.00 0.00 32.58 32.32 3hwo s HIS 182 CO 0.03 -0.94 -0.19 0.54 -2.47 0.00 0.00 174.74 171.70 3hwo s VAL 183 N 2.55 2.39 0.04 0.89 0.11 0.11 -1.35 120.40 125.14 3hwo s VAL 183 Ca 0.10 -0.88 -0.30 0.00 -2.93 0.00 0.00 61.98 57.97 3hwo s VAL 183 Cb -0.13 -1.97 -0.08 0.00 -1.53 0.00 0.00 36.38 32.67 3hwo s VAL 183 CO -0.28 0.54 1.71 -2.84 -3.33 0.00 0.00 175.10 170.90 3hwo s PRO 184 N 0.59 4.18 0.38 1.54 0.02 -1.26 -0.36 135.00 140.09 3hwo s PRO 184 Ca -0.11 2.35 0.04 0.00 0.02 0.00 0.00 61.00 63.30 3hwo s PRO 184 Cb -0.16 -3.76 -0.01 0.00 0.02 0.00 0.00 34.50 30.59 3hwo s PRO 184 CO 0.03 -0.80 0.55 -0.51 -0.33 0.00 0.00 177.00 175.95 3hwo s LEU 185 N 3.21 3.85 0.15 -5.54 1.02 -0.13 -4.95 118.68 116.30 3hwo s LEU 185 Ca 0.76 0.02 -0.07 0.00 0.02 0.00 0.00 54.13 54.86 3hwo s LEU 185 Cb -0.39 -2.93 -0.00 0.00 0.02 0.00 0.00 46.19 42.89 3hwo s LEU 185 CO 0.33 -0.53 1.43 0.00 0.02 0.00 0.00 176.35 177.60 3hwo h ALA 186 N 0.70 0.55 -2.02 4.21 0.00 -1.96 -3.37 119.26 117.37 3hwo h ALA 186 Ca -0.46 -0.54 -0.40 0.00 0.00 0.00 0.00 54.91 53.51 3hwo h ALA 186 Cb 1.25 -0.07 0.21 0.00 0.00 0.00 0.00 17.79 19.18 3hwo h ALA 186 CO 0.55 0.70 -0.01 0.16 0.00 0.00 0.00 179.25 180.65 3hwo s ASP 187 N -6.97 -0.05 0.00 0.00 1.47 -1.26 -4.85 116.67 105.01 3hwo s ASP 187 Ca -0.09 0.85 0.00 0.00 1.18 0.00 0.00 52.55 54.49 3hwo s ASP 187 Cb 0.10 -1.22 0.00 0.00 -0.34 0.00 0.00 42.92 41.47 3hwo s ASP 187 CO 0.87 -4.75 0.45 0.61 0.68 0.00 0.00 175.17 173.03 3hwo n GLY 188 N 0.40 1.14 3.67 2.12 0.00 -1.26 -4.91 105.19 106.34 3hwo n GLY 188 Ca 0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 3hwo n GLY 188 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hwo n GLY 189 N 0.09 -0.55 2.74 -0.02 0.00 -1.26 -4.82 105.19 101.38 3hwo n GLY 189 Ca 0.00 -1.85 -0.19 0.00 0.00 0.00 0.00 46.02 43.98 3hwo n GLY 189 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hwo s VAL 190 N -3.39 0.08 -0.17 1.61 1.01 -0.15 -0.96 120.40 118.44 3hwo s VAL 190 Ca 0.68 0.25 -0.19 0.00 0.00 0.00 0.00 61.98 62.72 3hwo s VAL 190 Cb -0.03 -0.27 -0.03 0.00 0.00 0.00 0.00 36.38 36.05 3hwo s VAL 190 CO 0.46 0.18 0.52 -0.22 0.00 0.00 0.00 175.10 176.04 3hwo s LEU 191 N 1.73 4.19 -0.02 3.92 2.96 0.52 -1.45 118.68 130.53 3hwo s LEU 191 Ca -0.00 0.75 0.01 0.00 -0.22 0.00 0.00 54.13 54.67 3hwo s LEU 191 Cb -0.13 -2.73 0.02 0.00 0.50 0.00 0.00 46.19 43.85 3hwo s LEU 191 CO -0.03 -0.13 -0.02 -0.22 -1.32 0.00 0.00 176.35 174.63 3hwo s LEU 192 N 1.30 1.45 -0.03 -0.68 1.98 -0.28 0.05 118.68 122.47 3hwo s LEU 192 Ca 0.25 -0.05 -0.30 0.00 -2.89 0.00 0.00 54.13 51.14 3hwo s LEU 192 Cb -0.15 -0.25 0.12 0.00 0.66 0.00 0.00 46.19 46.57 3hwo s LEU 192 CO 0.10 -0.05 1.31 -0.83 -1.89 0.00 0.00 176.35 174.99 3hwo s GLY 193 N 0.66 -0.35 -0.58 7.98 0.00 -0.81 0.03 107.32 114.26 3hwo s GLY 193 Ca -0.07 0.55 0.05 0.00 0.00 0.00 0.00 44.72 45.25 3hwo s GLY 193 CO -0.01 1.69 0.47 0.00 0.00 0.00 0.00 173.10 175.26 3hwo n ALA 194 N -0.61 3.23 -2.52 3.20 0.00 -0.46 -1.27 120.51 122.09 3hwo n ALA 194 Ca -0.05 -3.98 -0.41 0.00 0.00 0.00 0.00 53.44 48.99 3hwo n ALA 194 Cb 0.62 -0.90 -0.04 0.00 0.00 0.00 0.00 19.45 19.13 3hwo n ALA 194 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3hwo s SER 195 N -1.04 7.39 0.00 0.00 0.15 -0.04 -4.73 113.70 115.42 3hwo s SER 195 Ca 0.30 1.67 0.25 0.00 0.70 0.00 0.00 55.95 58.87 3hwo s SER 195 Cb 0.02 -2.56 0.83 0.00 -1.71 0.00 0.00 66.02 62.61 3hwo s SER 195 CO -0.16 -0.16 1.61 -0.81 1.20 0.00 0.00 173.24 174.93 3hwo n PRO 196 N 3.38 1.79 -3.81 5.44 -0.04 -1.26 -0.16 135.00 140.35 3hwo n PRO 196 Ca 0.04 -1.17 -0.37 0.00 -0.04 0.00 0.00 63.50 61.96 3hwo n PRO 196 Cb 0.50 -1.45 -0.13 0.00 -0.04 0.00 0.00 33.50 32.39 3hwo n PRO 196 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3hwo s GLU 197 N -1.89 2.50 -0.08 0.54 2.12 -1.26 -4.95 118.70 115.67 3hwo s GLU 197 Ca 0.35 -1.27 -0.30 0.00 0.36 0.00 0.00 54.97 54.11 3hwo s GLU 197 Cb 0.20 -3.37 -0.03 0.00 0.26 0.00 0.00 34.13 31.19 3hwo s GLU 197 CO 0.30 -0.69 1.23 -1.17 -0.54 0.00 0.00 175.26 174.39 3hwo s LEU 198 N 1.32 4.25 -0.19 2.70 2.96 -1.25 -1.60 118.68 126.87 3hwo s LEU 198 Ca -0.02 1.79 -0.07 0.00 -0.22 0.00 0.00 54.13 55.61 3hwo s LEU 198 Cb -0.20 -3.55 -0.21 0.00 0.50 0.00 0.00 46.19 42.73 3hwo s LEU 198 CO 0.01 -0.64 0.08 -0.11 -1.32 0.00 0.00 176.35 174.36 3hwo n LEU 199 N 5.60 2.57 -3.57 -0.68 -0.00 0.31 -1.59 117.00 119.63 3hwo n LEU 199 Ca 0.12 0.14 -0.00 0.00 -0.00 0.00 0.00 56.01 56.27 3hwo n LEU 199 Cb 0.46 -1.00 -0.04 0.00 -0.00 0.00 0.00 43.42 42.84 3hwo n LEU 199 CO 0.55 0.77 0.36 -0.22 -0.00 0.00 0.00 177.39 178.86 3hwo s LEU 200 N -7.04 -0.99 -0.14 -1.96 2.96 -0.15 -4.55 118.68 106.81 3hwo s LEU 200 Ca -0.29 1.34 -0.03 0.00 -0.22 0.00 0.00 54.13 54.93 3hwo s LEU 200 Cb 0.08 2.12 -0.03 0.00 0.50 0.00 0.00 46.19 48.86 3hwo s LEU 200 CO 0.66 -0.19 -0.04 -0.60 -1.32 0.00 0.00 176.35 174.86 3hwo s ARG 201 N 2.77 3.50 -0.16 1.98 3.52 0.75 0.06 118.95 131.37 3hwo s ARG 201 Ca -0.05 -0.52 0.00 0.00 -0.13 0.00 0.00 55.73 55.04 3hwo s ARG 201 Cb -0.10 -2.86 0.03 0.00 -1.56 0.00 0.00 34.95 30.46 3hwo s ARG 201 CO -0.19 0.33 -0.13 0.21 -0.81 0.00 0.00 175.30 174.72 3hwo s LYS 202 N 0.11 2.17 -0.37 5.12 2.20 -0.50 -0.59 119.74 127.88 3hwo s LYS 202 Ca -0.01 -0.60 0.03 0.00 -0.36 0.00 0.00 55.97 55.03 3hwo s LYS 202 Cb -0.14 -2.14 0.11 0.00 -1.51 0.00 0.00 37.83 34.15 3hwo s LYS 202 CO 0.03 -0.29 0.11 0.34 -0.36 0.00 0.00 175.35 175.18 3hwo s ASP 203 N 1.48 4.46 1.75 1.43 2.15 0.69 -1.60 116.67 127.03 3hwo s ASP 203 Ca 0.03 -2.26 0.00 0.00 0.43 0.00 0.00 52.55 50.76 3hwo s ASP 203 Cb -0.14 -1.44 0.00 0.00 -0.30 0.00 0.00 42.92 41.04 3hwo s ASP 203 CO -0.10 -0.35 0.00 0.61 -0.17 0.00 0.00 175.17 175.16 3hwo n GLY 204 N 4.10 2.94 0.21 2.66 0.00 -1.26 -2.65 105.19 111.19 3hwo n GLY 204 Ca 0.03 -0.21 0.11 0.00 0.00 0.00 0.00 46.02 45.95 3hwo n GLY 204 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3hwo h GLU 205 N 0.00 0.00 -6.63 1.61 9.09 -1.94 -3.45 114.58 113.26 3hwo h GLU 205 Ca 0.00 0.00 -0.51 0.00 0.05 0.00 0.00 59.36 58.90 3hwo h GLU 205 Cb 0.00 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.07 3hwo h GLU 205 CO 0.00 0.10 0.25 1.03 0.05 0.00 0.00 179.01 180.43 3hwo s ARG 206 N -3.22 4.66 0.05 1.06 0.52 -1.09 -2.25 118.95 118.69 3hwo s ARG 206 Ca 0.06 1.28 0.02 0.00 -0.52 0.00 0.00 55.73 56.56 3hwo s ARG 206 Cb 0.06 -3.23 -0.03 0.00 0.52 0.00 0.00 34.95 32.27 3hwo s ARG 206 CO 0.67 0.53 -0.06 -0.59 0.02 0.00 0.00 175.30 175.87 3hwo s PHE 207 N -1.20 0.65 0.04 -0.53 -0.12 0.03 -0.22 117.98 116.63 3hwo s PHE 207 Ca 0.39 -0.64 -0.03 0.00 -0.05 0.00 0.00 56.93 56.59 3hwo s PHE 207 Cb -0.24 -0.40 -0.02 0.00 -0.63 0.00 0.00 43.02 41.74 3hwo s PHE 207 CO 0.28 -0.14 0.04 -1.54 -0.05 0.00 0.00 175.22 173.81 3hwo s SER 208 N -1.99 0.28 -0.00 1.98 1.04 0.24 -1.26 113.70 114.00 3hwo s SER 208 Ca -0.05 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 55.70 3hwo s SER 208 Cb -0.05 0.20 0.00 0.00 0.10 0.00 0.00 66.02 66.27 3hwo s SER 208 CO -0.02 -0.51 -0.00 -0.55 0.98 0.00 0.00 173.24 173.14 3hwo s SER 209 N -2.30 0.05 -0.54 7.02 0.15 -0.95 -0.18 113.70 116.95 3hwo s SER 209 Ca -0.03 -0.01 0.05 0.00 0.70 0.00 0.00 55.95 56.67 3hwo s SER 209 Cb 0.01 -0.01 0.20 0.00 -1.71 0.00 0.00 66.02 64.50 3hwo s SER 209 CO -0.06 0.00 0.49 -0.38 1.20 0.00 0.00 173.24 174.49 3hwo n ILE 210 N 3.10 0.35 -1.87 6.45 5.41 -0.62 0.20 119.36 132.38 3hwo n ILE 210 Ca -0.13 -4.27 -0.40 0.00 1.00 0.00 0.00 62.75 58.95 3hwo n ILE 210 Cb 0.60 -1.95 0.00 0.00 -0.71 0.00 0.00 39.64 37.58 3hwo n ILE 210 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 3hwo s PRO 211 N -1.05 3.98 0.30 0.38 0.04 -1.21 -3.88 135.00 133.55 3hwo s PRO 211 Ca 0.32 2.42 0.09 0.00 0.04 0.00 0.00 61.00 63.87 3hwo s PRO 211 Cb 0.05 -2.85 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 3hwo s PRO 211 CO -0.14 -0.58 0.06 -0.51 0.04 0.00 0.00 177.00 175.86 3hwo s LEU 212 N -2.32 3.22 0.00 -3.56 1.43 -1.26 -2.02 118.68 114.17 3hwo s LEU 212 Ca 0.56 -0.72 0.00 0.00 -1.03 0.00 0.00 54.13 52.94 3hwo s LEU 212 Cb -0.44 -1.71 0.00 0.00 0.03 0.00 0.00 46.19 44.08 3hwo s LEU 212 CO 0.58 -0.14 0.00 0.00 0.23 0.00 0.00 176.35 177.02 3hwo n ALA 213 N -1.01 0.00 0.00 4.21 0.00 -1.00 -4.77 120.51 117.95 3hwo n ALA 213 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3hwo n ALA 213 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 3hwo n ALA 213 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hwo n GLY 214 N 0.00 2.35 3.17 0.00 0.00 -1.26 -4.04 105.19 105.40 3hwo n GLY 214 Ca 0.00 -1.34 -0.11 0.00 0.00 0.00 0.00 46.02 44.57 3hwo n GLY 214 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hwo s SER 215 N 0.00 0.01 -0.11 1.61 0.01 -1.26 -2.17 113.70 111.79 3hwo s SER 215 Ca 0.00 -0.27 -0.10 0.00 1.31 0.00 0.00 55.95 56.90 3hwo s SER 215 Cb 0.00 0.27 0.03 0.00 0.21 0.00 0.00 66.02 66.53 3hwo s SER 215 CO 0.00 -0.49 0.28 0.00 0.41 0.00 0.00 173.24 173.44 3hwo s ALA 216 N -2.08 -0.70 0.42 1.44 0.00 -0.67 -4.96 121.76 115.20 3hwo s ALA 216 Ca -0.09 0.83 -0.26 0.00 0.00 0.00 0.00 51.96 52.44 3hwo s ALA 216 Cb -0.03 -0.49 -0.10 0.00 0.00 0.00 0.00 23.12 22.50 3hwo s ALA 216 CO -0.01 -0.14 1.38 -2.13 0.00 0.00 0.00 175.76 174.85 3hwo n ARG 217 N 3.04 2.22 -2.59 0.00 0.63 -1.26 -0.57 116.66 118.13 3hwo n ARG 217 Ca -0.14 0.79 -0.31 0.00 -0.92 0.00 0.00 57.85 57.27 3hwo n ARG 217 Cb 0.58 -2.53 -0.02 0.00 0.45 0.00 0.00 32.46 30.93 3hwo n ARG 217 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 3hwo s ARG 218 N -2.25 3.78 0.06 -0.14 0.52 -0.78 -4.72 118.95 115.42 3hwo s ARG 218 Ca 0.59 0.61 0.07 0.00 -0.52 0.00 0.00 55.73 56.47 3hwo s ARG 218 Cb -0.48 -2.28 -0.03 0.00 0.52 0.00 0.00 34.95 32.67 3hwo s ARG 218 CO 0.59 -0.18 -0.16 -0.65 0.02 0.00 0.00 175.30 174.92 3hwo s GLN 219 N -4.17 2.08 0.41 3.54 -1.52 -1.26 -4.98 119.66 113.76 3hwo s GLN 219 Ca 0.53 -0.99 0.18 0.00 -1.95 0.00 0.00 55.36 53.13 3hwo s GLN 219 Cb -0.10 -2.22 1.09 0.00 -0.22 0.00 0.00 33.01 31.56 3hwo s GLN 219 CO 0.35 0.53 1.80 -1.35 -0.25 0.00 0.00 175.29 176.38 3hwo h PRO 220 N 4.29 0.39 -5.46 2.91 0.11 -1.98 -3.42 132.00 128.83 3hwo h PRO 220 Ca -0.48 -0.02 -0.67 0.00 0.11 0.00 0.00 66.00 64.93 3hwo h PRO 220 Cb 1.16 -0.09 -0.29 0.00 0.11 0.00 0.00 31.00 31.89 3hwo h PRO 220 CO 0.48 0.26 -0.82 0.34 -0.21 0.00 0.00 178.00 178.06 3hwo s ASP 221 N -5.41 3.58 0.00 -2.05 2.15 -1.26 -5.02 116.67 108.67 3hwo s ASP 221 Ca -0.08 -0.42 0.00 0.00 0.43 0.00 0.00 52.55 52.47 3hwo s ASP 221 Cb 0.24 -1.41 0.00 0.00 -0.30 0.00 0.00 42.92 41.45 3hwo s ASP 221 CO 0.79 0.18 0.25 -1.84 -0.17 0.00 0.00 175.17 174.39 3hwo n GLU 222 N 3.38 0.40 -0.09 4.34 -0.00 -1.26 -1.86 120.64 125.55 3hwo n GLU 222 Ca -0.18 0.00 -0.14 0.00 -0.00 0.00 0.00 57.16 56.84 3hwo n GLU 222 Cb 0.53 -1.15 -0.05 0.00 -0.00 0.00 0.00 31.44 30.77 3hwo n GLU 222 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 3hwo n VAL 223 N 0.11 1.39 0.60 3.84 0.31 -1.26 -3.82 118.33 119.50 3hwo n VAL 223 Ca 0.00 -0.01 0.08 0.00 -0.01 0.00 0.00 64.34 64.40 3hwo n VAL 223 Cb 0.08 -2.08 0.37 0.00 -0.91 0.00 0.00 33.84 31.30 3hwo n VAL 223 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3hwo n LEU 224 N -4.21 0.00 -0.07 7.52 4.77 -0.89 -2.54 117.00 121.58 3hwo n LEU 224 Ca -0.25 0.49 -0.21 0.00 -0.03 0.00 0.00 56.01 56.01 3hwo n LEU 224 Cb 0.58 -0.49 -0.12 0.00 -2.33 0.00 0.00 43.42 41.06 3hwo n LEU 224 CO 0.12 -0.20 -0.51 -0.78 -1.33 0.00 0.00 177.39 174.69 3hwo h ASP 225 N 0.00 0.11 0.27 -1.43 1.82 -1.61 -3.15 116.42 112.44 3hwo h ASP 225 Ca 0.00 -0.65 0.00 0.00 -0.39 0.00 0.00 57.03 55.99 3hwo h ASP 225 Cb 0.29 -0.04 0.00 0.00 0.68 0.00 0.00 39.33 40.27 3hwo h ASP 225 CO 0.00 1.55 0.00 -1.14 -1.61 0.00 0.00 179.24 178.04 3hwo n ARG 226 N -4.22 0.19 -0.04 0.28 3.00 -1.05 -1.99 116.66 112.83 3hwo n ARG 226 Ca -0.30 0.16 -0.02 0.00 -0.00 0.00 0.00 57.85 57.69 3hwo n ARG 226 Cb 0.76 -1.50 -0.08 0.00 0.00 0.00 0.00 32.46 31.64 3hwo n ARG 226 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.63 176.78 3hwo n GLU 227 N -1.29 1.72 -0.29 -0.14 0.28 -1.14 -3.79 120.64 115.98 3hwo n GLU 227 Ca 0.06 -0.03 0.12 0.00 -0.16 0.00 0.00 57.16 57.15 3hwo n GLU 227 Cb 0.11 -1.26 0.36 0.00 1.43 0.00 0.00 31.44 32.08 3hwo n GLU 227 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3hwo h ALA 228 N 0.66 1.80 -0.11 -1.84 0.00 -1.35 0.58 119.26 118.99 3hwo h ALA 228 Ca -0.19 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.61 3hwo h ALA 228 Cb 1.28 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.94 3hwo h ALA 228 CO 0.01 -0.06 -0.45 0.78 0.00 0.00 0.00 179.25 179.54 3hwo h GLY 229 N 0.72 0.55 0.49 0.00 0.00 -1.71 -1.99 103.07 101.13 3hwo h GLY 229 Ca 0.47 -0.75 0.11 0.00 0.00 0.00 0.00 47.33 47.16 3hwo h GLY 229 CO -0.23 0.67 0.54 3.43 0.00 0.00 0.00 176.54 180.95 3hwo h ASN 230 N 0.10 0.78 -0.60 0.19 2.35 -1.41 -1.27 115.58 115.73 3hwo h ASN 230 Ca -0.02 0.05 -0.07 0.00 -0.55 0.00 0.00 56.30 55.71 3hwo h ASN 230 Cb 1.08 -0.10 -0.03 0.00 0.05 0.00 0.00 38.32 39.32 3hwo h ASN 230 CO 0.09 0.43 0.13 -0.09 -1.65 0.00 0.00 177.43 176.34 3hwo h ARG 231 N 0.88 1.00 -0.85 0.81 2.43 0.16 -2.71 114.38 116.08 3hwo h ARG 231 Ca 0.45 -0.23 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 3hwo h ARG 231 Cb 0.43 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.81 3hwo h ARG 231 CO -0.26 0.90 0.46 1.25 -1.51 0.00 0.00 179.97 180.81 3hwo h LEU 232 N 0.95 1.08 -1.48 3.80 5.85 -0.48 0.75 115.31 125.78 3hwo h LEU 232 Ca 0.20 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.83 3hwo h LEU 232 Cb 0.37 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.09 3hwo h LEU 232 CO 0.00 0.88 0.37 0.25 -0.34 0.00 0.00 178.44 179.60 3hwo h LEU 233 N 1.20 0.61 0.20 2.25 5.85 -1.01 -2.98 115.31 121.42 3hwo h LEU 233 Ca 0.30 -0.01 -0.28 0.00 0.84 0.00 0.00 57.88 58.73 3hwo h LEU 233 Cb 0.05 -0.15 0.03 0.00 0.37 0.00 0.00 40.66 40.96 3hwo h LEU 233 CO -0.05 0.43 -1.25 0.00 -0.34 0.00 0.00 178.44 177.24 3hwo h ALA 234 N 1.66 -0.09 -1.05 1.25 0.00 -1.12 -3.48 119.26 116.44 3hwo h ALA 234 Ca 0.21 -0.84 -0.86 0.00 0.00 0.00 0.00 54.91 53.42 3hwo h ALA 234 Cb -0.02 0.20 0.01 0.00 0.00 0.00 0.00 17.79 17.98 3hwo h ALA 234 CO -0.05 0.61 0.64 0.45 0.00 0.00 0.00 179.25 180.90 3hwo n SER 235 N -3.88 1.18 0.06 0.00 2.88 0.20 -4.87 113.62 109.19 3hwo n SER 235 Ca -0.17 1.18 -0.08 0.00 -1.33 0.00 0.00 58.87 58.47 3hwo n SER 235 Cb 0.98 -0.91 -0.12 0.00 -0.75 0.00 0.00 64.21 63.41 3hwo n SER 235 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 3hwo h GLU 236 N 4.97 0.02 0.12 -1.46 4.39 -1.91 -1.57 114.58 119.13 3hwo h GLU 236 Ca -0.45 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.23 3hwo h GLU 236 Cb 1.37 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 30.02 3hwo h GLU 236 CO 0.94 0.98 -0.10 -0.22 -1.16 0.00 0.00 179.01 179.45 3hwo h LYS 237 N 0.00 -0.23 -0.37 2.33 3.11 -1.97 -0.16 116.57 119.28 3hwo h LYS 237 Ca -0.04 0.02 -0.15 0.00 -2.81 0.00 0.00 60.65 57.67 3hwo h LYS 237 Cb 1.80 0.05 -0.01 0.00 -1.00 0.00 0.00 32.23 33.07 3hwo h LYS 237 CO 0.13 -0.15 -0.35 -0.44 -2.81 0.00 0.00 179.45 175.83 3hwo h ASP 238 N -0.24 0.91 -0.54 4.20 3.32 -1.91 0.07 116.42 122.23 3hwo h ASP 238 Ca 0.00 -0.40 -0.07 0.00 0.02 0.00 0.00 57.03 56.59 3hwo h ASP 238 Cb 0.22 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.49 3hwo h ASP 238 CO -0.02 1.16 0.10 0.03 -1.72 0.00 0.00 179.24 178.79 3hwo h ARG 239 N 0.72 0.94 -0.23 3.56 2.47 -1.19 0.45 114.38 121.09 3hwo h ARG 239 Ca 0.07 -0.23 -0.12 0.00 -1.26 0.00 0.00 59.98 58.45 3hwo h ARG 239 Cb 0.92 -0.12 -0.00 0.00 -1.65 0.00 0.00 29.97 29.11 3hwo h ARG 239 CO 0.08 0.87 -0.31 1.25 0.56 0.00 0.00 179.97 182.42 3hwo h HIS 240 N 0.89 0.76 -0.42 3.04 2.76 -0.92 0.27 115.15 121.53 3hwo h HIS 240 Ca 0.18 -0.25 0.06 0.00 -2.20 0.00 0.00 60.37 58.16 3hwo h HIS 240 Cb 0.38 -0.15 -0.09 0.00 1.55 0.00 0.00 27.41 29.10 3hwo h HIS 240 CO 0.02 0.98 -0.52 1.49 -1.30 0.00 0.00 177.93 178.60 3hwo h GLU 241 N 0.32 -0.36 -0.50 5.26 4.81 -0.71 -1.99 114.58 121.41 3hwo h GLU 241 Ca 0.03 0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.31 3hwo h GLU 241 Cb 0.89 0.08 -0.04 0.00 0.63 0.00 0.00 28.75 30.31 3hwo h GLU 241 CO 0.07 -0.24 0.28 1.25 -0.73 0.00 0.00 179.01 179.64 3hwo h HIS 242 N -0.38 0.52 -0.66 0.92 2.76 0.09 -2.94 115.15 115.45 3hwo h HIS 242 Ca 0.09 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.28 3hwo h HIS 242 Cb 0.59 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 29.36 3hwo h HIS 242 CO -0.70 0.28 0.42 1.49 -1.30 0.00 0.00 177.93 178.11 3hwo h GLU 243 N 0.55 0.89 -0.90 5.26 4.57 -0.51 -2.23 114.58 122.20 3hwo h GLU 243 Ca 0.21 -0.06 0.05 0.00 -1.18 0.00 0.00 59.36 58.38 3hwo h GLU 243 Cb 0.07 -0.19 -0.06 0.00 -0.16 0.00 0.00 28.75 28.41 3hwo h GLU 243 CO -0.12 0.61 0.57 1.25 -1.18 0.00 0.00 179.01 180.14 3hwo h LEU 244 N 0.91 0.92 -0.19 1.64 5.85 -1.19 -2.22 115.31 121.04 3hwo h LEU 244 Ca 0.24 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.95 3hwo h LEU 244 Cb -0.07 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.76 3hwo h LEU 244 CO -0.05 0.61 0.06 0.58 -0.34 0.00 0.00 178.44 179.30 3hwo h VAL 245 N 1.07 1.18 -0.16 1.05 2.07 -1.44 -3.20 116.25 116.82 3hwo h VAL 245 Ca 0.38 -0.56 -0.21 0.00 0.82 0.00 0.00 66.70 67.13 3hwo h VAL 245 Cb 0.11 1.20 0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3hwo h VAL 245 CO -0.15 0.18 -0.72 0.71 0.02 0.00 0.00 177.57 177.60 3hwo h THR 246 N 0.13 1.28 -0.71 2.57 1.35 -1.22 -2.99 112.91 113.32 3hwo h THR 246 Ca 0.06 -1.93 -0.00 0.00 -0.55 0.00 0.00 66.41 63.99 3hwo h THR 246 Cb 0.22 1.97 -0.03 0.00 -1.73 0.00 0.00 68.15 68.57 3hwo h THR 246 CO -0.00 0.61 0.43 -0.61 -0.25 0.00 0.00 175.52 175.70 3hwo h GLN 247 N 0.51 0.96 -0.32 4.72 -0.00 -1.54 -1.75 115.11 117.70 3hwo h GLN 247 Ca -0.04 -0.08 0.04 0.00 -0.00 0.00 0.00 58.65 58.57 3hwo h GLN 247 Cb 1.35 -0.20 -0.04 0.00 0.00 0.00 0.00 27.48 28.59 3hwo h GLN 247 CO 0.15 0.68 0.07 0.00 0.00 0.00 0.00 178.83 179.73 3hwo h ALA 248 N 1.23 0.34 0.00 3.38 0.00 -1.53 -2.67 119.26 120.01 3hwo h ALA 248 Ca 0.26 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 3hwo h ALA 248 Cb -0.04 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3hwo h ALA 248 CO -0.05 -0.34 -0.59 0.00 0.00 0.00 0.00 179.25 178.27 3hwo h MET 249 N 0.18 0.00 -0.03 0.00 -0.00 -1.36 -2.70 114.93 111.02 3hwo h MET 249 Ca 0.15 0.00 0.03 0.00 -0.00 0.00 0.00 59.70 59.88 3hwo h MET 249 Cb 0.16 0.00 -0.06 0.00 -0.00 0.00 0.00 31.60 31.70 3hwo h MET 249 CO -0.19 0.59 -0.49 0.87 -0.00 0.00 0.00 176.91 177.69 3hwo h LYS 250 N 0.00 -0.59 -0.43 -0.10 1.57 -1.06 -0.33 116.57 115.63 3hwo h LYS 250 Ca -0.01 0.04 0.04 0.00 -1.87 0.00 0.00 60.65 58.85 3hwo h LYS 250 Cb 1.26 0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.67 3hwo h LYS 250 CO 0.08 -0.39 0.20 0.93 -0.57 0.00 0.00 179.45 179.69 3hwo h GLU 251 N -0.61 0.39 -0.25 3.15 4.39 -1.42 -0.69 114.58 119.53 3hwo h GLU 251 Ca 0.03 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.67 3hwo h GLU 251 Cb 0.69 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 29.24 3hwo h GLU 251 CO -0.36 0.26 -0.03 0.28 -1.16 0.00 0.00 179.01 177.99 3hwo h VAL 252 N 0.40 1.17 0.00 3.13 2.07 -1.33 -2.79 116.25 118.90 3hwo h VAL 252 Ca 0.19 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 67.01 3hwo h VAL 252 Cb 0.12 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3hwo h VAL 252 CO -0.15 0.23 -0.65 -0.07 0.02 0.00 0.00 177.57 176.96 3hwo h LEU 253 N 0.37 0.00 -0.72 2.57 3.38 -0.38 -3.40 115.31 117.12 3hwo h LEU 253 Ca 0.08 -0.19 0.07 0.00 0.09 0.00 0.00 57.88 57.93 3hwo h LEU 253 Cb 0.30 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 40.96 3hwo h LEU 253 CO 0.01 0.10 -0.45 0.03 0.09 0.00 0.00 178.44 178.22 3hwo h ARG 254 N 0.00 -0.03 -0.93 1.13 3.08 -0.86 -1.75 114.38 115.03 3hwo h ARG 254 Ca 0.00 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.72 3hwo h ARG 254 Cb 0.77 0.01 -0.20 0.00 0.08 0.00 0.00 29.97 30.63 3hwo h ARG 254 CO 0.00 -0.02 0.43 0.39 -1.07 0.00 0.00 179.97 179.70 3hwo n GLU 255 N -4.72 2.46 0.00 0.04 1.02 -1.26 -3.97 120.64 114.21 3hwo n GLU 255 Ca 0.01 -2.47 0.00 0.00 -0.02 0.00 0.00 57.16 54.68 3hwo n GLU 255 Cb 0.20 -1.99 0.00 0.00 -0.02 0.00 0.00 31.44 29.63 3hwo n GLU 255 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3hwo n ARG 256 N -0.56 4.01 -5.05 3.49 5.12 -0.70 -5.05 116.66 117.92 3hwo n ARG 256 Ca 0.43 0.00 -0.32 0.00 -1.93 0.00 0.00 57.85 56.03 3hwo n ARG 256 Cb 1.37 -0.55 -0.15 0.00 -1.16 0.00 0.00 32.46 31.96 3hwo n ARG 256 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 3hwo s SER 257 N -1.03 3.54 0.03 0.55 0.01 -0.95 -4.20 113.70 111.65 3hwo s SER 257 Ca 0.00 -0.39 -0.09 0.00 1.31 0.00 0.00 55.95 56.77 3hwo s SER 257 Cb 0.00 -1.06 -0.04 0.00 0.21 0.00 0.00 66.02 65.13 3hwo s SER 257 CO 0.00 0.25 1.15 0.28 0.41 0.00 0.00 173.24 175.33 3hwo h SER 258 N 6.07 -0.43 -3.46 2.44 0.02 -1.19 -3.46 113.55 113.54 3hwo h SER 258 Ca -0.33 0.04 -0.44 0.00 -0.84 0.00 0.00 61.79 60.23 3hwo h SER 258 Cb 1.18 0.16 -0.14 0.00 0.14 0.00 0.00 62.40 63.74 3hwo h SER 258 CO 0.50 -0.15 -0.64 -1.83 -1.14 0.00 0.00 176.83 173.56 3hwo s GLU 259 N -3.75 1.49 -0.30 3.45 -1.05 -1.25 -4.99 118.70 112.31 3hwo s GLU 259 Ca -0.04 -1.78 -0.10 0.00 -0.15 0.00 0.00 54.97 52.89 3hwo s GLU 259 Cb 0.02 -0.82 0.13 0.00 -0.44 0.00 0.00 34.13 33.02 3hwo s GLU 259 CO 0.16 -0.10 0.66 -1.17 0.95 0.00 0.00 175.26 175.76 3hwo s LEU 260 N -3.40 -1.14 -0.15 1.83 2.96 -1.26 -2.22 118.68 115.31 3hwo s LEU 260 Ca 0.32 1.56 -0.02 0.00 -0.22 0.00 0.00 54.13 55.76 3hwo s LEU 260 Cb 0.06 2.30 -0.02 0.00 0.50 0.00 0.00 46.19 49.03 3hwo s LEU 260 CO 0.12 -0.22 -0.07 -2.28 -1.32 0.00 0.00 176.35 172.58 3hwo s HIS 261 N 2.88 2.94 -0.10 5.38 5.65 0.32 -5.00 115.29 127.37 3hwo s HIS 261 Ca -0.06 -0.43 -0.03 0.00 0.25 0.00 0.00 55.06 54.79 3hwo s HIS 261 Cb -0.12 -1.91 0.04 0.00 -1.18 0.00 0.00 32.58 29.41 3hwo s HIS 261 CO -0.19 -0.10 0.05 0.08 -0.65 0.00 0.00 174.74 173.93 3hwo s VAL 262 N 0.36 0.10 0.45 0.89 1.01 -1.26 -1.88 120.40 120.06 3hwo s VAL 262 Ca -0.07 0.08 -0.24 0.00 0.00 0.00 0.00 61.98 61.75 3hwo s VAL 262 Cb -0.15 -0.46 -0.09 0.00 0.00 0.00 0.00 36.38 35.68 3hwo s VAL 262 CO 0.04 0.04 1.26 -2.65 0.00 0.00 0.00 175.10 173.78 3hwo n PRO 263 N 5.23 1.82 0.03 2.72 -0.02 -1.26 -4.91 135.00 138.61 3hwo n PRO 263 Ca -0.06 0.65 0.12 0.00 -2.02 0.00 0.00 63.50 62.20 3hwo n PRO 263 Cb 0.49 -2.39 0.26 0.00 -0.02 0.00 0.00 33.50 31.85 3hwo n PRO 263 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3hwo n SER 264 N 0.00 0.55 -4.26 2.55 3.41 -1.26 -4.80 113.62 109.80 3hwo n SER 264 Ca 0.08 0.04 -0.30 0.00 -0.26 0.00 0.00 58.87 58.43 3hwo n SER 264 Cb 0.41 0.08 -0.16 0.00 -0.26 0.00 0.00 64.21 64.28 3hwo n SER 264 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3hwo s SER 265 N -3.62 2.80 0.93 4.04 0.01 -1.26 -5.10 113.70 111.51 3hwo s SER 265 Ca 0.09 -0.44 -0.12 0.00 1.31 0.00 0.00 55.95 56.79 3hwo s SER 265 Cb 0.16 -0.42 0.15 0.00 0.21 0.00 0.00 66.02 66.11 3hwo s SER 265 CO 0.69 0.28 1.12 -2.16 0.41 0.00 0.00 173.24 173.57 3hwo s PRO 266 N -0.46 0.99 0.18 12.44 0.04 -1.26 -4.94 135.00 141.98 3hwo s PRO 266 Ca 0.06 0.41 0.05 0.00 0.04 0.00 0.00 61.00 61.57 3hwo s PRO 266 Cb -0.10 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.58 3hwo s PRO 266 CO 0.00 -2.33 -0.10 1.14 0.04 0.00 0.00 177.00 175.75 3hwo s GLN 267 N -5.15 1.17 0.12 4.56 -2.07 0.21 -4.88 119.66 113.62 3hwo s GLN 267 Ca 0.64 -1.52 -0.30 0.00 -1.82 0.00 0.00 55.36 52.36 3hwo s GLN 267 Cb -0.16 -0.75 -0.06 0.00 -1.09 0.00 0.00 33.01 30.94 3hwo s GLN 267 CO 0.55 0.08 0.95 -0.51 -1.32 0.00 0.00 175.29 175.03 3hwo s LEU 268 N -3.23 4.51 0.17 2.60 1.43 -1.26 -0.17 118.68 122.73 3hwo s LEU 268 Ca 0.20 1.78 0.04 0.00 -1.03 0.00 0.00 54.13 55.13 3hwo s LEU 268 Cb 0.02 -3.57 -0.05 0.00 0.03 0.00 0.00 46.19 42.63 3hwo s LEU 268 CO 0.03 -0.04 -0.08 0.27 0.23 0.00 0.00 176.35 176.77 3hwo s ILE 269 N -0.10 1.14 0.15 -0.59 -5.25 -0.52 -4.91 121.20 111.11 3hwo s ILE 269 Ca 0.46 -2.06 0.10 0.00 -0.99 0.00 0.00 60.65 58.16 3hwo s ILE 269 Cb -0.23 -1.99 -0.04 0.00 2.95 0.00 0.00 42.46 43.15 3hwo s ILE 269 CO 0.30 -0.63 -0.18 -0.89 -1.79 0.00 0.00 174.94 171.75 3hwo s THR 270 N -3.35 2.77 0.20 8.37 2.01 -1.26 -1.22 115.64 123.16 3hwo s THR 270 Ca 0.20 -1.67 0.06 0.00 0.31 0.00 0.00 61.69 60.59 3hwo s THR 270 Cb 0.03 -2.30 -0.05 0.00 0.01 0.00 0.00 72.50 70.19 3hwo s THR 270 CO 0.03 0.01 -0.10 -0.89 -0.69 0.00 0.00 174.62 172.98 3hwo s THR 271 N -1.36 1.41 -0.26 -0.82 2.01 0.22 -4.98 115.64 111.87 3hwo s THR 271 Ca 0.20 -2.12 0.19 0.00 0.31 0.00 0.00 61.69 60.27 3hwo s THR 271 Cb -0.10 -2.08 0.19 0.00 0.01 0.00 0.00 72.50 70.53 3hwo s THR 271 CO 0.11 -0.57 1.57 -2.65 -0.69 0.00 0.00 174.62 172.39 3hwo n PRO 272 N -0.35 0.12 -0.05 4.92 -0.02 -1.26 -3.30 135.00 135.07 3hwo n PRO 272 Ca -0.08 0.62 -0.06 0.00 -2.02 0.00 0.00 63.50 61.96 3hwo n PRO 272 Cb 0.61 -1.93 -0.05 0.00 -0.02 0.00 0.00 33.50 32.12 3hwo n PRO 272 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 3hwo n THR 273 N -2.17 0.54 -4.04 3.45 -1.04 -1.26 -4.88 114.28 104.89 3hwo n THR 273 Ca -0.01 -0.24 -0.13 0.00 -2.04 0.00 0.00 64.05 61.63 3hwo n THR 273 Cb 0.05 -0.83 -0.13 0.00 -1.82 0.00 0.00 70.33 67.61 3hwo n THR 273 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3hwo s LEU 274 N -5.27 2.14 0.05 -4.42 1.43 -1.21 -1.86 118.68 109.54 3hwo s LEU 274 Ca -0.10 -0.32 -0.22 0.00 -1.03 0.00 0.00 54.13 52.46 3hwo s LEU 274 Cb 0.03 -0.11 -0.06 0.00 0.03 0.00 0.00 46.19 46.08 3hwo s LEU 274 CO 0.25 -0.11 0.66 0.26 0.23 0.00 0.00 176.35 177.64 3hwo s TRP 275 N -0.80 3.75 0.17 0.29 0.52 0.27 -0.61 118.94 122.53 3hwo s TRP 275 Ca -0.06 1.35 0.06 0.00 0.02 0.00 0.00 56.10 57.47 3hwo s TRP 275 Cb -0.06 -2.67 -0.04 0.00 -1.15 0.00 0.00 33.47 29.55 3hwo s TRP 275 CO -0.00 0.40 -0.13 -1.01 0.02 0.00 0.00 176.95 176.23 3hwo s HIS 276 N -0.46 1.49 -0.11 -1.98 3.76 -0.35 -1.67 115.29 115.97 3hwo s HIS 276 Ca 0.33 -0.65 -0.15 0.00 -0.15 0.00 0.00 55.06 54.45 3hwo s HIS 276 Cb -0.20 -0.73 -0.05 0.00 1.11 0.00 0.00 32.58 32.72 3hwo s HIS 276 CO 0.20 0.22 0.36 -0.51 -0.85 0.00 0.00 174.74 174.16 3hwo s LEU 277 N -3.15 4.32 0.12 0.89 1.43 -0.92 -1.45 118.68 119.92 3hwo s LEU 277 Ca 0.18 0.69 0.08 0.00 -1.03 0.00 0.00 54.13 54.06 3hwo s LEU 277 Cb 0.00 -2.49 -0.04 0.00 0.03 0.00 0.00 46.19 43.70 3hwo s LEU 277 CO 0.04 0.15 -0.21 0.00 0.23 0.00 0.00 176.35 176.56 3hwo s ALA 278 N 0.03 1.87 -0.20 4.21 0.00 0.76 -2.38 121.76 126.04 3hwo s ALA 278 Ca 0.20 -1.31 -0.02 0.00 0.00 0.00 0.00 51.96 50.84 3hwo s ALA 278 Cb -0.14 -0.24 0.06 0.00 0.00 0.00 0.00 23.12 22.80 3hwo s ALA 278 CO 0.08 0.34 0.02 0.99 0.00 0.00 0.00 175.76 177.19 3hwo s THR 279 N -1.35 0.70 0.08 0.00 2.01 -0.86 -0.62 115.64 115.60 3hwo s THR 279 Ca 0.09 -0.70 -0.30 0.00 0.31 0.00 0.00 61.69 61.09 3hwo s THR 279 Cb -0.09 -1.18 -0.05 0.00 0.01 0.00 0.00 72.50 71.19 3hwo s THR 279 CO 0.05 -0.21 1.01 -2.16 -0.69 0.00 0.00 174.62 172.61 3hwo s PRO 280 N 1.77 4.61 -0.13 4.92 0.05 -1.26 -3.34 135.00 141.63 3hwo s PRO 280 Ca -0.01 1.50 -0.04 0.00 0.05 0.00 0.00 61.00 62.50 3hwo s PRO 280 Cb -0.17 -3.39 -0.03 0.00 0.05 0.00 0.00 34.50 30.95 3hwo s PRO 280 CO -0.08 0.06 0.01 -0.06 0.05 0.00 0.00 177.00 176.99 3hwo s PHE 281 N 0.41 3.17 -0.03 0.56 0.40 0.13 -4.22 117.98 118.41 3hwo s PHE 281 Ca 0.50 0.04 0.02 0.00 -0.60 0.00 0.00 56.93 56.89 3hwo s PHE 281 Cb -0.24 -1.93 0.00 0.00 0.51 0.00 0.00 43.02 41.37 3hwo s PHE 281 CO 0.30 0.25 -0.09 -1.21 0.70 0.00 0.00 175.22 175.17 3hwo s GLU 282 N -0.18 0.96 0.29 0.44 2.02 -0.79 -2.23 118.70 119.21 3hwo s GLU 282 Ca 0.05 -0.31 -0.19 0.00 0.02 0.00 0.00 54.97 54.55 3hwo s GLU 282 Cb -0.12 -0.90 0.06 0.00 0.10 0.00 0.00 34.13 33.27 3hwo s GLU 282 CO 0.02 0.12 0.89 0.20 0.02 0.00 0.00 175.26 176.51 3hwo s GLY 283 N 0.18 0.22 0.09 -1.39 0.00 -0.39 -0.52 107.32 105.51 3hwo s GLY 283 Ca -0.03 -0.52 0.10 0.00 0.00 0.00 0.00 44.72 44.26 3hwo s GLY 283 CO 0.00 0.81 -0.25 0.54 0.00 0.00 0.00 173.10 174.20 3hwo s LYS 284 N -2.37 1.46 0.23 2.90 1.02 -0.94 -0.79 119.74 121.26 3hwo s LYS 284 Ca 0.18 -1.21 0.08 0.00 0.02 0.00 0.00 55.97 55.04 3hwo s LYS 284 Cb -0.04 -1.79 -0.05 0.00 -0.52 0.00 0.00 37.83 35.43 3hwo s LYS 284 CO 0.08 0.44 -0.13 0.00 -0.92 0.00 0.00 175.35 174.82 3hwo s ALA 285 N -0.97 2.18 1.09 5.17 0.00 -0.95 -0.63 121.76 127.64 3hwo s ALA 285 Ca 0.11 -1.74 -0.12 0.00 0.00 0.00 0.00 51.96 50.21 3hwo s ALA 285 Cb -0.10 -0.05 0.24 0.00 0.00 0.00 0.00 23.12 23.21 3hwo s ALA 285 CO 0.04 0.07 1.06 0.54 0.00 0.00 0.00 175.76 177.46 3hwo s ASN 286 N -3.37 1.65 0.00 0.00 6.03 -1.26 -4.82 114.94 113.17 3hwo s ASN 286 Ca 0.25 1.52 0.23 0.00 -1.03 0.00 0.00 52.86 53.83 3hwo s ASN 286 Cb -0.00 -2.23 1.04 0.00 -3.03 0.00 0.00 41.25 37.03 3hwo s ASN 286 CO 0.09 -3.78 1.75 -1.20 -2.03 0.00 0.00 177.10 171.93 3hwo n SER 287 N -4.64 0.00 0.00 3.54 7.64 -1.26 -2.43 113.62 116.47 3hwo n SER 287 Ca 0.05 0.35 0.09 0.00 1.01 0.00 0.00 58.87 60.37 3hwo n SER 287 Cb 0.55 -0.44 0.54 0.00 -1.01 0.00 0.00 64.21 63.84 3hwo n SER 287 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hwo n GLN 288 N -1.44 0.50 -4.39 1.43 1.13 -1.26 -4.83 117.38 108.51 3hwo n GLN 288 Ca 0.07 0.03 -0.25 0.00 -1.94 0.00 0.00 57.00 54.92 3hwo n GLN 288 Cb 0.25 -1.50 -0.13 0.00 0.11 0.00 0.00 30.24 28.97 3hwo n GLN 288 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 3hwo s GLU 289 N -2.17 1.20 0.33 -1.09 2.56 -1.02 -4.81 118.70 113.71 3hwo s GLU 289 Ca 0.25 -1.11 0.03 0.00 0.00 0.00 0.00 54.97 54.15 3hwo s GLU 289 Cb 0.13 -1.44 -0.01 0.00 2.00 0.00 0.00 34.13 34.81 3hwo s GLU 289 CO 0.24 0.34 0.12 0.27 -0.56 0.00 0.00 175.26 175.67 3hwo n ASN 290 N 1.28 1.17 -0.32 -1.70 0.23 -1.26 -4.91 115.26 109.75 3hwo n ASN 290 Ca -0.19 -2.78 0.05 0.00 -0.53 0.00 0.00 54.58 51.13 3hwo n ASN 290 Cb 0.53 0.85 0.21 0.00 -2.08 0.00 0.00 39.78 39.29 3hwo n ASN 290 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3hwo h ALA 291 N 1.56 1.34 0.06 -2.53 0.00 -1.73 -2.31 119.26 115.64 3hwo h ALA 291 Ca -0.26 0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.49 3hwo h ALA 291 Cb 1.00 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.66 3hwo h ALA 291 CO 0.41 0.11 -0.80 -0.07 0.00 0.00 0.00 179.25 178.91 3hwo h LEU 292 N 0.84 0.60 -0.97 0.00 3.38 -1.92 0.37 115.31 117.62 3hwo h LEU 292 Ca 0.45 -0.82 0.18 0.00 0.09 0.00 0.00 57.88 57.78 3hwo h LEU 292 Cb 0.47 -0.19 -0.10 0.00 0.09 0.00 0.00 40.66 40.93 3hwo h LEU 292 CO -0.28 1.35 0.57 0.71 0.09 0.00 0.00 178.44 180.89 3hwo h THR 293 N -0.07 0.72 -0.01 0.22 1.35 -1.67 0.46 112.91 113.91 3hwo h THR 293 Ca -0.12 -0.26 -0.19 0.00 -0.55 0.00 0.00 66.41 65.30 3hwo h THR 293 Cb 1.53 -0.09 0.01 0.00 -1.73 0.00 0.00 68.15 67.87 3hwo h THR 293 CO 0.15 0.14 -0.73 -0.07 -0.25 0.00 0.00 175.52 174.76 3hwo h LEU 294 N 0.75 0.66 -0.42 3.87 3.38 -1.41 -2.52 115.31 119.62 3hwo h LEU 294 Ca 0.55 -0.75 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 3hwo h LEU 294 Cb 0.81 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.34 3hwo h LEU 294 CO -0.37 1.32 0.21 0.00 0.09 0.00 0.00 178.44 179.68 3hwo h ALA 295 N 0.35 0.54 -0.97 1.53 0.00 -0.36 -2.18 119.26 118.18 3hwo h ALA 295 Ca -0.09 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.76 3hwo h ALA 295 Cb 1.42 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.99 3hwo h ALA 295 CO 0.14 0.09 0.63 0.00 0.00 0.00 0.00 179.25 180.11 3hwo h LEU 297 N 1.20 0.37 0.04 0.00 5.85 -1.16 -3.26 115.31 118.35 3hwo h LEU 297 Ca 0.39 0.02 -0.24 0.00 0.84 0.00 0.00 57.88 58.89 3hwo h LEU 297 Cb 0.03 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 3hwo h LEU 297 CO -0.13 0.26 -1.10 -0.07 -0.34 0.00 0.00 178.44 177.06 3hwo h LEU 298 N 0.49 0.21 -9.49 2.25 3.38 -1.01 -3.47 115.31 107.68 3hwo h LEU 298 Ca 0.20 -0.22 -0.67 0.00 0.09 0.00 0.00 57.88 57.28 3hwo h LEU 298 Cb 0.09 -0.07 -0.11 0.00 0.09 0.00 0.00 40.66 40.66 3hwo h LEU 298 CO -0.13 1.16 -0.56 -2.28 0.09 0.00 0.00 178.44 176.73 3hwo s HIS 299 N -2.72 3.36 0.39 1.13 2.46 -0.59 -3.19 115.29 116.13 3hwo s HIS 299 Ca -0.01 0.32 -0.24 0.00 0.47 0.00 0.00 55.06 55.60 3hwo s HIS 299 Cb 0.09 -1.83 -0.10 0.00 -0.13 0.00 0.00 32.58 30.61 3hwo s HIS 299 CO 0.85 0.59 1.00 -1.25 -2.47 0.00 0.00 174.74 173.46 3hwo s PRO 300 N -1.15 4.28 0.56 2.88 0.04 -1.26 -4.82 135.00 135.53 3hwo s PRO 300 Ca 0.16 1.38 -0.11 0.00 0.04 0.00 0.00 61.00 62.48 3hwo s PRO 300 Cb -0.12 -2.54 -0.05 0.00 0.04 0.00 0.00 34.50 31.84 3hwo s PRO 300 CO 0.06 -0.01 0.96 0.99 0.04 0.00 0.00 177.00 179.04 3hwo s THR 301 N -1.75 4.71 -0.87 1.26 2.01 -1.19 -4.79 115.64 115.02 3hwo s THR 301 Ca 0.57 0.81 0.00 0.00 0.31 0.00 0.00 61.69 63.38 3hwo s THR 301 Cb -0.18 -3.83 0.00 0.00 0.01 0.00 0.00 72.50 68.50 3hwo s THR 301 CO 0.24 -0.95 0.85 -2.65 -0.69 0.00 0.00 174.62 171.42 3hwo n PRO 302 N -2.29 0.00 0.18 4.92 -0.02 -1.26 -0.39 135.00 136.14 3hwo n PRO 302 Ca 0.05 0.36 0.13 0.00 -2.02 0.00 0.00 63.50 62.02 3hwo n PRO 302 Cb 0.54 -1.59 0.33 0.00 -0.02 0.00 0.00 33.50 32.76 3hwo n PRO 302 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3hwo h ALA 303 N 1.59 1.00 0.00 3.55 0.00 -1.88 -3.33 119.26 120.19 3hwo h ALA 303 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3hwo h ALA 303 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3hwo h ALA 303 CO 0.00 0.00 -0.89 -0.11 0.00 0.00 0.00 179.25 178.25 3hwo n LEU 304 N -2.75 0.00 0.01 0.00 7.94 0.47 -4.81 117.00 117.86 3hwo n LEU 304 Ca 0.04 0.00 -0.00 0.00 -1.11 0.00 0.00 56.01 54.94 3hwo n LEU 304 Cb 0.45 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.40 3hwo n LEU 304 CO 0.31 0.00 -0.00 -1.54 -1.11 0.00 0.00 177.39 175.04 3hwo n SER 305 N -1.37 0.18 0.00 1.96 3.41 -0.45 -4.70 113.62 112.66 3hwo n SER 305 Ca 0.00 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 3hwo n SER 305 Cb 0.03 -0.07 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 3hwo n SER 305 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hwo n GLY 306 N 3.41 -0.67 2.87 5.00 0.00 -1.25 0.70 105.19 115.25 3hwo n GLY 306 Ca -0.00 -1.32 -0.15 0.00 0.00 0.00 0.00 46.02 44.55 3hwo n GLY 306 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3hwo s PHE 307 N -2.89 -0.12 0.78 1.61 5.36 0.21 -3.47 117.98 119.47 3hwo s PHE 307 Ca 0.00 0.44 -0.11 0.00 -0.96 0.00 0.00 56.93 56.30 3hwo s PHE 307 Cb 0.00 -0.17 0.06 0.00 -0.34 0.00 0.00 43.02 42.57 3hwo s PHE 307 CO 0.00 -0.18 1.11 -2.14 -1.46 0.00 0.00 175.22 172.55 3hwo s PRO 308 N 1.46 2.11 0.06 10.12 0.02 -1.26 -0.03 135.00 147.49 3hwo s PRO 308 Ca -0.06 1.29 -0.29 0.00 0.02 0.00 0.00 61.00 61.96 3hwo s PRO 308 Cb -0.12 -1.87 -0.14 0.00 0.02 0.00 0.00 34.50 32.38 3hwo s PRO 308 CO -0.05 -1.77 1.45 1.25 -0.33 0.00 0.00 177.00 177.55 3hwo h HIS 309 N -1.07 -1.12 -0.09 6.54 -0.00 -1.93 -1.74 115.15 115.73 3hwo h HIS 309 Ca -0.44 0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 59.85 3hwo h HIS 309 Cb 1.24 0.43 -0.01 0.00 -0.00 0.00 0.00 27.41 29.07 3hwo h HIS 309 CO 0.56 -0.56 -0.34 0.37 -0.00 0.00 0.00 177.93 177.96 3hwo h GLN 310 N -0.86 0.17 0.00 5.26 4.15 -1.99 0.87 115.11 122.71 3hwo h GLN 310 Ca -0.06 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.23 3hwo h GLN 310 Cb 0.73 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.40 3hwo h GLN 310 CO -0.01 0.49 -0.31 0.00 -1.93 0.00 0.00 178.83 177.07 3hwo h ALA 311 N 1.51 1.07 0.01 3.38 0.00 -1.90 -2.97 119.26 120.36 3hwo h ALA 311 Ca 0.02 -0.28 -0.28 0.00 0.00 0.00 0.00 54.91 54.37 3hwo h ALA 311 Cb 0.67 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 3hwo h ALA 311 CO 0.05 0.38 -1.59 0.00 0.00 0.00 0.00 179.25 178.09 3hwo h ALA 312 N 1.69 0.65 -0.79 0.00 0.00 -0.35 -3.19 119.26 117.27 3hwo h ALA 312 Ca -0.00 -1.35 0.20 0.00 0.00 0.00 0.00 54.91 53.76 3hwo h ALA 312 Cb 0.77 0.38 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 3hwo h ALA 312 CO 0.04 1.49 0.54 1.15 0.00 0.00 0.00 179.25 182.47 3hwo h THR 313 N 0.01 0.68 0.19 0.00 2.02 -0.80 -1.16 112.91 113.84 3hwo h THR 313 Ca -0.24 -0.08 -0.33 0.00 0.77 0.00 0.00 66.41 66.53 3hwo h THR 313 Cb 1.97 0.44 0.01 0.00 -1.74 0.00 0.00 68.15 68.84 3hwo h THR 313 CO 0.09 0.04 -1.60 1.56 0.37 0.00 0.00 175.52 175.98 3hwo h GLN 314 N 0.22 0.39 -0.69 6.66 4.20 -1.56 -2.72 115.11 121.60 3hwo h GLN 314 Ca 0.39 -0.67 0.04 0.00 0.06 0.00 0.00 58.65 58.47 3hwo h GLN 314 Cb 1.21 0.25 -0.05 0.00 0.30 0.00 0.00 27.48 29.19 3hwo h GLN 314 CO -0.08 1.32 0.42 0.28 -0.67 0.00 0.00 178.83 180.10 3hwo h VAL 315 N 0.02 1.06 -0.56 -0.54 2.07 -1.49 -2.54 116.25 114.26 3hwo h VAL 315 Ca -0.31 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 66.93 3hwo h VAL 315 Cb 2.03 0.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.95 3hwo h VAL 315 CO 0.17 0.15 0.37 0.40 0.02 0.00 0.00 177.57 178.68 3hwo h ILE 316 N 0.81 1.15 0.00 4.57 2.04 -1.31 -1.34 117.51 123.43 3hwo h ILE 316 Ca 0.29 -0.27 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 3hwo h ILE 316 Cb 0.07 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.48 3hwo h ILE 316 CO -0.13 0.14 -0.11 0.00 0.00 0.00 0.00 178.15 178.05 3hwo h ALA 317 N 1.20 1.21 0.00 1.87 0.00 -1.21 -2.02 119.26 120.31 3hwo h ALA 317 Ca 0.20 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hwo h ALA 317 Cb -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3hwo h ALA 317 CO -0.04 0.14 -1.50 0.39 0.00 0.00 0.00 179.25 178.23 3hwo n GLU 318 N -3.52 0.38 -0.11 0.00 1.02 -0.97 -4.52 120.64 112.93 3hwo n GLU 318 Ca -0.01 -0.10 -0.12 0.00 -0.02 0.00 0.00 57.16 56.91 3hwo n GLU 318 Cb 0.25 -1.53 -0.15 0.00 -0.02 0.00 0.00 31.44 29.99 3hwo n GLU 318 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3hwo n LEU 319 N -1.97 0.92 -4.64 -4.62 4.77 -0.55 -4.95 117.00 105.96 3hwo n LEU 319 Ca -0.00 -0.04 -0.40 0.00 -0.03 0.00 0.00 56.01 55.53 3hwo n LEU 319 Cb 0.47 0.06 -0.07 0.00 -2.33 0.00 0.00 43.42 41.56 3hwo n LEU 319 CO 0.44 0.63 0.33 -1.61 -1.33 0.00 0.00 177.39 175.85 3hwo s GLU 320 N -2.49 4.14 0.00 3.23 2.02 -0.78 -4.95 118.70 119.87 3hwo s GLU 320 Ca -0.17 0.49 0.00 0.00 0.02 0.00 0.00 54.97 55.31 3hwo s GLU 320 Cb 0.07 -3.62 0.00 0.00 0.10 0.00 0.00 34.13 30.68 3hwo s GLU 320 CO 0.75 -0.32 1.22 -0.35 0.02 0.00 0.00 175.26 176.58 3hwo n PRO 321 N 5.38 0.92 -3.84 0.39 -0.04 -1.26 -4.79 135.00 131.76 3hwo n PRO 321 Ca -0.02 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.37 3hwo n PRO 321 Cb 0.49 -1.04 -0.02 0.00 -0.04 0.00 0.00 33.50 32.89 3hwo n PRO 321 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3hwo s PHE 322 N 0.11 -0.19 -0.19 0.54 -0.71 -1.26 -5.01 117.98 111.27 3hwo s PHE 322 Ca 0.00 -0.25 -0.09 0.00 -1.04 0.00 0.00 56.93 55.55 3hwo s PHE 322 Cb 0.00 0.70 -0.05 0.00 -1.21 0.00 0.00 43.02 42.46 3hwo s PHE 322 CO 0.00 -1.18 0.12 0.34 -1.34 0.00 0.00 175.22 173.17 3hwo s ASP 323 N -2.92 6.16 0.26 1.98 2.15 -1.26 -5.01 116.67 118.03 3hwo s ASP 323 Ca 0.11 0.23 0.08 0.00 0.43 0.00 0.00 52.55 53.40 3hwo s ASP 323 Cb -0.05 -2.07 0.30 0.00 -0.30 0.00 0.00 42.92 40.80 3hwo s ASP 323 CO 0.06 0.20 1.59 0.03 -0.17 0.00 0.00 175.17 176.87 3hwo h ARG 324 N 6.53 0.09 0.00 4.34 3.08 -1.99 -3.47 114.38 122.97 3hwo h ARG 324 Ca -0.42 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.56 3hwo h ARG 324 Cb 1.16 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.22 3hwo h ARG 324 CO 0.74 0.68 0.00 0.39 -1.07 0.00 0.00 179.97 180.71 3hwo n GLU 325 N -3.83 0.00 0.15 0.04 1.02 -1.26 -1.04 120.64 115.72 3hwo n GLU 325 Ca -0.02 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.25 3hwo n GLU 325 Cb 0.62 0.00 0.40 0.00 -0.02 0.00 0.00 31.44 32.44 3hwo n GLU 325 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 3hwo h LEU 326 N 0.00 0.00 -9.43 -4.62 3.38 -1.91 0.38 115.31 103.12 3hwo h LEU 326 Ca 0.00 0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.43 3hwo h LEU 326 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3hwo h LEU 326 CO 0.00 0.00 0.75 -0.36 0.09 0.00 0.00 178.44 178.92 3hwo s PHE 327 N -3.21 3.06 -0.00 1.13 2.99 -0.21 -2.12 117.98 119.62 3hwo s PHE 327 Ca 0.08 0.96 0.00 0.00 0.00 0.00 0.00 56.93 57.96 3hwo s PHE 327 Cb 0.10 -3.61 0.00 0.00 0.00 0.00 0.00 43.02 39.51 3hwo s PHE 327 CO 0.57 -2.16 0.00 0.41 -0.00 0.00 0.00 175.22 174.04 3hwo n GLY 328 N 3.52 0.48 0.00 4.36 0.00 -0.35 -4.30 105.19 108.89 3hwo n GLY 328 Ca 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.11 3hwo n GLY 328 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hwo n GLY 329 N -2.86 1.38 3.26 -0.02 0.00 -0.90 -4.42 105.19 101.63 3hwo n GLY 329 Ca -0.00 -1.83 -0.22 0.00 0.00 0.00 0.00 46.02 43.97 3hwo n GLY 329 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hwo s ILE 330 N 1.77 1.56 0.06 -0.61 -4.36 -0.75 -0.42 121.20 118.44 3hwo s ILE 330 Ca 0.00 -1.49 0.05 0.00 -0.26 0.00 0.00 60.65 58.95 3hwo s ILE 330 Cb 0.00 -1.44 -0.03 0.00 1.25 0.00 0.00 42.46 42.24 3hwo s ILE 330 CO 0.00 -0.10 -0.13 0.54 0.24 0.00 0.00 174.94 175.48 3hwo s VAL 331 N -1.20 1.02 -0.07 8.37 0.11 0.70 -0.83 120.40 128.51 3hwo s VAL 331 Ca 0.04 -1.16 0.00 0.00 -2.93 0.00 0.00 61.98 57.94 3hwo s VAL 331 Cb -0.10 -0.98 0.00 0.00 -1.53 0.00 0.00 36.38 33.77 3hwo s VAL 331 CO 0.04 -0.17 0.00 0.61 -3.33 0.00 0.00 175.10 172.25 3hwo n GLY 332 N 1.53 -0.38 3.68 6.54 0.00 -0.78 -0.31 105.19 115.46 3hwo n GLY 332 Ca -0.20 -0.53 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 3hwo n GLY 332 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 3hwo s TRP 333 N -4.00 -0.24 -0.06 1.61 1.48 -0.44 -1.86 118.94 115.43 3hwo s TRP 333 Ca 0.00 -0.13 -0.27 0.00 -1.06 0.00 0.00 56.10 54.63 3hwo s TRP 333 Cb 0.00 0.59 0.06 0.00 -1.16 0.00 0.00 33.47 32.96 3hwo s TRP 333 CO 0.00 -1.07 0.61 0.00 -4.06 0.00 0.00 176.95 172.43 3hwo n ASP 335 N 1.14 0.74 0.00 0.00 5.68 -0.29 -0.65 116.55 123.18 3hwo n ASP 335 Ca -0.19 -1.55 0.15 0.00 -0.50 0.00 0.00 54.79 52.70 3hwo n ASP 335 Cb 0.57 -0.16 0.85 0.00 -1.14 0.00 0.00 41.12 41.23 3hwo n ASP 335 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3hwo n SER 336 N -2.78 0.00 -0.39 -1.12 3.41 -1.23 -3.83 113.62 107.67 3hwo n SER 336 Ca 0.06 -0.72 0.08 0.00 -0.26 0.00 0.00 58.87 58.03 3hwo n SER 336 Cb 0.22 -0.08 0.18 0.00 -0.26 0.00 0.00 64.21 64.27 3hwo n SER 336 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3hwo n GLU 337 N -1.08 1.56 -0.32 4.33 4.71 -1.26 -4.98 120.64 123.59 3hwo n GLU 337 Ca 0.20 -2.89 0.00 0.00 -0.01 0.00 0.00 57.16 54.46 3hwo n GLU 337 Cb 0.14 -1.59 0.00 0.00 -1.01 0.00 0.00 31.44 28.98 3hwo n GLU 337 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3hwo n GLY 338 N -1.24 1.57 3.92 0.62 0.00 -1.25 -4.92 105.19 103.89 3hwo n GLY 338 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 3hwo n GLY 338 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3hwo s ASN 339 N -3.24 6.13 0.00 1.61 0.01 -1.26 -2.36 114.94 115.83 3hwo s ASN 339 Ca 0.00 0.78 0.00 0.00 -0.71 0.00 0.00 52.86 52.93 3hwo s ASN 339 Cb 0.00 -2.08 0.00 0.00 0.41 0.00 0.00 41.25 39.58 3hwo s ASN 339 CO 0.00 -0.63 0.00 0.61 -1.51 0.00 0.00 177.10 175.57 3hwo n GLY 340 N -2.24 -1.58 3.35 0.66 0.00 -0.63 -1.13 105.19 103.62 3hwo n GLY 340 Ca 0.01 -1.15 -0.12 0.00 0.00 0.00 0.00 46.02 44.75 3hwo n GLY 340 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3hwo s GLU 341 N -1.61 0.51 -0.06 1.61 2.12 -0.73 -1.40 118.70 119.14 3hwo s GLU 341 Ca 0.00 0.71 -0.00 0.00 0.36 0.00 0.00 54.97 56.04 3hwo s GLU 341 Cb 0.00 0.18 0.03 0.00 0.26 0.00 0.00 34.13 34.60 3hwo s GLU 341 CO 0.00 -0.09 -0.02 -1.58 -0.54 0.00 0.00 175.26 173.03 3hwo s TRP 342 N 0.62 0.68 0.20 5.30 0.52 0.11 -1.33 118.94 125.03 3hwo s TRP 342 Ca -0.03 -0.18 0.10 0.00 0.02 0.00 0.00 56.10 56.02 3hwo s TRP 342 Cb -0.05 -0.72 -0.04 0.00 -1.15 0.00 0.00 33.47 31.51 3hwo s TRP 342 CO -0.04 -0.26 -0.16 0.14 0.02 0.00 0.00 176.95 176.64 3hwo s VAL 343 N 1.50 2.78 0.20 4.03 -7.23 0.57 -0.53 120.40 121.71 3hwo s VAL 343 Ca -0.02 -1.89 -0.30 0.00 -1.81 0.00 0.00 61.98 57.96 3hwo s VAL 343 Cb -0.13 -2.37 -0.08 0.00 0.56 0.00 0.00 36.38 34.36 3hwo s VAL 343 CO -0.03 -0.14 1.25 -0.69 -0.31 0.00 0.00 175.10 175.18 3hwo s VAL 344 N -1.77 3.36 -1.13 1.32 1.01 -0.63 -0.21 120.40 122.35 3hwo s VAL 344 Ca 0.24 1.14 -0.19 0.00 0.00 0.00 0.00 61.98 63.17 3hwo s VAL 344 Cb -0.08 -3.73 0.09 0.00 0.00 0.00 0.00 36.38 32.66 3hwo s VAL 344 CO 0.13 0.18 1.50 -0.89 0.00 0.00 0.00 175.10 176.02 3hwo s THR 345 N -0.03 4.29 0.26 3.92 2.01 0.44 -4.75 115.64 121.78 3hwo s THR 345 Ca 0.54 -1.58 0.02 0.00 0.31 0.00 0.00 61.69 60.98 3hwo s THR 345 Cb -0.35 -5.04 -0.03 0.00 0.01 0.00 0.00 72.50 67.09 3hwo s THR 345 CO 0.38 -1.86 0.22 0.27 -0.69 0.00 0.00 174.62 172.95 3hwo s ILE 346 N 3.84 0.00 -1.47 1.82 -4.36 -1.26 -1.22 121.20 118.55 3hwo s ILE 346 Ca 0.46 -1.96 -0.00 0.00 -0.26 0.00 0.00 60.65 58.89 3hwo s ILE 346 Cb 0.00 -2.50 0.00 0.00 1.25 0.00 0.00 42.46 41.22 3hwo s ILE 346 CO -0.02 0.00 0.25 0.54 0.24 0.00 0.00 174.94 175.95 3hwo n ARG 347 N -0.43 -2.34 -4.29 0.37 5.12 -1.26 -4.12 116.66 109.70 3hwo n ARG 347 Ca 0.04 0.28 -0.18 0.00 -1.93 0.00 0.00 57.85 56.06 3hwo n ARG 347 Cb 0.64 -4.16 -0.09 0.00 -1.16 0.00 0.00 32.46 27.70 3hwo n ARG 347 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3hwo s ALA 349 N -3.65 -0.62 -0.22 0.00 0.00 0.10 -3.27 121.76 114.10 3hwo s ALA 349 Ca 0.38 0.41 -0.09 0.00 0.00 0.00 0.00 51.96 52.65 3hwo s ALA 349 Cb 0.04 -0.15 -0.05 0.00 0.00 0.00 0.00 23.12 22.97 3hwo s ALA 349 CO 0.20 -0.19 0.12 0.21 0.00 0.00 0.00 175.76 176.10 3hwo s LYS 350 N -0.68 4.02 -0.01 0.00 2.20 -0.52 -1.13 119.74 123.61 3hwo s LYS 350 Ca -0.08 -0.30 0.04 0.00 -0.36 0.00 0.00 55.97 55.27 3hwo s LYS 350 Cb -0.04 -3.41 -0.03 0.00 -1.51 0.00 0.00 37.83 32.83 3hwo s LYS 350 CO 0.02 0.13 -0.11 -0.51 -0.36 0.00 0.00 175.35 174.52 3hwo s LEU 351 N 0.82 2.92 -0.29 5.43 1.02 -0.53 -0.99 118.68 127.06 3hwo s LEU 351 Ca 0.06 -0.20 -0.05 0.00 0.02 0.00 0.00 54.13 53.96 3hwo s LEU 351 Cb -0.13 -1.66 0.16 0.00 0.02 0.00 0.00 46.19 44.58 3hwo s LEU 351 CO 0.02 0.31 0.60 -0.60 0.02 0.00 0.00 176.35 176.70 3hwo s ARG 352 N -1.13 0.55 6.44 1.70 3.52 -0.29 -0.98 118.95 128.76 3hwo s ARG 352 Ca 0.14 1.16 0.00 0.00 -0.13 0.00 0.00 55.73 56.90 3hwo s ARG 352 Cb -0.11 0.61 0.00 0.00 -1.56 0.00 0.00 34.95 33.89 3hwo s ARG 352 CO 0.04 -0.44 0.00 0.39 -0.81 0.00 0.00 175.30 174.48 3hwo n GLU 353 N 5.43 0.00 -0.73 5.12 -0.58 -1.26 -1.98 120.64 126.64 3hwo n GLU 353 Ca -0.06 0.00 0.07 0.00 -0.42 0.00 0.00 57.16 56.75 3hwo n GLU 353 Cb 0.50 0.00 0.35 0.00 -0.57 0.00 0.00 31.44 31.72 3hwo n GLU 353 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 3hwo n ASN 354 N 7.42 4.95 -4.23 1.62 6.94 -1.26 -1.36 115.26 129.35 3hwo n ASN 354 Ca 0.00 -2.69 -0.32 0.00 -0.02 0.00 0.00 54.58 51.55 3hwo n ASN 354 Cb 0.00 -0.63 -0.17 0.00 -2.36 0.00 0.00 39.78 36.62 3hwo n ASN 354 CO 0.00 0.00 0.00 -1.58 -1.03 0.00 0.00 177.26 174.65 3hwo s GLN 355 N -2.33 3.02 0.03 -3.83 2.00 -0.84 -1.13 119.66 116.60 3hwo s GLN 355 Ca 0.48 -0.87 0.06 0.00 -2.00 0.00 0.00 55.36 53.03 3hwo s GLN 355 Cb 0.35 -2.30 -0.02 0.00 0.80 0.00 0.00 33.01 31.83 3hwo s GLN 355 CO 0.17 0.20 -0.19 0.08 -0.50 0.00 0.00 175.29 175.05 3hwo s VAL 356 N 0.30 1.50 -0.14 1.34 1.01 0.14 -1.14 120.40 123.40 3hwo s VAL 356 Ca -0.17 -1.09 0.01 0.00 0.00 0.00 0.00 61.98 60.73 3hwo s VAL 356 Cb -0.18 -1.31 0.02 0.00 0.00 0.00 0.00 36.38 34.92 3hwo s VAL 356 CO 0.08 0.19 -0.17 -0.60 0.00 0.00 0.00 175.10 174.60 3hwo s ARG 357 N -1.06 2.54 0.31 2.72 3.52 -0.16 0.11 118.95 126.93 3hwo s ARG 357 Ca 0.06 -0.66 0.00 0.00 -0.13 0.00 0.00 55.73 55.00 3hwo s ARG 357 Cb -0.08 -2.20 -0.04 0.00 -1.56 0.00 0.00 34.95 31.07 3hwo s ARG 357 CO 0.01 -0.15 0.51 -0.51 -0.81 0.00 0.00 175.30 174.36 3hwo s LEU 358 N 1.20 4.07 -0.01 -0.88 1.43 0.90 -1.44 118.68 123.96 3hwo s LEU 358 Ca -0.00 0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 53.53 3hwo s LEU 358 Cb -0.14 -3.28 0.00 0.00 0.03 0.00 0.00 46.19 42.81 3hwo s LEU 358 CO -0.07 -0.23 0.04 0.12 0.23 0.00 0.00 176.35 176.44 3hwo s PHE 359 N -2.20 -0.04 -0.13 0.29 5.36 -1.20 -2.05 117.98 118.01 3hwo s PHE 359 Ca 0.40 0.09 -0.20 0.00 -0.96 0.00 0.00 56.93 56.26 3hwo s PHE 359 Cb -0.10 0.01 0.05 0.00 -0.34 0.00 0.00 43.02 42.64 3hwo s PHE 359 CO 0.34 -0.02 0.51 0.00 -1.46 0.00 0.00 175.22 174.59 3hwo s ALA 360 N 0.00 -1.29 0.08 11.12 0.00 -0.99 -4.36 121.76 126.32 3hwo s ALA 360 Ca -0.00 1.20 0.01 0.00 0.00 0.00 0.00 51.96 53.17 3hwo s ALA 360 Cb -0.00 -0.47 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 3hwo s ALA 360 CO 0.00 -0.28 -0.06 0.20 0.00 0.00 0.00 175.76 175.62 3hwo s GLY 361 N -0.39 0.67 0.05 0.00 0.00 -1.26 -0.99 107.32 105.41 3hwo s GLY 361 Ca -0.05 -1.22 -0.00 0.00 0.00 0.00 0.00 44.72 43.45 3hwo s GLY 361 CO 0.03 -1.31 -0.04 0.00 0.00 0.00 0.00 173.10 171.78 3hwo s ALA 362 N -3.26 0.52 0.00 3.20 0.00 -0.52 -4.84 121.76 116.87 3hwo s ALA 362 Ca 0.07 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.94 3hwo s ALA 362 Cb 0.03 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.36 3hwo s ALA 362 CO -0.05 -0.28 0.00 0.41 0.00 0.00 0.00 175.76 175.84 3hwo n GLY 363 N 0.46 1.10 3.18 0.00 0.00 -1.26 0.16 105.19 108.83 3hwo n GLY 363 Ca -0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 3hwo n GLY 363 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hwo s ILE 364 N -2.00 2.49 0.30 -0.61 1.09 -1.09 -4.93 121.20 116.46 3hwo s ILE 364 Ca 0.00 -0.87 0.03 0.00 -1.10 0.00 0.00 60.65 58.71 3hwo s ILE 364 Cb 0.00 -2.12 -0.04 0.00 -1.06 0.00 0.00 42.46 39.24 3hwo s ILE 364 CO 0.00 0.45 0.15 0.68 -0.10 0.00 0.00 174.94 176.12 3hwo s VAL 365 N 1.33 0.36 0.52 2.92 -7.23 -1.26 -2.80 120.40 114.24 3hwo s VAL 365 Ca 0.04 -2.00 0.30 0.00 -1.81 0.00 0.00 61.98 58.51 3hwo s VAL 365 Cb -0.14 -2.53 0.47 0.00 0.56 0.00 0.00 36.38 34.74 3hwo s VAL 365 CO -0.09 0.00 1.88 -0.65 -0.31 0.00 0.00 175.10 175.93 3hwo h PRO 366 N 2.24 0.06 -0.12 4.82 0.11 -1.84 -1.17 132.00 136.10 3hwo h PRO 366 Ca -0.34 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3hwo h PRO 366 Cb 1.25 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3hwo h PRO 366 CO 0.53 0.04 0.00 0.00 -0.21 0.00 0.00 178.00 178.37 3hwo n ALA 367 N -2.68 2.54 -2.71 -0.75 0.00 -1.26 -4.90 120.51 110.75 3hwo n ALA 367 Ca 0.19 -0.43 -0.39 0.00 0.00 0.00 0.00 53.44 52.80 3hwo n ALA 367 Cb 0.93 -1.14 -0.05 0.00 0.00 0.00 0.00 19.45 19.19 3hwo n ALA 367 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3hwo s SER 368 N -1.60 6.90 0.02 0.00 1.04 -0.44 -5.06 113.70 114.56 3hwo s SER 368 Ca 0.32 1.08 -0.23 0.00 0.48 0.00 0.00 55.95 57.60 3hwo s SER 368 Cb 0.17 -2.38 -0.05 0.00 0.10 0.00 0.00 66.02 63.85 3hwo s SER 368 CO 0.26 -0.12 0.69 -0.94 0.98 0.00 0.00 173.24 174.11 3hwo s SER 369 N 0.82 7.10 0.34 7.02 1.04 -1.26 -4.91 113.70 123.86 3hwo s SER 369 Ca 0.34 1.32 0.07 0.00 0.48 0.00 0.00 55.95 58.16 3hwo s SER 369 Cb -0.17 -2.42 0.76 0.00 0.10 0.00 0.00 66.02 64.29 3hwo s SER 369 CO 0.16 0.04 1.86 -0.65 0.98 0.00 0.00 173.24 175.63 3hwo h PRO 370 N 5.72 0.73 -0.44 4.02 0.11 -1.90 0.80 132.00 141.03 3hwo h PRO 370 Ca -0.44 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 65.51 3hwo h PRO 370 Cb 1.20 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 3hwo h PRO 370 CO 0.71 0.49 -0.17 1.25 -0.21 0.00 0.00 178.00 180.07 3hwo h LEU 371 N 0.76 0.86 -0.58 2.35 5.85 -1.94 -1.67 115.31 120.93 3hwo h LEU 371 Ca 0.46 -0.29 0.04 0.00 0.84 0.00 0.00 57.88 58.93 3hwo h LEU 371 Cb 0.67 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.43 3hwo h LEU 371 CO -0.22 1.02 0.33 1.23 -0.34 0.00 0.00 178.44 180.45 3hwo h GLY 372 N 0.96 0.84 0.99 3.75 0.00 -1.29 -1.50 103.07 106.81 3hwo h GLY 372 Ca 0.11 -0.24 -0.25 0.00 0.00 0.00 0.00 47.33 46.96 3hwo h GLY 372 CO 0.05 0.17 -1.05 0.83 0.00 0.00 0.00 176.54 176.54 3hwo h GLU 373 N 0.63 0.48 -0.57 4.80 4.39 -1.16 -1.46 114.58 121.69 3hwo h GLU 373 Ca 0.25 -0.69 0.12 0.00 0.34 0.00 0.00 59.36 59.37 3hwo h GLU 373 Cb 0.10 0.24 -0.10 0.00 -0.10 0.00 0.00 28.75 28.89 3hwo h GLU 373 CO -0.14 1.31 -0.03 2.35 -1.16 0.00 0.00 179.01 181.33 3hwo h TRP 374 N -0.01 -0.10 -0.00 4.33 2.91 -1.29 0.15 115.95 121.94 3hwo h TRP 374 Ca -0.17 0.04 -0.15 0.00 1.13 0.00 0.00 58.89 59.75 3hwo h TRP 374 Cb 1.78 0.13 -0.02 0.00 -0.51 0.00 0.00 29.16 30.55 3hwo h TRP 374 CO 0.15 -0.17 -0.69 0.00 -1.03 0.00 0.00 178.44 176.69 3hwo h ARG 375 N 0.09 0.03 0.67 2.65 3.08 -1.29 -1.46 114.38 118.15 3hwo h ARG 375 Ca 0.29 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 60.29 3hwo h ARG 375 Cb 0.46 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.52 3hwo h ARG 375 CO -0.51 0.71 -0.32 1.49 -1.07 0.00 0.00 179.97 180.26 3hwo h GLU 376 N 0.02 -0.87 -0.97 0.04 4.81 -0.65 -1.52 114.58 115.43 3hwo h GLU 376 Ca -0.01 0.06 0.20 0.00 -0.13 0.00 0.00 59.36 59.48 3hwo h GLU 376 Cb 1.23 0.20 -0.09 0.00 0.63 0.00 0.00 28.75 30.71 3hwo h GLU 376 CO 0.09 -0.54 0.61 1.79 -0.73 0.00 0.00 179.01 180.23 3hwo h THR 377 N -1.11 0.69 -0.50 0.32 1.35 -0.76 0.31 112.91 113.20 3hwo h THR 377 Ca -0.09 -0.21 0.09 0.00 -0.55 0.00 0.00 66.41 65.65 3hwo h THR 377 Cb 0.73 0.02 -0.08 0.00 -1.73 0.00 0.00 68.15 67.09 3hwo h THR 377 CO 0.15 0.11 0.05 1.23 -0.25 0.00 0.00 175.52 176.81 3hwo h GLY 378 N 0.61 0.57 1.50 5.82 0.00 -0.93 0.80 103.07 111.44 3hwo h GLY 378 Ca 0.54 0.02 -0.15 0.00 0.00 0.00 0.00 47.33 47.74 3hwo h GLY 378 CO -0.29 -0.11 -0.52 -2.08 0.00 0.00 0.00 176.54 173.54 3hwo h VAL 379 N 0.17 1.32 -0.68 4.60 2.07 0.08 -2.82 116.25 120.99 3hwo h VAL 379 Ca 0.26 -1.75 -0.06 0.00 0.82 0.00 0.00 66.70 65.96 3hwo h VAL 379 Cb 0.37 1.74 -0.03 0.00 -1.52 0.00 0.00 31.29 31.85 3hwo h VAL 379 CO -0.38 0.54 0.17 0.11 0.02 0.00 0.00 177.57 178.04 3hwo h LYS 380 N 0.41 1.06 0.00 1.57 1.57 -0.92 -2.60 116.57 117.66 3hwo h LYS 380 Ca 0.01 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.54 3hwo h LYS 380 Cb 1.05 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 33.20 3hwo h LYS 380 CO 0.10 0.93 -0.08 -0.07 -0.57 0.00 0.00 179.45 179.75 3hwo h LEU 381 N 1.01 0.00 -0.59 2.94 3.38 -0.65 -3.03 115.31 118.38 3hwo h LEU 381 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3hwo h LEU 381 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 3hwo h LEU 381 CO -0.00 0.08 0.00 0.77 0.09 0.00 0.00 178.44 179.38 3hwo h SER 382 N 0.00 0.00 0.22 -0.43 4.64 -1.22 -1.17 113.55 115.59 3hwo h SER 382 Ca -0.00 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 3hwo h SER 382 Cb 0.31 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.38 3hwo h SER 382 CO 0.01 0.00 -0.26 0.74 -0.87 0.00 0.00 176.83 176.45 3hwo h THR 383 N 0.00 0.44 0.00 2.95 2.02 -1.62 0.12 112.91 116.81 3hwo h THR 383 Ca 0.00 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.01 3hwo h THR 383 Cb 0.63 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 3hwo h THR 383 CO 0.00 0.00 -0.82 0.24 0.37 0.00 0.00 175.52 175.31 3hwo h MET 384 N -0.53 0.03 -0.84 6.66 2.86 -1.59 -2.91 114.93 118.61 3hwo h MET 384 Ca 0.00 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 3hwo h MET 384 Cb 0.51 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.14 3hwo h MET 384 CO -0.08 0.83 0.47 -0.07 1.06 0.00 0.00 176.91 179.12 3hwo h LEU 385 N 0.02 1.04 -0.95 1.22 -0.00 -1.20 -2.77 115.31 112.66 3hwo h LEU 385 Ca -0.01 -0.08 -0.04 0.00 -0.00 0.00 0.00 57.88 57.75 3hwo h LEU 385 Cb 1.44 -0.26 -0.03 0.00 -0.00 0.00 0.00 40.66 41.81 3hwo h LEU 385 CO 0.11 0.83 0.31 0.78 -0.00 0.00 0.00 178.44 180.46 3hwo h ASN 386 N 1.17 0.97 -0.86 -0.43 2.35 -0.85 0.13 115.58 118.06 3hwo h ASN 386 Ca 0.30 -0.13 0.01 0.00 -0.55 0.00 0.00 56.30 55.93 3hwo h ASN 386 Cb 0.01 -0.25 -0.04 0.00 0.05 0.00 0.00 38.32 38.08 3hwo h ASN 386 CO -0.05 0.85 0.57 0.58 -1.65 0.00 0.00 177.43 177.73 3hwo h VAL 387 N 1.04 1.20 0.00 2.81 2.07 -1.30 -1.50 116.25 120.58 3hwo h VAL 387 Ca 0.25 -0.39 0.00 0.00 0.82 0.00 0.00 66.70 67.37 3hwo h VAL 387 Cb 0.17 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 29.90 3hwo h VAL 387 CO -0.02 0.21 0.00 0.49 0.02 0.00 0.00 177.57 178.27 3hwo n PHE 388 N -4.41 0.14 -2.28 1.57 3.72 -0.79 -4.87 117.46 110.54 3hwo n PHE 388 Ca 0.10 0.04 -0.02 0.00 -0.05 0.00 0.00 57.45 57.52 3hwo n PHE 388 Cb 0.04 -0.57 0.00 0.00 -0.94 0.00 0.00 39.48 38.02 3hwo n PHE 388 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hwo n GLY 389 N 1.27 0.49 3.69 1.37 0.00 -0.33 -5.04 105.19 106.64 3hwo n GLY 389 Ca 0.06 -0.70 -0.28 0.00 0.00 0.00 0.00 46.02 45.10 3hwo n GLY 389 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hwo s LEU 390 N -1.08 2.83 0.00 0.99 1.43 0.32 -5.00 118.68 118.16 3hwo s LEU 390 Ca 0.03 -1.34 0.00 0.00 -1.03 0.00 0.00 54.13 51.78 3hwo s LEU 390 Cb -0.01 -1.02 0.00 0.00 0.03 0.00 0.00 46.19 45.19 3hwo s LEU 390 CO 0.03 -0.57 0.29 1.41 0.23 0.00 0.00 176.35 177.74