#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hwo s THR 15 N 0.00 2.15 0.24 0.00 -4.23 -1.26 -5.09 115.64 107.45 3hwo s THR 15 Ca 0.00 -1.31 -0.30 0.00 -1.18 0.00 0.00 61.69 58.90 3hwo s THR 15 Cb 0.00 -2.46 -0.09 0.00 1.34 0.00 0.00 72.50 71.29 3hwo s THR 15 CO 0.00 0.00 0.95 -0.22 -0.54 0.00 0.00 174.62 174.81 3hwo s LEU 16 N -4.33 4.64 0.17 4.79 2.96 -1.26 -5.01 118.68 120.65 3hwo s LEU 16 Ca 0.46 1.98 -0.31 0.00 -0.22 0.00 0.00 54.13 56.04 3hwo s LEU 16 Cb -0.04 -3.61 -0.09 0.00 0.50 0.00 0.00 46.19 42.95 3hwo s LEU 16 CO 0.28 0.13 1.39 0.00 -1.32 0.00 0.00 176.35 176.84 3hwo s ALA 17 N -1.18 3.60 -2.00 5.97 0.00 -1.26 -3.94 121.76 122.94 3hwo s ALA 17 Ca 0.41 1.17 0.05 0.00 0.00 0.00 0.00 51.96 53.60 3hwo s ALA 17 Cb -0.26 -3.53 0.29 0.00 0.00 0.00 0.00 23.12 19.61 3hwo s ALA 17 CO 0.33 -0.63 0.73 -0.35 0.00 0.00 0.00 175.76 175.84 3hwo n PRO 18 N 3.30 0.17 -0.44 0.00 -0.04 -1.26 -1.01 135.00 135.71 3hwo n PRO 18 Ca 0.09 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.63 3hwo n PRO 18 Cb 0.42 -1.46 0.25 0.00 -0.04 0.00 0.00 33.50 32.67 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 -0.96 3.73 -4.29 3.54 6.94 -1.26 -4.48 115.26 118.48 3hwo n ASN 19 Ca 0.04 -3.06 -0.32 0.00 -0.02 0.00 0.00 54.58 51.22 3hwo n ASN 19 Cb 0.02 -0.54 -0.16 0.00 -2.36 0.00 0.00 39.78 36.73 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 -2.86 2.69 0.25 -3.83 0.52 -0.18 -4.70 118.95 110.84 3hwo s ARG 20 Ca 0.42 -0.86 -0.30 0.00 -0.52 0.00 0.00 55.73 54.47 3hwo s ARG 20 Cb 0.34 -2.24 -0.09 0.00 0.52 0.00 0.00 34.95 33.48 3hwo s ARG 20 CO 0.08 0.36 1.03 0.12 0.02 0.00 0.00 175.30 176.92 3hwo s PHE 21 N -0.10 3.75 -0.02 -0.53 5.36 -1.26 -4.37 117.98 120.81 3hwo s PHE 21 Ca -0.05 1.78 0.00 0.00 -0.96 0.00 0.00 56.93 57.71 3hwo s PHE 21 Cb -0.14 -3.16 0.02 0.00 -0.34 0.00 0.00 43.02 39.40 3hwo s PHE 21 CO 0.04 -0.14 0.00 0.12 -1.46 0.00 0.00 175.22 173.78 3hwo s PHE 22 N -1.08 0.24 -0.05 10.12 2.19 -0.68 -1.21 117.98 127.51 3hwo s PHE 22 Ca 0.43 0.01 -0.01 0.00 0.33 0.00 0.00 56.93 57.70 3hwo s PHE 22 Cb -0.29 -0.32 0.03 0.00 -1.31 0.00 0.00 43.02 41.13 3hwo s PHE 22 CO 0.37 -0.09 0.02 0.12 1.83 0.00 0.00 175.22 177.46 3hwo s PHE 23 N 0.79 0.38 -0.25 10.12 5.36 -0.29 -2.11 117.98 131.97 3hwo s PHE 23 Ca -0.08 0.01 0.02 0.00 -0.96 0.00 0.00 56.93 55.93 3hwo s PHE 23 Cb -0.11 -0.59 0.05 0.00 -0.34 0.00 0.00 43.02 42.04 3hwo s PHE 23 CO -0.02 -0.23 -0.11 1.41 -1.46 0.00 0.00 175.22 174.82 3hwo s MET 24 N 1.74 2.35 0.04 10.12 -2.45 -0.12 -1.39 119.30 129.59 3hwo s MET 24 Ca 0.00 -1.28 -0.10 0.00 -1.25 0.00 0.00 55.69 53.07 3hwo s MET 24 Cb -0.13 -2.87 0.00 0.00 1.25 0.00 0.00 34.83 33.09 3hwo s MET 24 CO -0.03 -0.53 0.20 0.45 1.05 0.00 0.00 175.02 176.16 3hwo s SER 25 N 1.14 0.02 0.53 1.11 0.15 -1.26 -2.57 113.70 112.82 3hwo s SER 25 Ca -0.07 -0.34 0.34 0.00 0.70 0.00 0.00 55.95 56.58 3hwo s SER 25 Cb -0.19 0.29 1.56 0.00 -1.71 0.00 0.00 66.02 65.97 3hwo s SER 25 CO -0.06 -0.55 2.03 1.55 1.20 0.00 0.00 173.24 177.41 3hwo h PRO 26 N 3.48 0.00 0.00 5.44 0.13 -1.92 -3.35 132.00 135.78 3hwo h PRO 26 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3hwo h PRO 26 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3hwo h PRO 26 CO 0.48 0.00 0.00 0.98 -0.23 0.00 0.00 178.00 179.23 3hwo n TYR 27 N -2.94 0.00 -4.15 1.56 9.36 -1.26 -4.97 117.16 114.77 3hwo n TYR 27 Ca -0.00 0.00 -0.24 0.00 3.32 0.00 0.00 57.90 60.98 3hwo n TYR 27 Cb 0.23 -0.06 -0.17 0.00 -0.63 0.00 0.00 39.34 38.71 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 -0.12 1.25 -0.06 2.98 1.81 -1.26 -5.14 118.95 118.42 3hwo s ARG 28 Ca 0.00 -0.21 0.02 0.00 -1.72 0.00 0.00 55.73 53.83 3hwo s ARG 28 Cb 0.00 -1.24 -0.03 0.00 -0.45 0.00 0.00 34.95 33.23 3hwo s ARG 28 CO 0.00 -0.14 -0.11 -1.12 -0.68 0.00 0.00 175.30 173.25 3hwo s SER 29 N 1.24 4.29 -0.01 0.23 0.01 -1.26 -4.06 113.70 114.14 3hwo s SER 29 Ca -0.05 -0.12 -0.29 0.00 1.31 0.00 0.00 55.95 56.79 3hwo s SER 29 Cb -0.14 -0.98 0.10 0.00 0.21 0.00 0.00 66.02 65.21 3hwo s SER 29 CO -0.02 0.35 1.01 0.72 0.41 0.00 0.00 173.24 175.71 3hwo s PHE 30 N -0.77 -0.22 0.38 2.43 -0.71 -0.49 -1.62 117.98 116.98 3hwo s PHE 30 Ca 0.12 0.07 0.08 0.00 -1.04 0.00 0.00 56.93 56.16 3hwo s PHE 30 Cb -0.11 0.56 -0.07 0.00 -1.21 0.00 0.00 43.02 42.19 3hwo s PHE 30 CO 0.01 -0.51 0.00 0.95 -1.34 0.00 0.00 175.22 174.33 3hwo s THR 31 N -2.94 2.23 0.23 -4.49 -4.23 -0.89 -1.14 115.64 104.41 3hwo s THR 31 Ca 0.08 -2.02 0.03 0.00 -1.18 0.00 0.00 61.69 58.61 3hwo s THR 31 Cb -0.00 -2.86 -0.05 0.00 1.34 0.00 0.00 72.50 70.93 3hwo s THR 31 CO -0.05 -0.10 -0.00 0.42 -0.54 0.00 0.00 174.62 174.35 3hwo s THR 32 N -2.63 1.03 -0.01 3.99 -4.23 -0.35 -0.60 115.64 112.84 3hwo s THR 32 Ca 0.35 -2.03 0.01 0.00 -1.18 0.00 0.00 61.69 58.83 3hwo s THR 32 Cb 0.05 -2.35 0.01 0.00 1.34 0.00 0.00 72.50 71.55 3hwo s THR 32 CO 0.18 -0.32 -0.02 -0.44 -0.54 0.00 0.00 174.62 173.49 3hwo s SER 33 N -3.31 0.35 0.68 3.99 0.01 0.29 -4.31 113.70 111.41 3hwo s SER 33 Ca 0.29 -0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.51 3hwo s SER 33 Cb 0.06 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.18 3hwo s SER 33 CO 0.09 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.33 3hwo n GLY 34 N 3.47 -1.11 2.95 3.44 0.00 -1.26 -0.92 105.19 111.76 3hwo n GLY 34 Ca -0.18 -1.11 -0.07 0.00 0.00 0.00 0.00 46.02 44.66 3hwo n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hwo h PHE 36 N 8.14 0.63 -1.74 0.00 3.57 -0.38 -3.44 116.94 123.73 3hwo h PHE 36 Ca -0.12 -0.20 0.05 0.00 3.53 0.00 0.00 57.97 61.23 3hwo h PHE 36 Cb 1.14 -0.13 -0.24 0.00 2.79 0.00 0.00 35.95 39.51 3hwo h PHE 36 CO 0.22 0.90 0.28 0.00 -2.23 0.00 0.00 178.31 177.48 3hwo s ALA 37 N -4.22 -2.02 0.38 2.41 0.00 -1.10 -5.01 121.76 112.21 3hwo s ALA 37 Ca -0.13 2.15 -0.06 0.00 0.00 0.00 0.00 51.96 53.92 3hwo s ALA 37 Cb 0.07 -1.49 -0.05 0.00 0.00 0.00 0.00 23.12 21.65 3hwo s ALA 37 CO 0.79 -0.32 0.67 1.03 0.00 0.00 0.00 175.76 177.93 3hwo s ARG 38 N 0.97 3.62 -0.19 0.00 0.52 -1.26 -0.99 118.95 121.62 3hwo s ARG 38 Ca -0.05 0.12 -0.04 0.00 -0.52 0.00 0.00 55.73 55.25 3hwo s ARG 38 Cb -0.05 -2.51 0.09 0.00 0.52 0.00 0.00 34.95 33.00 3hwo s ARG 38 CO -0.11 0.03 0.22 0.12 0.02 0.00 0.00 175.30 175.57 3hwo s PHE 39 N -2.37 -0.29 -0.32 -0.53 5.36 0.01 -4.94 117.98 114.91 3hwo s PHE 39 Ca 0.46 0.32 0.03 0.00 -0.96 0.00 0.00 56.93 56.78 3hwo s PHE 39 Cb -0.10 -0.32 0.03 0.00 -0.34 0.00 0.00 43.02 42.29 3hwo s PHE 39 CO 0.35 -0.56 0.68 -0.40 -1.46 0.00 0.00 175.22 173.84 3hwo n ASP 40 N 5.32 1.43 -4.62 6.13 5.68 -1.26 -2.28 116.55 126.95 3hwo n ASP 40 Ca -0.05 -1.29 -0.52 0.00 -0.50 0.00 0.00 54.79 52.42 3hwo n ASP 40 Cb 0.50 -0.01 -0.06 0.00 -1.14 0.00 0.00 41.12 40.41 3hwo n ASP 40 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 3hwo n GLU 41 N 0.07 1.31 -1.68 0.11 4.07 -1.26 -1.20 120.64 122.05 3hwo n GLU 41 Ca 0.02 0.47 -0.44 0.00 -0.06 0.00 0.00 57.16 57.16 3hwo n GLU 41 Cb 0.11 -2.15 -0.02 0.00 -0.06 0.00 0.00 31.44 29.33 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 3.13 2.09 -0.03 5.31 -0.02 -1.26 -3.73 135.00 140.48 3hwo n PRO 42 Ca 0.19 0.74 0.10 0.00 -2.02 0.00 0.00 63.50 62.51 3hwo n PRO 42 Cb 0.20 -2.36 0.49 0.00 -0.02 0.00 0.00 33.50 31.81 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 1.19 2.57 -1.62 3.55 0.00 -0.70 -4.59 120.51 120.91 3hwo n ALA 43 Ca 0.08 -0.30 -0.41 0.00 0.00 0.00 0.00 53.44 52.81 3hwo n ALA 43 Cb 0.34 -1.21 0.01 0.00 0.00 0.00 0.00 19.45 18.58 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 -0.30 2.47 -0.90 0.00 3.14 0.11 -0.72 118.33 122.13 3hwo n VAL 44 Ca 0.15 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 61.03 3hwo n VAL 44 Cb 0.18 -1.19 0.00 0.00 -1.06 0.00 0.00 33.84 31.77 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 0.47 -5.16 0.00 6.55 3.02 -1.26 -4.74 115.26 114.14 3hwo n ASN 45 Ca 0.09 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.68 3hwo n ASN 45 Cb 0.39 -3.25 0.24 0.00 -0.61 0.00 0.00 39.78 36.56 3hwo n ASN 45 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hwo n GLY 46 N 0.69 -0.27 0.17 7.41 0.00 0.10 -1.62 105.19 111.68 3hwo n GLY 46 Ca 0.00 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.09 3hwo n GLY 46 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3hwo h ASP 47 N 0.00 0.00 -3.50 1.61 3.04 -1.82 -3.35 116.42 112.39 3hwo h ASP 47 Ca 0.00 0.00 -0.60 0.00 -3.24 0.00 0.00 57.03 53.19 3hwo h ASP 47 Cb 0.00 0.00 -0.11 0.00 -1.04 0.00 0.00 39.33 38.18 3hwo h ASP 47 CO 0.00 0.00 -0.11 -0.55 -2.04 0.00 0.00 179.24 176.54 3hwo s SER 48 N -5.44 6.48 0.64 4.15 0.15 -0.64 -4.81 113.70 114.24 3hwo s SER 48 Ca 0.09 0.57 0.25 0.00 0.70 0.00 0.00 55.95 57.56 3hwo s SER 48 Cb 0.08 -2.26 1.30 0.00 -1.71 0.00 0.00 66.02 63.43 3hwo s SER 48 CO 0.63 -0.16 1.74 -0.65 1.20 0.00 0.00 173.24 176.01 3hwo h PRO 49 N 7.55 0.00 0.00 5.44 0.11 -1.86 -1.16 132.00 142.08 3hwo h PRO 49 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3hwo h PRO 49 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3hwo h PRO 49 CO 0.72 0.00 -0.80 -0.25 -0.21 0.00 0.00 178.00 177.46 3hwo n ASP 50 N -3.07 0.69 -4.62 -2.05 8.00 -1.26 -4.14 116.55 110.09 3hwo n ASP 50 Ca 0.03 -0.49 -0.39 0.00 0.71 0.00 0.00 54.79 54.65 3hwo n ASP 50 Cb 0.62 0.64 0.04 0.00 -0.02 0.00 0.00 41.12 42.40 3hwo n ASP 50 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3hwo n SER 51 N -1.62 1.05 -0.18 -2.24 3.41 -0.44 -4.79 113.62 108.81 3hwo n SER 51 Ca 0.04 0.88 0.19 0.00 -0.26 0.00 0.00 58.87 59.73 3hwo n SER 51 Cb 0.36 -1.39 0.56 0.00 -0.26 0.00 0.00 64.21 63.48 3hwo n SER 51 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3hwo h PRO 52 N 0.86 0.30 -0.24 4.33 0.11 -1.90 -2.01 132.00 133.44 3hwo h PRO 52 Ca -0.48 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 3hwo h PRO 52 Cb 1.35 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 3hwo h PRO 52 CO 0.53 0.20 0.12 0.35 -0.21 0.00 0.00 178.00 178.98 3hwo h PHE 53 N 0.30 0.35 -0.26 0.65 3.57 -1.85 -1.48 116.94 118.22 3hwo h PHE 53 Ca 0.41 -0.02 -0.18 0.00 3.53 0.00 0.00 57.97 61.71 3hwo h PHE 53 Cb 1.13 -0.11 -0.00 0.00 2.79 0.00 0.00 35.95 39.76 3hwo h PHE 53 CO -0.00 0.33 -0.57 1.96 -2.23 0.00 0.00 178.31 177.80 3hwo h GLN 54 N 0.27 0.81 -0.41 1.11 1.08 -1.71 -2.64 115.11 113.61 3hwo h GLN 54 Ca 0.08 -0.52 -0.00 0.00 -1.45 0.00 0.00 58.65 56.76 3hwo h GLN 54 Cb 0.11 0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.58 3hwo h GLN 54 CO -0.01 1.15 0.26 1.96 -0.95 0.00 0.00 178.83 181.24 3hwo h GLN 55 N 0.61 0.55 0.00 1.46 4.20 -1.33 -1.15 115.11 119.46 3hwo h GLN 55 Ca 0.01 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 3hwo h GLN 55 Cb 1.16 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.82 3hwo h GLN 55 CO 0.12 0.40 -0.18 0.87 -0.67 0.00 0.00 178.83 179.37 3hwo h LYS 56 N 0.55 0.00 -0.00 1.46 1.57 -1.33 -0.53 116.57 118.29 3hwo h LYS 56 Ca 0.15 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.74 3hwo h LYS 56 Cb -0.02 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.30 3hwo h LYS 56 CO -0.03 0.18 -0.72 1.25 -0.57 0.00 0.00 179.45 179.56 3hwo h LEU 57 N 0.00 0.64 0.08 2.94 5.85 -1.15 -1.49 115.31 122.19 3hwo h LEU 57 Ca -0.00 -0.75 -0.00 0.00 0.84 0.00 0.00 57.88 57.96 3hwo h LEU 57 Cb 0.81 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.65 3hwo h LEU 57 CO 0.02 1.31 -0.04 0.00 -0.34 0.00 0.00 178.44 179.39 3hwo h ALA 58 N 0.34 -0.11 -1.00 1.25 0.00 -1.09 -1.83 119.26 116.82 3hwo h ALA 58 Ca -0.09 -0.11 0.19 0.00 0.00 0.00 0.00 54.91 54.90 3hwo h ALA 58 Cb 1.42 0.04 -0.10 0.00 0.00 0.00 0.00 17.79 19.14 3hwo h ALA 58 CO 0.14 -0.46 0.61 0.00 0.00 0.00 0.00 179.25 179.54 3hwo h ALA 59 N 0.59 1.70 0.00 0.00 0.00 -1.14 -0.57 119.26 119.85 3hwo h ALA 59 Ca -0.01 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 3hwo h ALA 59 Cb 0.26 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3hwo h ALA 59 CO 0.02 -0.07 -0.54 1.25 0.00 0.00 0.00 179.25 179.91 3hwo h LEU 60 N 0.75 0.00 -0.19 0.00 5.85 -1.03 -2.07 115.31 118.63 3hwo h LEU 60 Ca 0.57 0.00 -0.22 0.00 0.84 0.00 0.00 57.88 59.07 3hwo h LEU 60 Cb 0.90 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.94 3hwo h LEU 60 CO -0.36 0.54 -0.90 -0.26 -0.34 0.00 0.00 178.44 177.12 3hwo h PHE 61 N 0.00 0.71 -0.79 1.25 0.04 -0.29 -2.29 116.94 115.57 3hwo h PHE 61 Ca -0.01 -0.37 -0.04 0.00 2.80 0.00 0.00 57.97 60.36 3hwo h PHE 61 Cb 1.09 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 39.11 3hwo h PHE 61 CO 0.00 1.18 0.33 0.00 -0.60 0.00 0.00 178.31 179.22 3hwo h ALA 62 N 0.71 1.10 0.40 2.45 0.00 -1.09 -2.12 119.26 120.71 3hwo h ALA 62 Ca -0.08 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 3hwo h ALA 62 Cb 1.53 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3hwo h ALA 62 CO 0.16 0.65 -0.19 -0.44 0.00 0.00 0.00 179.25 179.43 3hwo h ASP 63 N 1.14 -0.46 -0.46 0.00 5.19 -1.35 -1.27 116.42 119.21 3hwo h ASP 63 Ca 0.26 0.01 0.10 0.00 -0.62 0.00 0.00 57.03 56.78 3hwo h ASP 63 Cb 0.18 0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.79 3hwo h ASP 63 CO -0.03 -0.31 0.32 0.00 -3.12 0.00 0.00 179.24 176.10 3hwo h ALA 64 N 0.04 2.21 -0.07 3.45 0.00 -1.24 -0.91 119.26 122.75 3hwo h ALA 64 Ca -0.06 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.70 3hwo h ALA 64 Cb 0.42 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.20 3hwo h ALA 64 CO 0.09 -0.32 -0.50 0.87 0.00 0.00 0.00 179.25 179.39 3hwo h LYS 65 N 0.17 0.46 0.00 0.00 1.57 -1.23 0.37 116.57 117.91 3hwo h LYS 65 Ca 0.22 -0.40 -0.02 0.00 -1.87 0.00 0.00 60.65 58.57 3hwo h LYS 65 Cb 0.63 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 33.03 3hwo h LYS 65 CO -0.03 1.04 -0.09 0.00 -0.57 0.00 0.00 179.45 179.80 3hwo h ALA 66 N 0.42 1.26 -0.56 3.86 0.00 0.02 0.24 119.26 124.50 3hwo h ALA 66 Ca -0.04 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3hwo h ALA 66 Cb 1.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3hwo h ALA 66 CO 0.10 0.11 0.00 1.04 0.00 0.00 0.00 179.25 180.50 3hwo n GLN 67 N -3.57 2.33 -2.37 0.00 3.00 -0.61 -4.94 117.38 111.22 3hwo n GLN 67 Ca -0.02 -2.03 -0.08 0.00 -0.01 0.00 0.00 57.00 54.86 3hwo n GLN 67 Cb 0.21 -1.45 0.01 0.00 0.00 0.00 0.00 30.24 29.01 3hwo n GLN 67 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3hwo n GLY 68 N 1.38 0.17 3.66 1.08 0.00 0.84 -5.01 105.19 107.30 3hwo n GLY 68 Ca 0.19 -0.50 -0.42 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.60 4.80 -0.48 -0.61 1.01 0.13 -5.00 121.20 118.45 3hwo s ILE 69 Ca 0.06 1.76 -0.22 0.00 0.00 0.00 0.00 60.65 62.25 3hwo s ILE 69 Cb -0.03 -4.19 0.03 0.00 0.01 0.00 0.00 42.46 38.28 3hwo s ILE 69 CO 0.08 -0.08 0.77 -0.75 0.00 0.00 0.00 174.94 174.97 3hwo s LYS 70 N 2.73 3.32 -0.36 2.79 2.36 -1.26 -4.22 119.74 125.11 3hwo s LYS 70 Ca 0.39 -0.30 -0.01 0.00 -2.55 0.00 0.00 55.97 53.50 3hwo s LYS 70 Cb -0.16 -3.99 -0.01 0.00 -1.05 0.00 0.00 37.83 32.62 3hwo s LYS 70 CO 0.09 -1.20 0.33 0.09 1.55 0.00 0.00 175.35 176.20 3hwo n ASN 71 N 6.74 -4.34 -4.76 1.43 3.02 -1.26 -4.98 115.26 111.10 3hwo n ASN 71 Ca 0.00 -0.11 -0.40 0.00 -0.03 0.00 0.00 54.58 54.04 3hwo n ASN 71 Cb 0.48 -2.75 -0.04 0.00 -0.61 0.00 0.00 39.78 36.85 3hwo n ASN 71 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3hwo s PRO 72 N -3.18 4.57 0.07 3.52 0.05 -1.26 -4.98 135.00 133.79 3hwo s PRO 72 Ca 0.06 1.90 0.09 0.00 0.05 0.00 0.00 61.00 63.09 3hwo s PRO 72 Cb -0.01 -3.17 -0.03 0.00 0.05 0.00 0.00 34.50 31.34 3hwo s PRO 72 CO 0.32 0.10 -0.24 0.14 0.05 0.00 0.00 177.00 177.37 3hwo s VAL 73 N -1.04 2.40 -0.33 -0.36 -7.23 -1.26 -3.69 120.40 108.90 3hwo s VAL 73 Ca 0.46 -1.41 -0.12 0.00 -1.81 0.00 0.00 61.98 59.10 3hwo s VAL 73 Cb -0.34 -2.00 -0.01 0.00 0.56 0.00 0.00 36.38 34.59 3hwo s VAL 73 CO 0.43 0.29 0.21 -0.32 -0.31 0.00 0.00 175.10 175.40 3hwo s MET 74 N -1.52 3.44 0.31 4.82 1.75 0.81 -4.00 119.30 124.92 3hwo s MET 74 Ca 0.13 -0.67 0.10 0.00 -1.25 0.00 0.00 55.69 54.01 3hwo s MET 74 Cb -0.10 -3.73 -0.05 0.00 2.84 0.00 0.00 34.83 33.79 3hwo s MET 74 CO 0.04 -0.43 -0.10 0.14 -0.65 0.00 0.00 175.02 174.02 3hwo s VAL 75 N 1.69 2.57 -1.36 10.11 -7.23 -0.53 -0.75 120.40 124.90 3hwo s VAL 75 Ca 0.06 -2.19 0.00 0.00 -1.81 0.00 0.00 61.98 58.04 3hwo s VAL 75 Cb -0.17 -2.58 0.00 0.00 0.56 0.00 0.00 36.38 34.18 3hwo s VAL 75 CO 0.09 -0.29 0.00 0.61 -0.31 0.00 0.00 175.10 175.20 3hwo n GLY 76 N -0.78 0.37 2.91 2.32 0.00 -0.85 -0.35 105.19 108.81 3hwo n GLY 76 Ca -0.05 -1.78 -0.12 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.58 -0.10 -0.06 4.61 0.00 -0.87 -1.31 121.76 122.44 3hwo s ALA 77 Ca 0.00 0.13 0.03 0.00 0.00 0.00 0.00 51.96 52.12 3hwo s ALA 77 Cb 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.02 3hwo s ALA 77 CO 0.00 -0.02 -0.13 0.42 0.00 0.00 0.00 175.76 176.03 3hwo s ILE 78 N 0.06 3.18 0.70 0.00 1.01 0.40 -0.54 121.20 126.01 3hwo s ILE 78 Ca -0.00 -0.67 -0.12 0.00 0.00 0.00 0.00 60.65 59.85 3hwo s ILE 78 Cb -0.01 -2.27 0.01 0.00 0.01 0.00 0.00 42.46 40.21 3hwo s ILE 78 CO -0.00 0.58 1.08 -2.16 0.00 0.00 0.00 174.94 174.44 3hwo s PRO 79 N -0.60 2.77 0.22 2.79 0.04 -1.26 -1.86 135.00 137.10 3hwo s PRO 79 Ca 0.09 1.13 -0.14 0.00 0.04 0.00 0.00 61.00 62.12 3hwo s PRO 79 Cb -0.11 -1.96 0.26 0.00 0.04 0.00 0.00 34.50 32.72 3hwo s PRO 79 CO 0.01 -1.24 1.60 0.35 0.04 0.00 0.00 177.00 177.76 3hwo h PHE 80 N -0.53 -0.51 -3.42 0.56 3.57 -1.31 -3.32 116.94 111.98 3hwo h PHE 80 Ca -0.45 0.07 -0.70 0.00 3.53 0.00 0.00 57.97 60.42 3hwo h PHE 80 Cb 1.22 0.33 -0.19 0.00 2.79 0.00 0.00 35.95 40.11 3hwo h PHE 80 CO 0.59 -0.33 -0.15 0.34 -2.23 0.00 0.00 178.31 176.53 3hwo s ASP 81 N -5.23 6.20 0.00 0.41 2.15 -1.26 -4.73 116.67 114.21 3hwo s ASP 81 Ca -0.14 -0.84 0.17 0.00 0.43 0.00 0.00 52.55 52.17 3hwo s ASP 81 Cb 0.20 -2.24 1.03 0.00 -0.30 0.00 0.00 42.92 41.61 3hwo s ASP 81 CO 0.73 -0.68 1.50 -0.81 -0.17 0.00 0.00 175.17 175.74 3hwo n PRO 82 N 5.71 0.75 0.15 4.34 -0.04 -1.25 -1.79 135.00 142.88 3hwo n PRO 82 Ca -0.08 0.00 0.04 0.00 -0.04 0.00 0.00 63.50 63.42 3hwo n PRO 82 Cb 0.46 -1.36 0.09 0.00 -0.04 0.00 0.00 33.50 32.66 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 0.00 -7.15 0.54 3.08 -1.92 0.59 114.38 109.51 3hwo h ARG 83 Ca 0.00 0.00 -0.47 0.00 0.07 0.00 0.00 59.98 59.58 3hwo h ARG 83 Cb 0.00 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.08 3hwo h ARG 83 CO 0.00 0.45 0.37 -0.65 -1.07 0.00 0.00 179.97 179.07 3hwo s GLN 84 N -3.08 3.78 0.69 0.04 -0.21 -0.74 -4.77 119.66 115.37 3hwo s GLN 84 Ca 0.03 1.13 -0.17 0.00 0.02 0.00 0.00 55.36 56.38 3hwo s GLN 84 Cb 0.08 -2.10 0.02 0.00 1.00 0.00 0.00 33.01 32.00 3hwo s GLN 84 CO 0.73 -0.43 1.26 -1.25 -2.12 0.00 0.00 175.29 173.48 3hwo s PRO 85 N -3.79 2.29 0.47 2.91 0.04 -1.26 -4.36 135.00 131.30 3hwo s PRO 85 Ca 0.62 1.95 -0.01 0.00 0.04 0.00 0.00 61.00 63.60 3hwo s PRO 85 Cb -0.13 -1.83 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 3hwo s PRO 85 CO 0.28 -1.77 0.72 -1.12 0.04 0.00 0.00 177.00 175.15 3hwo s SER 86 N -1.65 5.86 -0.63 6.66 0.01 -0.34 -4.59 113.70 119.01 3hwo s SER 86 Ca 0.79 0.44 0.04 0.00 1.31 0.00 0.00 55.95 58.53 3hwo s SER 86 Cb -0.34 -1.67 0.36 0.00 0.21 0.00 0.00 66.02 64.58 3hwo s SER 86 CO 0.43 -0.73 1.21 -1.20 0.41 0.00 0.00 173.24 173.36 3hwo n SER 87 N -2.18 5.24 -4.83 2.44 7.64 0.30 -4.32 113.62 117.91 3hwo n SER 87 Ca 0.01 -3.71 -0.26 0.00 1.01 0.00 0.00 58.87 55.92 3hwo n SER 87 Cb 0.57 -0.67 -0.05 0.00 -1.01 0.00 0.00 64.21 63.06 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 -3.68 3.92 -0.09 -3.43 2.01 -0.97 -2.04 118.68 114.40 3hwo s LEU 88 Ca 0.47 -0.07 -0.31 0.00 0.01 0.00 0.00 54.13 54.24 3hwo s LEU 88 Cb 0.31 -2.52 0.09 0.00 0.01 0.00 0.00 46.19 44.08 3hwo s LEU 88 CO -0.17 0.06 0.80 -0.72 1.01 0.00 0.00 176.35 177.33 3hwo s TYR 89 N -1.76 -0.55 -0.25 0.29 -0.85 0.52 -0.81 117.35 113.94 3hwo s TYR 89 Ca 0.32 0.94 -0.22 0.00 -0.52 0.00 0.00 57.07 57.59 3hwo s TYR 89 Cb -0.10 0.43 -0.01 0.00 0.38 0.00 0.00 41.96 42.65 3hwo s TYR 89 CO 0.25 -0.51 0.71 0.42 -1.52 0.00 0.00 175.55 174.90 3hwo s ILE 90 N -1.16 4.92 0.90 -3.49 1.01 -0.16 -1.45 121.20 121.77 3hwo s ILE 90 Ca -0.08 1.29 -0.12 0.00 0.00 0.00 0.00 60.65 61.74 3hwo s ILE 90 Cb -0.00 -4.01 0.13 0.00 0.01 0.00 0.00 42.46 38.59 3hwo s ILE 90 CO 0.07 -0.03 1.15 -2.16 0.00 0.00 0.00 174.94 173.97 3hwo s PRO 91 N 2.65 1.20 0.17 2.79 0.04 -1.26 0.23 135.00 140.82 3hwo s PRO 91 Ca 0.30 0.24 0.06 0.00 0.04 0.00 0.00 61.00 61.63 3hwo s PRO 91 Cb -0.15 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 3hwo s PRO 91 CO 0.08 -2.15 1.38 1.49 0.04 0.00 0.00 177.00 177.84 3hwo h GLU 92 N -1.46 0.07 -3.23 4.56 4.57 -1.10 -3.36 114.58 114.62 3hwo h GLU 92 Ca -0.50 -0.09 -0.12 0.00 -1.18 0.00 0.00 59.36 57.47 3hwo h GLU 92 Cb 1.33 0.03 -0.20 0.00 -0.16 0.00 0.00 28.75 29.75 3hwo h GLU 92 CO 0.61 0.91 -0.35 0.45 -1.18 0.00 0.00 179.01 179.45 3hwo s SER 93 N -6.83 -0.10 -0.00 1.04 0.15 -0.57 -4.83 113.70 102.55 3hwo s SER 93 Ca -0.01 -0.05 -0.00 0.00 0.70 0.00 0.00 55.95 56.58 3hwo s SER 93 Cb 0.10 0.28 -0.00 0.00 -1.71 0.00 0.00 66.02 64.69 3hwo s SER 93 CO 0.81 -0.44 0.01 -1.66 1.20 0.00 0.00 173.24 173.16 3hwo s TRP 94 N -1.49 0.01 -0.26 3.44 1.48 -1.26 -0.55 118.94 120.30 3hwo s TRP 94 Ca -0.13 -0.01 -0.01 0.00 -1.06 0.00 0.00 56.10 54.89 3hwo s TRP 94 Cb -0.06 -0.01 0.08 0.00 -1.16 0.00 0.00 33.47 32.33 3hwo s TRP 94 CO 0.03 -0.02 0.06 -0.65 -4.06 0.00 0.00 176.95 172.30 3hwo s GLN 95 N -0.12 0.84 0.75 3.25 1.11 0.23 -4.97 119.66 120.75 3hwo s GLN 95 Ca -0.01 -0.88 -0.13 0.00 0.01 0.00 0.00 55.36 54.35 3hwo s GLN 95 Cb -0.01 -2.13 0.05 0.00 -1.01 0.00 0.00 33.01 29.91 3hwo s GLN 95 CO -0.00 -0.83 1.14 -1.54 0.01 0.00 0.00 175.29 174.07 3hwo s SER 96 N 1.65 4.31 0.19 5.90 1.04 -1.26 -2.09 113.70 123.44 3hwo s SER 96 Ca 0.04 2.10 -0.03 0.00 0.48 0.00 0.00 55.95 58.55 3hwo s SER 96 Cb -0.17 -2.56 -0.03 0.00 0.10 0.00 0.00 66.02 63.35 3hwo s SER 96 CO -0.17 -2.17 0.17 0.72 0.98 0.00 0.00 173.24 172.76 3hwo s PHE 97 N -2.42 1.00 -0.42 5.02 -0.71 -0.64 -4.88 117.98 114.93 3hwo s PHE 97 Ca 0.68 -1.26 -0.24 0.00 -1.04 0.00 0.00 56.93 55.07 3hwo s PHE 97 Cb -0.23 -0.44 0.02 0.00 -1.21 0.00 0.00 43.02 41.16 3hwo s PHE 97 CO 0.49 -0.67 0.82 0.45 -1.34 0.00 0.00 175.22 174.97 3hwo s SER 98 N -3.12 6.49 0.18 1.98 0.15 -1.26 -4.51 113.70 113.61 3hwo s SER 98 Ca 0.34 0.12 -0.14 0.00 0.70 0.00 0.00 55.95 56.98 3hwo s SER 98 Cb 0.06 -2.41 0.16 0.00 -1.71 0.00 0.00 66.02 62.12 3hwo s SER 98 CO 0.10 -0.89 1.73 -0.09 1.20 0.00 0.00 173.24 175.29 3hwo h ARG 99 N 8.82 0.25 -0.67 5.44 2.43 -1.94 -0.18 114.38 128.54 3hwo h ARG 99 Ca -0.24 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 58.92 3hwo h ARG 99 Cb 1.09 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 30.55 3hwo h ARG 99 CO 0.96 0.17 0.44 -0.56 -1.51 0.00 0.00 179.97 179.47 3hwo h GLN 100 N 0.26 0.88 0.04 0.20 3.07 -1.96 -0.57 115.11 117.03 3hwo h GLN 100 Ca 0.23 -0.05 0.01 0.00 0.09 0.00 0.00 58.65 58.93 3hwo h GLN 100 Cb 0.28 -0.20 -0.02 0.00 0.08 0.00 0.00 27.48 27.62 3hwo h GLN 100 CO -0.28 0.59 -0.10 0.93 0.09 0.00 0.00 178.83 180.06 3hwo h GLU 101 N 0.90 -0.18 -0.54 0.06 3.07 -1.85 -2.85 114.58 113.18 3hwo h GLU 101 Ca 0.24 0.01 0.02 0.00 -0.50 0.00 0.00 59.36 59.14 3hwo h GLU 101 Cb -0.10 0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 27.82 3hwo h GLU 101 CO -0.05 -0.12 0.36 -0.22 -1.40 0.00 0.00 179.01 177.57 3hwo h LYS 102 N -0.19 0.64 -0.59 2.33 3.11 -0.64 -0.68 116.57 120.55 3hwo h LYS 102 Ca 0.02 -0.04 0.02 0.00 -2.81 0.00 0.00 60.65 57.85 3hwo h LYS 102 Cb 0.22 -0.15 -0.04 0.00 -1.00 0.00 0.00 32.23 31.26 3hwo h LYS 102 CO -0.07 0.43 0.37 1.96 -2.81 0.00 0.00 179.45 179.32 3hwo h GLN 103 N 0.66 0.71 0.25 1.90 4.20 -0.89 -1.81 115.11 120.13 3hwo h GLN 103 Ca 0.21 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.87 3hwo h GLN 103 Cb 0.03 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.65 3hwo h GLN 103 CO -0.05 0.47 -0.12 0.00 -0.67 0.00 0.00 178.83 178.45 3hwo h ALA 104 N 1.25 -0.34 -0.42 3.87 0.00 -1.15 -3.15 119.26 119.33 3hwo h ALA 104 Ca 0.24 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.01 3hwo h ALA 104 Cb 0.01 0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.86 3hwo h ALA 104 CO -0.09 -0.53 -0.42 0.77 0.00 0.00 0.00 179.25 178.98 3hwo h SER 105 N -0.66 -1.44 -0.88 0.00 0.02 -1.08 -1.97 113.55 107.54 3hwo h SER 105 Ca -0.03 0.20 0.21 0.00 -0.84 0.00 0.00 61.79 61.32 3hwo h SER 105 Cb 0.47 0.60 -0.06 0.00 0.14 0.00 0.00 62.40 63.55 3hwo h SER 105 CO 0.06 -0.26 0.59 0.00 -1.14 0.00 0.00 176.83 176.08 3hwo h ALA 106 N -0.25 2.30 -0.32 3.77 0.00 -1.41 -0.39 119.26 122.97 3hwo h ALA 106 Ca 0.07 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 3hwo h ALA 106 Cb 0.40 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3hwo h ALA 106 CO -0.51 -0.57 -0.27 -0.09 0.00 0.00 0.00 179.25 177.81 3hwo h ARG 107 N 0.34 0.65 0.00 0.00 2.43 -1.31 -3.31 114.38 113.18 3hwo h ARG 107 Ca 0.45 -0.27 0.00 0.00 -0.81 0.00 0.00 59.98 59.35 3hwo h ARG 107 Cb 1.23 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 3hwo h ARG 107 CO -0.15 0.85 0.00 0.54 -1.51 0.00 0.00 179.97 179.71 3hwo n ARG 108 N -4.10 0.00 0.00 0.20 3.00 -0.17 -4.79 116.66 110.81 3hwo n ARG 108 Ca -0.00 0.02 0.00 0.00 -0.01 0.00 0.00 57.85 57.86 3hwo n ARG 108 Cb 0.44 -0.95 0.00 0.00 0.00 0.00 0.00 32.46 31.95 3hwo n ARG 108 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 3hwo n PHE 109 N -0.57 0.00 -0.08 -1.55 7.35 -1.14 -4.78 117.46 116.69 3hwo n PHE 109 Ca 0.00 0.00 -0.14 0.00 -0.76 0.00 0.00 57.45 56.55 3hwo n PHE 109 Cb 0.00 0.00 -0.14 0.00 0.35 0.00 0.00 39.48 39.69 3hwo n PHE 109 CO 0.00 0.00 0.00 0.25 -0.76 0.00 0.00 176.76 176.25 3hwo n THR 110 N 0.00 1.53 -1.65 -2.13 -2.24 -1.26 -4.94 114.28 103.59 3hwo n THR 110 Ca 0.00 -0.72 -0.52 0.00 -2.27 0.00 0.00 64.05 60.54 3hwo n THR 110 Cb 0.00 -1.11 -0.06 0.00 -2.10 0.00 0.00 70.33 67.07 3hwo n THR 110 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 3hwo n ARG 111 N -3.10 1.47 -3.29 -0.78 0.63 -1.26 -4.98 116.66 105.34 3hwo n ARG 111 Ca -0.34 0.53 -0.13 0.00 -0.92 0.00 0.00 57.85 56.99 3hwo n ARG 111 Cb 1.07 -2.24 -0.04 0.00 0.45 0.00 0.00 32.46 31.70 3hwo n ARG 111 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 3hwo n SER 112 N 4.06 0.91 -3.86 6.15 7.64 -1.26 -5.04 113.62 122.23 3hwo n SER 112 Ca 0.21 -2.18 -0.29 0.00 1.01 0.00 0.00 58.87 57.62 3hwo n SER 112 Cb 0.20 0.61 -0.16 0.00 -1.01 0.00 0.00 64.21 63.85 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 -2.83 1.24 0.02 1.43 0.74 -1.26 -5.11 119.66 113.90 3hwo s GLN 113 Ca 0.13 -0.64 -0.30 0.00 0.05 0.00 0.00 55.36 54.59 3hwo s GLN 113 Cb 0.01 -2.22 -0.07 0.00 1.10 0.00 0.00 33.01 31.82 3hwo s GLN 113 CO 0.09 -0.55 1.65 -1.12 -0.55 0.00 0.00 175.29 174.81 3hwo s SER 114 N 1.63 6.64 0.11 6.67 0.01 -1.26 -5.00 113.70 122.48 3hwo s SER 114 Ca -0.02 2.39 0.07 0.00 1.31 0.00 0.00 55.95 59.70 3hwo s SER 114 Cb -0.17 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.47 3hwo s SER 114 CO -0.07 -0.89 -0.08 -0.76 0.41 0.00 0.00 173.24 171.84 3hwo s LEU 115 N 3.14 3.11 -0.23 2.44 2.01 -1.26 -5.03 118.68 122.86 3hwo s LEU 115 Ca 0.74 -0.36 0.01 0.00 0.01 0.00 0.00 54.13 54.53 3hwo s LEU 115 Cb -0.37 -1.89 0.04 0.00 0.01 0.00 0.00 46.19 43.97 3hwo s LEU 115 CO 0.31 0.17 -0.13 0.20 1.01 0.00 0.00 176.35 177.92 3hwo s ASN 116 N -2.25 3.96 -0.27 2.29 0.01 -1.26 -5.01 114.94 112.41 3hwo s ASN 116 Ca 0.22 -0.99 -0.29 0.00 -0.71 0.00 0.00 52.86 51.09 3hwo s ASN 116 Cb -0.11 -1.56 -0.01 0.00 0.41 0.00 0.00 41.25 39.98 3hwo s ASN 116 CO 0.15 -0.11 1.36 0.54 -1.51 0.00 0.00 177.10 177.52 3hwo s VAL 117 N 1.23 4.07 -0.08 1.60 0.11 -1.26 -1.08 120.40 124.99 3hwo s VAL 117 Ca -0.02 1.22 -0.18 0.00 -2.93 0.00 0.00 61.98 60.08 3hwo s VAL 117 Cb -0.17 -4.05 -0.29 0.00 -1.53 0.00 0.00 36.38 30.35 3hwo s VAL 117 CO -0.08 -0.40 0.68 0.58 -3.33 0.00 0.00 175.10 172.56 3hwo h VAL 118 N 5.93 1.21 -3.78 2.04 2.07 -0.91 -3.47 116.25 119.34 3hwo h VAL 118 Ca -0.28 -2.45 -0.24 0.00 0.82 0.00 0.00 66.70 64.55 3hwo h VAL 118 Cb 1.11 2.89 -0.27 0.00 -1.52 0.00 0.00 31.29 33.50 3hwo h VAL 118 CO 1.02 0.70 -0.72 -0.70 0.02 0.00 0.00 177.57 177.89 3hwo s GLU 119 N -2.46 0.09 -0.06 1.57 2.12 -0.74 -4.99 118.70 114.23 3hwo s GLU 119 Ca -0.17 -0.10 0.02 0.00 0.36 0.00 0.00 54.97 55.08 3hwo s GLU 119 Cb 0.03 -0.05 0.02 0.00 0.26 0.00 0.00 34.13 34.39 3hwo s GLU 119 CO 0.79 0.01 -0.09 0.50 -0.54 0.00 0.00 175.26 175.93 3hwo s ARG 120 N -0.18 1.39 -0.12 4.30 3.52 -1.26 -1.10 118.95 125.50 3hwo s ARG 120 Ca -0.01 -0.30 -0.05 0.00 -0.13 0.00 0.00 55.73 55.24 3hwo s ARG 120 Cb -0.01 -1.21 0.06 0.00 -1.56 0.00 0.00 34.95 32.22 3hwo s ARG 120 CO -0.00 -0.02 0.25 -1.14 -0.81 0.00 0.00 175.30 173.57 3hwo s GLN 121 N 0.79 0.15 -0.19 5.12 2.00 -0.14 -4.99 119.66 122.41 3hwo s GLN 121 Ca -0.13 0.66 -0.24 0.00 -2.00 0.00 0.00 55.36 53.66 3hwo s GLN 121 Cb -0.15 -0.09 -0.02 0.00 0.80 0.00 0.00 33.01 33.56 3hwo s GLN 121 CO 0.02 -0.25 0.77 0.00 -0.50 0.00 0.00 175.29 175.33 3hwo s ALA 122 N 2.06 3.54 -0.23 1.58 0.00 -1.26 0.78 121.76 128.22 3hwo s ALA 122 Ca -0.02 -0.08 0.02 0.00 0.00 0.00 0.00 51.96 51.88 3hwo s ALA 122 Cb -0.12 -3.16 0.05 0.00 0.00 0.00 0.00 23.12 19.89 3hwo s ALA 122 CO -0.08 -0.66 -0.11 0.42 0.00 0.00 0.00 175.76 175.32 3hwo s ILE 123 N 2.18 1.93 0.45 0.00 1.09 0.14 -3.54 121.20 123.45 3hwo s ILE 123 Ca 0.35 -1.33 -0.08 0.00 -1.10 0.00 0.00 60.65 58.49 3hwo s ILE 123 Cb -0.16 -2.02 0.10 0.00 -1.06 0.00 0.00 42.46 39.32 3hwo s ILE 123 CO 0.11 0.08 0.61 -0.81 -0.10 0.00 0.00 174.94 174.84 3hwo n PRO 124 N 4.55 -0.59 -2.46 2.79 -0.04 -1.26 0.22 135.00 138.20 3hwo n PRO 124 Ca -0.15 -0.95 -0.24 0.00 -0.04 0.00 0.00 63.50 62.12 3hwo n PRO 124 Cb 0.44 -0.63 0.08 0.00 -0.04 0.00 0.00 33.50 33.36 3hwo n PRO 124 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3hwo s GLU 125 N -4.34 1.97 0.09 0.54 2.02 -1.23 -4.79 118.70 112.96 3hwo s GLU 125 Ca 0.35 -0.77 -0.31 0.00 0.02 0.00 0.00 54.97 54.26 3hwo s GLU 125 Cb -0.01 -2.30 -0.14 0.00 0.10 0.00 0.00 34.13 31.78 3hwo s GLU 125 CO 0.24 -1.26 1.62 0.37 0.02 0.00 0.00 175.26 176.26 3hwo h GLN 126 N -0.46 -0.69 -0.88 1.61 4.15 -1.99 -0.29 115.11 116.56 3hwo h GLN 126 Ca -0.40 0.05 0.02 0.00 0.77 0.00 0.00 58.65 59.08 3hwo h GLN 126 Cb 1.28 0.16 -0.05 0.00 0.21 0.00 0.00 27.48 29.09 3hwo h GLN 126 CO 0.48 -0.46 0.58 1.15 -1.93 0.00 0.00 178.83 178.64 3hwo h THR 127 N -0.72 1.19 -0.24 2.39 2.02 -1.99 -0.61 112.91 114.96 3hwo h THR 127 Ca -0.04 -0.40 -0.00 0.00 0.77 0.00 0.00 66.41 66.74 3hwo h THR 127 Cb 0.62 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 3hwo h THR 127 CO -0.01 0.21 0.13 0.74 0.37 0.00 0.00 175.52 176.96 3hwo h THR 128 N 1.16 1.12 -0.96 3.16 2.02 -1.83 -0.63 112.91 116.94 3hwo h THR 128 Ca 0.33 -0.31 0.01 0.00 0.77 0.00 0.00 66.41 67.21 3hwo h THR 128 Cb -0.08 0.89 -0.05 0.00 -1.74 0.00 0.00 68.15 67.17 3hwo h THR 128 CO -0.09 0.11 0.62 0.15 0.37 0.00 0.00 175.52 176.69 3hwo h PHE 129 N 0.28 1.22 -0.27 3.16 3.57 -0.64 -0.85 116.94 123.40 3hwo h PHE 129 Ca 0.08 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.49 3hwo h PHE 129 Cb 0.07 -0.41 -0.01 0.00 2.79 0.00 0.00 35.95 38.38 3hwo h PHE 129 CO -0.03 0.78 -0.29 0.93 -2.23 0.00 0.00 178.31 177.46 3hwo h GLU 130 N 1.31 0.55 -0.55 1.11 5.08 -0.96 -1.36 114.58 119.76 3hwo h GLU 130 Ca 0.35 -0.23 -0.08 0.00 -1.00 0.00 0.00 59.36 58.40 3hwo h GLU 130 Cb -0.13 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 3hwo h GLU 130 CO -0.07 0.78 0.02 1.96 -1.00 0.00 0.00 179.01 180.70 3hwo h GLN 131 N 0.47 0.92 -0.10 2.33 4.20 -0.41 -0.54 115.11 121.99 3hwo h GLN 131 Ca 0.06 -0.26 0.01 0.00 0.06 0.00 0.00 58.65 58.53 3hwo h GLN 131 Cb 0.75 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.41 3hwo h GLN 131 CO 0.06 0.90 0.01 0.52 -0.67 0.00 0.00 178.83 179.65 3hwo h MET 132 N 0.86 0.04 -0.51 1.46 2.86 -0.79 -1.27 114.93 117.58 3hwo h MET 132 Ca 0.16 -0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.85 3hwo h MET 132 Cb 0.48 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.08 3hwo h MET 132 CO 0.02 0.03 0.24 0.28 1.06 0.00 0.00 176.91 178.54 3hwo h VAL 133 N 0.04 0.91 -0.75 -2.22 2.07 -1.08 -0.03 116.25 115.20 3hwo h VAL 133 Ca 0.04 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 3hwo h VAL 133 Cb 0.05 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 3hwo h VAL 133 CO -0.07 0.08 0.36 0.00 0.02 0.00 0.00 177.57 177.96 3hwo h ALA 134 N 1.30 0.96 -0.32 1.67 0.00 -0.95 0.28 119.26 122.20 3hwo h ALA 134 Ca 0.23 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 3hwo h ALA 134 Cb 0.18 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3hwo h ALA 134 CO -0.19 0.53 0.15 -0.09 0.00 0.00 0.00 179.25 179.65 3hwo h ARG 135 N 1.05 0.47 -0.49 0.00 1.12 -0.56 -1.89 114.38 114.08 3hwo h ARG 135 Ca 0.26 -0.08 -0.10 0.00 -1.11 0.00 0.00 59.98 58.96 3hwo h ARG 135 Cb 0.12 -0.08 -0.02 0.00 -0.01 0.00 0.00 29.97 29.98 3hwo h ARG 135 CO -0.03 0.45 -0.06 0.00 -3.11 0.00 0.00 179.97 177.22 3hwo h ALA 136 N 1.00 0.67 -0.53 2.80 0.00 -0.56 -2.32 119.26 120.32 3hwo h ALA 136 Ca 0.11 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.67 3hwo h ALA 136 Cb 0.14 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3hwo h ALA 136 CO -0.01 0.54 0.21 0.00 0.00 0.00 0.00 179.25 179.99 3hwo h ALA 137 N 0.91 1.38 -0.56 0.00 0.00 -0.34 -0.06 119.26 120.58 3hwo h ALA 137 Ca 0.13 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3hwo h ALA 137 Cb 0.61 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 3hwo h ALA 137 CO 0.04 0.47 -0.00 0.00 0.00 0.00 0.00 179.25 179.75 3hwo h ALA 138 N 1.48 0.76 -0.37 0.00 0.00 -1.18 -3.06 119.26 116.89 3hwo h ALA 138 Ca 0.18 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 3hwo h ALA 138 Cb 0.15 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3hwo h ALA 138 CO -0.02 0.59 -0.17 -0.07 0.00 0.00 0.00 179.25 179.58 3hwo h LEU 139 N 0.88 0.68 -0.66 0.00 3.38 -0.79 -2.85 115.31 115.94 3hwo h LEU 139 Ca 0.16 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3hwo h LEU 139 Cb 0.55 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3hwo h LEU 139 CO 0.03 0.86 0.00 0.71 0.09 0.00 0.00 178.44 180.12 3hwo h THR 140 N 0.61 0.00 0.00 0.22 1.35 -0.95 -2.46 112.91 111.69 3hwo h THR 140 Ca 0.10 -0.29 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 3hwo h THR 140 Cb 0.63 1.08 0.00 0.00 -1.73 0.00 0.00 68.15 68.13 3hwo h THR 140 CO 0.04 0.00 -0.36 0.00 -0.25 0.00 0.00 175.52 174.95 3hwo h ALA 141 N 2.28 0.77 -1.90 6.62 0.00 -1.41 -3.41 119.26 122.21 3hwo h ALA 141 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.46 3hwo h ALA 141 Cb 0.43 0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.28 3hwo h ALA 141 CO 0.00 0.00 0.05 0.95 0.00 0.00 0.00 179.25 180.25 3hwo s THR 142 N -3.16 2.49 -1.83 0.00 -4.23 -0.92 -5.00 115.64 103.00 3hwo s THR 142 Ca 0.08 -0.55 0.30 0.00 -1.18 0.00 0.00 61.69 60.34 3hwo s THR 142 Cb 0.12 -2.94 0.76 0.00 1.34 0.00 0.00 72.50 71.77 3hwo s THR 142 CO 0.67 0.00 2.11 -2.65 -0.54 0.00 0.00 174.62 174.21 3hwo n PRO 143 N -2.56 0.79 0.24 3.99 -0.02 -1.26 -3.76 135.00 132.42 3hwo n PRO 143 Ca 0.09 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.66 3hwo n PRO 143 Cb 0.60 -1.50 0.59 0.00 -0.02 0.00 0.00 33.50 33.17 3hwo n PRO 143 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 3hwo h GLN 144 N 0.00 0.00 -1.73 -0.52 4.15 -1.94 -3.46 115.11 111.61 3hwo h GLN 144 Ca 0.00 0.00 0.11 0.00 0.77 0.00 0.00 58.65 59.53 3hwo h GLN 144 Cb 0.08 0.00 -0.21 0.00 0.21 0.00 0.00 27.48 27.57 3hwo h GLN 144 CO 0.00 0.18 0.57 0.54 -1.93 0.00 0.00 178.83 178.19 3hwo s VAL 145 N -4.35 0.00 -0.06 2.39 0.11 -1.25 -4.81 120.40 112.43 3hwo s VAL 145 Ca -0.03 0.00 0.05 0.00 -2.93 0.00 0.00 61.98 59.07 3hwo s VAL 145 Cb 0.14 -1.00 -0.07 0.00 -1.53 0.00 0.00 36.38 33.92 3hwo s VAL 145 CO 0.64 0.00 0.01 0.47 -3.33 0.00 0.00 175.10 172.90 3hwo n ASP 146 N 0.38 3.55 -3.72 3.54 8.00 0.95 -4.12 116.55 125.12 3hwo n ASP 146 Ca -0.08 -0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.29 3hwo n ASP 146 Cb 0.59 0.58 -0.10 0.00 -0.02 0.00 0.00 41.12 42.16 3hwo n ASP 146 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 3hwo s LYS 147 N -2.14 0.44 -0.05 -1.24 2.20 -0.47 -4.69 119.74 113.79 3hwo s LYS 147 Ca -0.04 0.64 0.01 0.00 -0.36 0.00 0.00 55.97 56.23 3hwo s LYS 147 Cb 0.02 0.14 0.02 0.00 -1.51 0.00 0.00 37.83 36.49 3hwo s LYS 147 CO 0.23 -0.09 -0.07 0.08 -0.36 0.00 0.00 175.35 175.13 3hwo s VAL 148 N 0.65 0.77 -0.26 4.02 1.01 -0.99 -0.77 120.40 124.83 3hwo s VAL 148 Ca -0.04 -0.26 -0.17 0.00 0.00 0.00 0.00 61.98 61.52 3hwo s VAL 148 Cb -0.05 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.55 3hwo s VAL 148 CO -0.04 0.28 0.46 -0.69 0.00 0.00 0.00 175.10 175.10 3hwo s VAL 149 N 0.85 5.12 0.00 2.92 1.01 0.24 -0.35 120.40 130.19 3hwo s VAL 149 Ca -0.12 0.76 0.04 0.00 0.00 0.00 0.00 61.98 62.67 3hwo s VAL 149 Cb -0.15 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 3hwo s VAL 149 CO 0.01 0.12 -0.10 -0.76 0.00 0.00 0.00 175.10 174.37 3hwo s LEU 150 N 2.14 2.97 0.36 3.92 1.43 -0.67 -4.86 118.68 123.97 3hwo s LEU 150 Ca 0.19 -0.21 0.04 0.00 -1.03 0.00 0.00 54.13 53.11 3hwo s LEU 150 Cb -0.16 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.31 3hwo s LEU 150 CO 0.09 0.29 0.08 -0.94 0.23 0.00 0.00 176.35 176.10 3hwo s SER 151 N -1.29 2.53 0.25 2.29 1.04 -1.26 -0.83 113.70 116.43 3hwo s SER 151 Ca 0.15 -1.48 -0.11 0.00 0.48 0.00 0.00 55.95 54.99 3hwo s SER 151 Cb -0.11 0.13 -0.01 0.00 0.10 0.00 0.00 66.02 66.14 3hwo s SER 151 CO 0.06 -0.72 0.44 0.00 0.98 0.00 0.00 173.24 174.00 3hwo s ARG 152 N -3.84 1.53 0.09 4.02 1.70 0.13 -4.83 118.95 117.75 3hwo s ARG 152 Ca 0.31 -1.31 0.06 0.00 -0.47 0.00 0.00 55.73 54.33 3hwo s ARG 152 Cb 0.07 0.45 -0.03 0.00 -0.57 0.00 0.00 34.95 34.86 3hwo s ARG 152 CO 0.15 -0.63 -0.17 -0.51 -1.08 0.00 0.00 175.30 173.06 3hwo s LEU 153 N -3.04 2.31 -0.19 -1.89 1.02 0.13 -2.21 118.68 114.81 3hwo s LEU 153 Ca 0.24 -0.68 0.01 0.00 0.02 0.00 0.00 54.13 53.73 3hwo s LEU 153 Cb 0.00 -0.67 0.03 0.00 0.02 0.00 0.00 46.19 45.58 3hwo s LEU 153 CO 0.10 -0.04 -0.15 -0.63 0.02 0.00 0.00 176.35 175.66 3hwo s ILE 154 N -1.39 1.83 -0.09 -0.59 1.01 -0.94 0.24 121.20 121.27 3hwo s ILE 154 Ca 0.03 -0.97 -0.19 0.00 0.00 0.00 0.00 60.65 59.52 3hwo s ILE 154 Cb -0.09 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.56 3hwo s ILE 154 CO 0.03 0.35 0.53 -1.81 0.00 0.00 0.00 174.94 174.04 3hwo s ASP 155 N 1.35 6.78 -0.13 3.58 1.01 0.23 -1.41 116.67 128.09 3hwo s ASP 155 Ca 0.02 0.94 0.01 0.00 0.71 0.00 0.00 52.55 54.22 3hwo s ASP 155 Cb -0.15 -2.32 0.02 0.00 1.01 0.00 0.00 42.92 41.48 3hwo s ASP 155 CO -0.10 0.00 -0.15 -0.63 0.21 0.00 0.00 175.17 174.50 3hwo s ILE 156 N 0.49 1.54 -0.21 0.77 1.01 0.36 -0.97 121.20 124.20 3hwo s ILE 156 Ca 0.29 -0.65 -0.07 0.00 0.00 0.00 0.00 60.65 60.23 3hwo s ILE 156 Cb -0.16 -1.43 -0.03 0.00 0.01 0.00 0.00 42.46 40.85 3hwo s ILE 156 CO 0.13 0.45 0.04 -0.89 0.00 0.00 0.00 174.94 174.67 3hwo s THR 157 N 1.20 4.40 0.48 2.92 2.01 -0.26 -0.68 115.64 125.71 3hwo s THR 157 Ca -0.02 -0.16 0.05 0.00 0.31 0.00 0.00 61.69 61.87 3hwo s THR 157 Cb -0.14 -3.00 0.05 0.00 0.01 0.00 0.00 72.50 69.42 3hwo s THR 157 CO -0.05 0.41 0.41 0.35 -0.69 0.00 0.00 174.62 175.05 3hwo n THR 158 N 4.13 0.00 -0.06 -0.82 -2.24 0.21 -0.28 114.28 115.22 3hwo n THR 158 Ca -0.17 -1.85 -0.12 0.00 -2.27 0.00 0.00 64.05 59.65 3hwo n THR 158 Cb 0.52 -0.17 -0.06 0.00 -2.10 0.00 0.00 70.33 68.52 3hwo n THR 158 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 3hwo h ASP 159 N 0.49 0.34 -4.59 3.42 -0.00 -1.40 -3.43 116.42 111.24 3hwo h ASP 159 Ca -0.29 -0.38 -0.47 0.00 -0.00 0.00 0.00 57.03 55.89 3hwo h ASP 159 Cb 1.09 -0.09 -0.14 0.00 -0.00 0.00 0.00 39.33 40.20 3hwo h ASP 159 CO 0.45 0.64 -0.53 0.00 -0.00 0.00 0.00 179.24 179.80 3hwo s ALA 160 N -4.69 2.21 0.57 4.15 0.00 -1.26 -5.04 121.76 117.69 3hwo s ALA 160 Ca -0.14 -1.69 -0.20 0.00 0.00 0.00 0.00 51.96 49.93 3hwo s ALA 160 Cb 0.06 1.13 -0.05 0.00 0.00 0.00 0.00 23.12 24.25 3hwo s ALA 160 CO 0.74 -0.50 1.06 0.00 0.00 0.00 0.00 175.76 177.05 3hwo n ALA 161 N -0.69 0.48 -2.68 0.00 0.00 -1.26 -4.22 120.51 112.14 3hwo n ALA 161 Ca 0.01 0.06 -0.37 0.00 0.00 0.00 0.00 53.44 53.14 3hwo n ALA 161 Cb 0.64 -2.16 -0.07 0.00 0.00 0.00 0.00 19.45 17.87 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 -1.43 5.24 -0.31 0.00 1.01 0.19 -4.86 121.20 121.04 3hwo s ILE 162 Ca 0.73 0.64 -0.27 0.00 0.00 0.00 0.00 60.65 61.76 3hwo s ILE 162 Cb -0.44 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.39 3hwo s ILE 162 CO 0.49 0.45 0.96 -0.62 0.00 0.00 0.00 174.94 176.21 3hwo s ASP 163 N -0.06 6.83 0.11 3.58 2.15 -1.26 -4.78 116.67 123.24 3hwo s ASP 163 Ca 0.19 0.91 -0.03 0.00 0.43 0.00 0.00 52.55 54.05 3hwo s ASP 163 Cb -0.14 -2.49 -0.15 0.00 -0.30 0.00 0.00 42.92 39.84 3hwo s ASP 163 CO 0.07 -0.76 1.25 0.77 -0.17 0.00 0.00 175.17 176.34 3hwo h SER 164 N 8.06 0.44 0.44 -0.34 4.64 -1.97 -3.08 113.55 121.75 3hwo h SER 164 Ca -0.22 -0.40 -0.06 0.00 -0.47 0.00 0.00 61.79 60.64 3hwo h SER 164 Cb 1.07 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 63.02 3hwo h SER 164 CO 0.97 1.24 -0.30 1.23 -0.87 0.00 0.00 176.83 179.10 3hwo h GLY 165 N 1.48 0.00 0.99 -0.77 0.00 -1.92 0.34 103.07 103.19 3hwo h GLY 165 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 46.93 3hwo h GLY 165 CO 0.17 0.00 -1.71 -0.24 0.00 0.00 0.00 176.54 174.76 3hwo h VAL 166 N 0.00 0.90 -0.74 4.60 3.04 -1.88 -3.21 116.25 118.96 3hwo h VAL 166 Ca -0.00 -2.66 -0.05 0.00 -1.01 0.00 0.00 66.70 62.97 3hwo h VAL 166 Cb 0.60 2.54 -0.03 0.00 -2.01 0.00 0.00 31.29 32.39 3hwo h VAL 166 CO 0.04 0.70 0.25 0.25 -1.01 0.00 0.00 177.57 177.80 3hwo h LEU 167 N 0.04 1.06 -1.80 3.16 5.85 -1.41 -2.42 115.31 119.78 3hwo h LEU 167 Ca -0.30 -0.19 0.06 0.00 0.84 0.00 0.00 57.88 58.30 3hwo h LEU 167 Cb 2.01 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 42.74 3hwo h LEU 167 CO 0.10 0.97 0.26 0.25 -0.34 0.00 0.00 178.44 179.68 3hwo h LEU 168 N 1.10 0.21 -0.05 2.25 5.85 -0.98 -2.25 115.31 121.44 3hwo h LEU 168 Ca 0.24 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.81 3hwo h LEU 168 Cb 0.28 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.27 3hwo h LEU 168 CO -0.01 0.14 -0.58 -0.08 -0.34 0.00 0.00 178.44 177.57 3hwo h GLU 169 N 0.24 0.47 -0.41 1.25 4.57 -1.44 -2.17 114.58 117.10 3hwo h GLU 169 Ca 0.17 -0.45 -0.03 0.00 -1.18 0.00 0.00 59.36 57.88 3hwo h GLU 169 Cb 0.37 0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.05 3hwo h GLU 169 CO -0.03 1.09 0.14 0.00 -1.18 0.00 0.00 179.01 179.03 3hwo h ARG 170 N 0.02 0.58 -0.12 1.92 3.08 -1.39 -1.67 114.38 116.80 3hwo h ARG 170 Ca -0.06 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 59.90 3hwo h ARG 170 Cb 1.26 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.19 3hwo h ARG 170 CO 0.12 0.50 0.05 1.25 -1.07 0.00 0.00 179.97 180.82 3hwo h LEU 171 N 0.58 0.16 -1.51 3.04 6.46 -1.30 -0.18 115.31 122.55 3hwo h LEU 171 Ca 0.14 -0.14 -0.02 0.00 -0.12 0.00 0.00 57.88 57.74 3hwo h LEU 171 Cb 0.15 -0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.02 3hwo h LEU 171 CO -0.01 0.26 0.11 0.40 -0.62 0.00 0.00 178.44 178.58 3hwo h ILE 172 N 0.05 1.13 -0.13 4.05 5.03 -1.24 -0.30 117.51 126.11 3hwo h ILE 172 Ca 0.04 -0.42 -0.05 0.00 -0.12 0.00 0.00 64.86 64.31 3hwo h ILE 172 Cb 0.15 0.78 -0.00 0.00 -3.03 0.00 0.00 36.82 34.71 3hwo h ILE 172 CO -0.00 0.16 -0.12 0.00 -0.68 0.00 0.00 178.15 177.50 3hwo h ALA 173 N 1.69 0.18 0.00 1.87 0.00 -0.83 -2.33 119.26 119.85 3hwo h ALA 173 Ca 0.11 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3hwo h ALA 173 Cb 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3hwo h ALA 173 CO -0.01 0.04 0.00 1.96 0.00 0.00 0.00 179.25 181.24 3hwo h GLN 174 N -0.08 0.00 -2.07 0.00 4.20 -0.93 -3.37 115.11 112.85 3hwo h GLN 174 Ca 0.02 0.00 -0.51 0.00 0.06 0.00 0.00 58.65 58.22 3hwo h GLN 174 Cb 0.65 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 28.02 3hwo h GLN 174 CO 0.03 0.00 -1.06 0.09 -0.67 0.00 0.00 178.83 177.22 3hwo n ASN 175 N -2.82 1.72 -0.27 1.46 3.02 -0.13 -4.80 115.26 113.45 3hwo n ASN 175 Ca 0.04 -3.17 0.07 0.00 -0.03 0.00 0.00 54.58 51.49 3hwo n ASN 175 Cb 0.44 -0.61 0.31 0.00 -0.61 0.00 0.00 39.78 39.31 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 3.04 0.84 -0.02 3.52 0.13 -1.60 -3.25 132.00 134.66 3hwo h PRO 176 Ca 0.11 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 3hwo h PRO 176 Cb 0.85 -0.19 0.00 0.00 0.13 0.00 0.00 31.00 31.79 3hwo h PRO 176 CO 0.58 0.55 -0.41 1.33 -0.23 0.00 0.00 178.00 179.82 3hwo n VAL 177 N -4.51 0.00 -2.06 1.56 0.24 -1.26 -4.93 118.33 107.36 3hwo n VAL 177 Ca 0.14 -0.28 -0.27 0.00 -2.04 0.00 0.00 64.34 61.89 3hwo n VAL 177 Cb 0.29 1.25 0.08 0.00 -1.47 0.00 0.00 33.84 33.99 3hwo n VAL 177 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3hwo s SER 178 N -2.42 4.58 -0.87 -1.34 1.04 -1.23 -4.92 113.70 108.54 3hwo s SER 178 Ca 0.20 0.57 -0.25 0.00 0.48 0.00 0.00 55.95 56.95 3hwo s SER 178 Cb 0.18 -1.12 0.03 0.00 0.10 0.00 0.00 66.02 65.22 3hwo s SER 178 CO 0.54 -1.80 1.43 -0.31 0.98 0.00 0.00 173.24 174.08 3hwo s TYR 179 N -3.42 2.33 -0.08 5.02 2.02 -0.04 -4.72 117.35 118.47 3hwo s TYR 179 Ca 0.62 -0.33 -0.16 0.00 -0.37 0.00 0.00 57.07 56.83 3hwo s TYR 179 Cb -0.10 -4.60 -0.05 0.00 -0.40 0.00 0.00 41.96 36.81 3hwo s TYR 179 CO 0.47 -2.01 0.42 -0.80 -1.57 0.00 0.00 175.55 172.06 3hwo s ASN 180 N 4.81 6.70 0.08 2.29 0.01 -1.06 -1.41 114.94 126.36 3hwo s ASN 180 Ca 0.44 0.83 -0.01 0.00 -0.71 0.00 0.00 52.86 53.40 3hwo s ASN 180 Cb -0.04 -2.26 -0.04 0.00 0.41 0.00 0.00 41.25 39.32 3hwo s ASN 180 CO 0.03 0.14 0.00 0.72 -1.51 0.00 0.00 177.10 176.48 3hwo s PHE 181 N -0.06 0.63 -0.29 2.20 -0.12 -0.31 -0.94 117.98 119.09 3hwo s PHE 181 Ca 0.24 -1.12 0.03 0.00 -0.05 0.00 0.00 56.93 56.02 3hwo s PHE 181 Cb -0.15 -0.42 0.18 0.00 -0.63 0.00 0.00 43.02 42.00 3hwo s PHE 181 CO 0.10 -0.43 0.52 -1.58 -0.05 0.00 0.00 175.22 173.78 3hwo s HIS 182 N -3.96 -1.47 -0.21 3.49 2.46 -0.90 -2.08 115.29 112.62 3hwo s HIS 182 Ca 0.13 0.97 -0.01 0.00 0.47 0.00 0.00 55.06 56.62 3hwo s HIS 182 Cb 0.08 0.20 0.02 0.00 -0.13 0.00 0.00 32.58 32.75 3hwo s HIS 182 CO -0.06 -0.98 -0.13 0.54 -2.47 0.00 0.00 174.74 171.64 3hwo s VAL 183 N 2.73 2.56 0.32 0.89 0.11 0.14 -1.69 120.40 125.45 3hwo s VAL 183 Ca 0.12 -0.90 -0.29 0.00 -2.93 0.00 0.00 61.98 57.98 3hwo s VAL 183 Cb -0.12 -2.18 -0.11 0.00 -1.53 0.00 0.00 36.38 32.44 3hwo s VAL 183 CO -0.25 0.40 1.55 -2.16 -3.33 0.00 0.00 175.10 171.31 3hwo s PRO 184 N 1.33 4.13 -0.09 1.54 0.04 -1.26 -1.27 135.00 139.42 3hwo s PRO 184 Ca 0.03 2.55 -0.01 0.00 0.04 0.00 0.00 61.00 63.61 3hwo s PRO 184 Cb -0.15 -3.01 -0.03 0.00 0.04 0.00 0.00 34.50 31.35 3hwo s PRO 184 CO -0.08 -0.58 -0.02 -0.51 0.04 0.00 0.00 177.00 175.85 3hwo s LEU 185 N -0.99 3.46 -0.01 -3.56 1.43 0.19 -4.91 118.68 114.29 3hwo s LEU 185 Ca 0.60 0.09 -0.30 0.00 -1.03 0.00 0.00 54.13 53.48 3hwo s LEU 185 Cb -0.47 -1.78 -0.05 0.00 0.03 0.00 0.00 46.19 43.92 3hwo s LEU 185 CO 0.52 0.36 1.27 0.00 0.23 0.00 0.00 176.35 178.73 3hwo s ALA 186 N -0.78 3.51 0.00 4.21 0.00 -1.26 -1.80 121.76 125.64 3hwo s ALA 186 Ca 0.12 0.76 0.00 0.00 0.00 0.00 0.00 51.96 52.84 3hwo s ALA 186 Cb -0.11 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.48 3hwo s ALA 186 CO 0.02 -0.75 0.00 -0.25 0.00 0.00 0.00 175.76 174.78 3hwo n ASP 187 N 4.99 -0.13 0.00 0.00 8.00 -1.26 -5.00 116.55 123.15 3hwo n ASP 187 Ca 0.11 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.61 3hwo n ASP 187 Cb 0.45 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 3hwo n ASP 187 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hwo n GLY 188 N -2.04 -2.71 0.00 0.44 0.00 -0.75 -5.09 105.19 95.05 3hwo n GLY 188 Ca 0.00 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.75 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 -1.24 0.43 2.98 -0.02 0.00 -1.26 -4.69 105.19 101.39 3hwo n GLY 189 Ca 0.00 -1.89 -0.20 0.00 0.00 0.00 0.00 46.02 43.93 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 -1.83 0.70 -0.18 1.61 1.01 0.31 -0.64 120.40 121.39 3hwo s VAL 190 Ca 0.00 -0.31 -0.17 0.00 0.00 0.00 0.00 61.98 61.50 3hwo s VAL 190 Cb 0.00 -0.64 -0.04 0.00 0.00 0.00 0.00 36.38 35.71 3hwo s VAL 190 CO 0.00 0.23 0.46 -0.22 0.00 0.00 0.00 175.10 175.57 3hwo s LEU 191 N 0.28 4.19 0.02 3.92 2.96 -0.40 -0.88 118.68 128.77 3hwo s LEU 191 Ca -0.04 0.65 0.03 0.00 -0.22 0.00 0.00 54.13 54.54 3hwo s LEU 191 Cb -0.09 -2.63 -0.02 0.00 0.50 0.00 0.00 46.19 43.96 3hwo s LEU 191 CO 0.00 -0.09 -0.08 -0.22 -1.32 0.00 0.00 176.35 174.64 3hwo s LEU 192 N 1.23 2.15 0.00 -0.68 2.96 -0.22 0.25 118.68 124.37 3hwo s LEU 192 Ca 0.23 -0.37 0.00 0.00 -0.22 0.00 0.00 54.13 53.77 3hwo s LEU 192 Cb -0.15 -0.29 0.00 0.00 0.50 0.00 0.00 46.19 46.25 3hwo s LEU 192 CO 0.09 -0.06 0.00 0.61 -1.32 0.00 0.00 176.35 175.67 3hwo n GLY 193 N 2.09 0.84 2.73 7.98 0.00 -0.88 -0.29 105.19 117.66 3hwo n GLY 193 Ca -0.18 -0.89 -0.28 0.00 0.00 0.00 0.00 46.02 44.66 3hwo n GLY 193 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hwo s ALA 194 N -2.00 2.70 -0.10 4.61 0.00 -0.62 -1.17 121.76 125.19 3hwo s ALA 194 Ca 0.00 -3.09 -0.20 0.00 0.00 0.00 0.00 51.96 48.67 3hwo s ALA 194 Cb 0.00 -1.95 -0.04 0.00 0.00 0.00 0.00 23.12 21.13 3hwo s ALA 194 CO 0.00 -2.05 0.55 0.45 0.00 0.00 0.00 175.76 174.71 3hwo s SER 195 N -0.44 6.79 0.00 0.00 0.15 -0.50 -4.68 113.70 115.01 3hwo s SER 195 Ca 0.24 0.95 0.27 0.00 0.70 0.00 0.00 55.95 58.10 3hwo s SER 195 Cb -0.11 -2.33 0.83 0.00 -1.71 0.00 0.00 66.02 62.70 3hwo s SER 195 CO -0.11 -0.03 1.61 -0.81 1.20 0.00 0.00 173.24 175.10 3hwo n PRO 196 N 3.66 0.83 -3.69 5.44 -0.04 -1.26 -0.86 135.00 139.09 3hwo n PRO 196 Ca -0.05 -0.47 -0.39 0.00 -0.04 0.00 0.00 63.50 62.55 3hwo n PRO 196 Cb 0.51 -1.49 -0.12 0.00 -0.04 0.00 0.00 33.50 32.37 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 -2.49 2.87 -0.14 0.54 2.12 -1.26 -4.95 118.70 115.39 3hwo s GLU 197 Ca 0.25 -1.02 -0.25 0.00 0.36 0.00 0.00 54.97 54.31 3hwo s GLU 197 Cb 0.19 -3.55 -0.02 0.00 0.26 0.00 0.00 34.13 31.01 3hwo s GLU 197 CO 0.51 -0.60 0.79 -1.17 -0.54 0.00 0.00 175.26 174.25 3hwo s LEU 198 N 1.50 4.22 -0.21 2.70 2.96 -1.25 -1.05 118.68 127.55 3hwo s LEU 198 Ca 0.01 1.18 -0.16 0.00 -0.22 0.00 0.00 54.13 54.94 3hwo s LEU 198 Cb -0.19 -3.19 -0.19 0.00 0.50 0.00 0.00 46.19 43.12 3hwo s LEU 198 CO 0.04 -0.31 0.11 -0.11 -1.32 0.00 0.00 176.35 174.77 3hwo n LEU 199 N 4.78 2.10 -3.52 -0.68 -0.00 0.01 -1.48 117.00 118.21 3hwo n LEU 199 Ca 0.03 0.33 0.00 0.00 -0.00 0.00 0.00 56.01 56.37 3hwo n LEU 199 Cb 0.50 -0.97 -0.03 0.00 -0.00 0.00 0.00 43.42 42.91 3hwo n LEU 199 CO 0.48 0.49 0.23 -0.22 -0.00 0.00 0.00 177.39 178.37 3hwo s LEU 200 N -7.56 -1.20 -0.14 -1.96 2.96 -0.66 -4.38 118.68 105.74 3hwo s LEU 200 Ca -0.30 1.39 -0.03 0.00 -0.22 0.00 0.00 54.13 54.97 3hwo s LEU 200 Cb 0.08 2.26 -0.03 0.00 0.50 0.00 0.00 46.19 49.00 3hwo s LEU 200 CO 0.61 -0.23 -0.03 -0.60 -1.32 0.00 0.00 176.35 174.78 3hwo s ARG 201 N 2.89 3.53 -0.05 1.98 3.52 0.68 -1.33 118.95 130.18 3hwo s ARG 201 Ca 0.01 -0.49 0.05 0.00 -0.13 0.00 0.00 55.73 55.17 3hwo s ARG 201 Cb -0.13 -2.90 -0.01 0.00 -1.56 0.00 0.00 34.95 30.36 3hwo s ARG 201 CO -0.19 0.34 -0.20 0.21 -0.81 0.00 0.00 175.30 174.65 3hwo s LYS 202 N 0.09 2.03 -0.13 5.12 2.20 -0.47 -0.02 119.74 128.57 3hwo s LYS 202 Ca 0.00 -0.71 -0.04 0.00 -0.36 0.00 0.00 55.97 54.87 3hwo s LYS 202 Cb -0.13 -1.75 0.06 0.00 -1.51 0.00 0.00 37.83 34.50 3hwo s LYS 202 CO 0.02 0.29 0.14 0.34 -0.36 0.00 0.00 175.35 175.79 3hwo s ASP 203 N -0.03 1.35 0.57 1.43 2.15 0.16 -2.97 116.67 119.33 3hwo s ASP 203 Ca -0.04 -0.07 0.00 0.00 0.43 0.00 0.00 52.55 52.87 3hwo s ASP 203 Cb -0.12 0.12 0.00 0.00 -0.30 0.00 0.00 42.92 42.62 3hwo s ASP 203 CO 0.03 -0.29 0.00 0.61 -0.17 0.00 0.00 175.17 175.34 3hwo n GLY 204 N 5.31 2.39 0.00 2.66 0.00 -1.26 -0.97 105.19 113.31 3hwo n GLY 204 Ca -0.05 -0.19 0.12 0.00 0.00 0.00 0.00 46.02 45.90 3hwo n GLY 204 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3hwo n GLU 205 N 14.00 0.08 -3.44 1.61 0.28 -1.26 -4.81 120.64 127.10 3hwo n GLU 205 Ca 0.00 0.08 -0.38 0.00 -0.16 0.00 0.00 57.16 56.70 3hwo n GLU 205 Cb 0.00 -1.50 -0.06 0.00 1.43 0.00 0.00 31.44 31.31 3hwo n GLU 205 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 3hwo s ARG 206 N -2.90 4.08 0.19 3.44 0.52 -0.15 0.49 118.95 124.62 3hwo s ARG 206 Ca 0.14 0.42 0.05 0.00 -0.52 0.00 0.00 55.73 55.82 3hwo s ARG 206 Cb 0.16 -3.30 -0.05 0.00 0.52 0.00 0.00 34.95 32.28 3hwo s ARG 206 CO 0.42 0.50 -0.07 -0.59 0.02 0.00 0.00 175.30 175.58 3hwo s PHE 207 N -0.48 1.45 0.17 -0.53 -0.12 -1.06 0.38 117.98 117.79 3hwo s PHE 207 Ca 0.24 -0.79 -0.07 0.00 -0.05 0.00 0.00 56.93 56.27 3hwo s PHE 207 Cb -0.16 -0.77 -0.02 0.00 -0.63 0.00 0.00 43.02 41.44 3hwo s PHE 207 CO 0.12 0.09 0.24 -1.54 -0.05 0.00 0.00 175.22 174.08 3hwo s SER 208 N -3.24 0.09 -0.16 1.98 1.04 0.97 -2.31 113.70 112.08 3hwo s SER 208 Ca 0.22 -1.01 -0.11 0.00 0.48 0.00 0.00 55.95 55.53 3hwo s SER 208 Cb 0.03 0.42 0.05 0.00 0.10 0.00 0.00 66.02 66.62 3hwo s SER 208 CO 0.04 -0.88 0.39 -0.55 0.98 0.00 0.00 173.24 173.22 3hwo s SER 209 N -3.01 -0.45 -0.59 7.02 0.15 -1.00 -0.23 113.70 115.59 3hwo s SER 209 Ca 0.22 0.82 0.04 0.00 0.70 0.00 0.00 55.95 57.74 3hwo s SER 209 Cb 0.04 0.76 0.17 0.00 -1.71 0.00 0.00 66.02 65.27 3hwo s SER 209 CO 0.03 -0.17 0.42 -0.63 1.20 0.00 0.00 173.24 174.09 3hwo s ILE 210 N 0.88 1.95 0.31 6.45 1.01 -0.55 -0.19 121.20 131.07 3hwo s ILE 210 Ca -0.05 -3.60 -0.30 0.00 0.00 0.00 0.00 60.65 56.70 3hwo s ILE 210 Cb -0.06 -2.30 -0.11 0.00 0.01 0.00 0.00 42.46 40.00 3hwo s ILE 210 CO -0.07 -1.07 1.57 -2.16 0.00 0.00 0.00 174.94 173.21 3hwo s PRO 211 N -0.80 4.13 -0.01 2.79 0.04 -1.23 -3.80 135.00 136.11 3hwo s PRO 211 Ca 0.27 2.56 0.05 0.00 0.04 0.00 0.00 61.00 63.92 3hwo s PRO 211 Cb -0.04 -3.02 -0.03 0.00 0.04 0.00 0.00 34.50 31.45 3hwo s PRO 211 CO -0.16 -0.60 -0.15 -0.51 0.04 0.00 0.00 177.00 175.62 3hwo s LEU 212 N -0.80 2.72 -0.29 -3.56 1.02 -1.26 -1.99 118.68 114.52 3hwo s LEU 212 Ca 0.61 -0.28 -0.22 0.00 0.02 0.00 0.00 54.13 54.27 3hwo s LEU 212 Cb -0.47 -1.57 0.14 0.00 0.02 0.00 0.00 46.19 44.31 3hwo s LEU 212 CO 0.51 0.31 1.06 0.00 0.02 0.00 0.00 176.35 178.24 3hwo s ALA 213 N -0.83 -2.11 0.00 4.21 0.00 -1.05 -4.78 121.76 117.21 3hwo s ALA 213 Ca 0.13 1.97 0.00 0.00 0.00 0.00 0.00 51.96 54.06 3hwo s ALA 213 Cb -0.11 -1.57 0.00 0.00 0.00 0.00 0.00 23.12 21.44 3hwo s ALA 213 CO 0.03 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 175.94 3hwo n GLY 214 N 2.65 2.34 3.05 0.00 0.00 -1.26 -4.10 105.19 107.87 3hwo n GLY 214 Ca -0.14 -1.28 -0.10 0.00 0.00 0.00 0.00 46.02 44.50 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 0.12 -0.00 1.61 0.01 -1.26 -2.47 113.70 111.71 3hwo s SER 215 Ca 0.00 -0.35 -0.12 0.00 1.31 0.00 0.00 55.95 56.79 3hwo s SER 215 Cb 0.00 0.16 0.02 0.00 0.21 0.00 0.00 66.02 66.40 3hwo s SER 215 CO 0.00 -0.35 0.25 0.00 0.41 0.00 0.00 173.24 173.56 3hwo s ALA 216 N -1.46 -0.62 0.21 1.44 0.00 -0.70 -4.98 121.76 115.65 3hwo s ALA 216 Ca -0.15 0.15 -0.30 0.00 0.00 0.00 0.00 51.96 51.66 3hwo s ALA 216 Cb -0.08 0.10 -0.09 0.00 0.00 0.00 0.00 23.12 23.05 3hwo s ALA 216 CO 0.00 -0.25 1.33 0.50 0.00 0.00 0.00 175.76 177.34 3hwo s ARG 217 N -1.43 4.37 0.78 0.00 3.52 -1.26 0.04 118.95 124.96 3hwo s ARG 217 Ca -0.13 2.09 -0.13 0.00 -0.13 0.00 0.00 55.73 57.42 3hwo s ARG 217 Cb -0.06 -3.18 0.07 0.00 -1.56 0.00 0.00 34.95 30.22 3hwo s ARG 217 CO 0.03 -0.28 1.18 1.03 -0.81 0.00 0.00 175.30 176.46 3hwo s ARG 218 N -0.15 1.88 0.07 5.12 1.81 -0.46 -4.70 118.95 122.52 3hwo s ARG 218 Ca 0.57 1.66 0.09 0.00 -1.72 0.00 0.00 55.73 56.33 3hwo s ARG 218 Cb -0.37 -1.81 -0.03 0.00 -0.45 0.00 0.00 34.95 32.28 3hwo s ARG 218 CO 0.39 -2.01 -0.26 -0.65 -0.68 0.00 0.00 175.30 172.09 3hwo s GLN 219 N -4.17 1.61 0.10 3.54 -1.52 -1.26 -4.96 119.66 113.00 3hwo s GLN 219 Ca 0.71 -1.15 -0.16 0.00 -1.95 0.00 0.00 55.36 52.81 3hwo s GLN 219 Cb -0.27 -1.87 -0.07 0.00 -0.22 0.00 0.00 33.01 30.58 3hwo s GLN 219 CO 0.49 0.47 1.46 -1.00 -0.25 0.00 0.00 175.29 176.46 3hwo h PRO 220 N 4.53 0.63 -6.46 2.91 0.13 -1.97 -3.41 132.00 128.36 3hwo h PRO 220 Ca -0.47 -0.28 -0.53 0.00 -0.87 0.00 0.00 66.00 63.85 3hwo h PRO 220 Cb 1.15 -0.01 0.03 0.00 0.13 0.00 0.00 31.00 32.30 3hwo h PRO 220 CO 0.42 0.87 1.04 0.34 -0.23 0.00 0.00 178.00 180.44 3hwo s ASP 221 N -6.34 6.54 0.29 1.44 -1.08 -1.26 -4.93 116.67 111.33 3hwo s ASP 221 Ca -0.13 2.58 -0.03 0.00 -0.52 0.00 0.00 52.55 54.45 3hwo s ASP 221 Cb 0.08 -2.56 0.40 0.00 -1.46 0.00 0.00 42.92 39.38 3hwo s ASP 221 CO 0.80 -0.93 1.95 -0.08 0.52 0.00 0.00 175.17 177.43 3hwo h GLU 222 N 8.48 1.13 0.08 4.34 4.81 -1.99 0.12 114.58 131.54 3hwo h GLU 222 Ca -0.44 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 58.71 3hwo h GLU 222 Cb 1.21 -0.25 0.00 0.00 0.63 0.00 0.00 28.75 30.34 3hwo h GLU 222 CO 0.94 0.76 -0.04 0.28 -0.73 0.00 0.00 179.01 180.22 3hwo h VAL 223 N 1.16 1.17 -0.80 0.32 2.07 -1.96 -2.71 116.25 115.51 3hwo h VAL 223 Ca 0.31 -1.02 0.04 0.00 0.82 0.00 0.00 66.70 66.84 3hwo h VAL 223 Cb -0.11 1.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.43 3hwo h VAL 223 CO -0.07 0.25 0.52 -0.07 0.02 0.00 0.00 177.57 178.23 3hwo h LEU 224 N -0.59 0.84 -0.26 2.57 3.38 -1.92 -1.37 115.31 117.96 3hwo h LEU 224 Ca -0.01 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3hwo h LEU 224 Cb 0.49 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3hwo h LEU 224 CO 0.02 0.58 0.14 -0.78 0.09 0.00 0.00 178.44 178.48 3hwo h ASP 225 N 0.97 0.32 -0.50 -0.43 3.58 -1.02 0.18 116.42 119.53 3hwo h ASP 225 Ca 0.32 -0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.66 3hwo h ASP 225 Cb 0.05 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 41.00 3hwo h ASP 225 CO -0.09 0.32 0.25 -0.09 -2.88 0.00 0.00 179.24 176.74 3hwo h ARG 226 N 0.30 0.75 -0.32 0.28 9.65 -1.13 -1.28 114.38 122.63 3hwo h ARG 226 Ca 0.09 -0.09 -0.13 0.00 -1.10 0.00 0.00 59.98 58.74 3hwo h ARG 226 Cb 0.07 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.49 3hwo h ARG 226 CO -0.01 0.59 -0.33 0.93 2.80 0.00 0.00 179.97 183.95 3hwo h GLU 227 N 0.75 0.72 -0.28 0.20 5.08 -0.69 -2.36 114.58 118.00 3hwo h GLU 227 Ca 0.19 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.19 3hwo h GLU 227 Cb 0.10 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3hwo h GLU 227 CO -0.02 0.95 0.12 0.00 -1.00 0.00 0.00 179.01 179.05 3hwo h ALA 228 N 1.02 0.36 -0.22 3.43 0.00 -0.47 -0.81 119.26 122.57 3hwo h ALA 228 Ca 0.06 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.92 3hwo h ALA 228 Cb 0.86 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.47 3hwo h ALA 228 CO 0.07 -0.05 -0.23 0.78 0.00 0.00 0.00 179.25 179.83 3hwo h GLY 229 N 0.30 -0.14 1.38 0.00 0.00 -1.15 -2.22 103.07 101.24 3hwo h GLY 229 Ca 0.09 0.28 -0.10 0.00 0.00 0.00 0.00 47.33 47.61 3hwo h GLY 229 CO -0.01 -0.19 -0.15 3.43 0.00 0.00 0.00 176.54 179.61 3hwo h ASN 230 N -0.24 0.73 0.23 0.19 2.35 -1.30 -2.22 115.58 115.32 3hwo h ASN 230 Ca 0.13 -0.23 -0.04 0.00 -0.55 0.00 0.00 56.30 55.61 3hwo h ASN 230 Cb 0.44 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 3hwo h ASN 230 CO -0.36 0.89 -0.20 -0.09 -1.65 0.00 0.00 177.43 176.02 3hwo h ARG 231 N 0.66 0.00 -0.17 0.81 2.43 -0.95 -2.87 114.38 114.29 3hwo h ARG 231 Ca 0.11 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 59.10 3hwo h ARG 231 Cb 0.63 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.19 3hwo h ARG 231 CO 0.04 0.20 -0.57 1.25 -1.51 0.00 0.00 179.97 179.39 3hwo h LEU 232 N 0.00 0.79 -1.90 3.80 5.85 -0.78 -2.16 115.31 120.91 3hwo h LEU 232 Ca -0.00 -0.60 0.16 0.00 0.84 0.00 0.00 57.88 58.28 3hwo h LEU 232 Cb 0.37 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.14 3hwo h LEU 232 CO 0.03 1.26 0.43 -0.07 -0.34 0.00 0.00 178.44 179.74 3hwo h LEU 233 N 0.38 0.09 -1.60 2.25 3.38 -1.30 -1.74 115.31 116.77 3hwo h LEU 233 Ca -0.02 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3hwo h LEU 233 Cb 1.19 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3hwo h LEU 233 CO 0.12 0.05 -0.01 0.00 0.09 0.00 0.00 178.44 178.69 3hwo n ALA 234 N -2.62 2.51 -2.23 1.53 0.00 -1.11 -4.91 120.51 113.69 3hwo n ALA 234 Ca 0.11 -0.61 -0.41 0.00 0.00 0.00 0.00 53.44 52.53 3hwo n ALA 234 Cb 0.61 -0.93 -0.03 0.00 0.00 0.00 0.00 19.45 19.10 3hwo n ALA 234 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3hwo s SER 235 N -2.01 5.91 0.17 0.00 0.15 -0.65 -4.90 113.70 112.37 3hwo s SER 235 Ca 0.31 0.55 -0.23 0.00 0.70 0.00 0.00 55.95 57.28 3hwo s SER 235 Cb 0.20 -2.54 0.07 0.00 -1.71 0.00 0.00 66.02 62.05 3hwo s SER 235 CO 0.31 -1.83 1.59 -0.08 1.20 0.00 0.00 173.24 174.44 3hwo h GLU 236 N 12.24 -0.22 -0.21 5.44 4.81 -1.90 0.44 114.58 135.17 3hwo h GLU 236 Ca -0.28 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.01 3hwo h GLU 236 Cb 1.12 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.51 3hwo h GLU 236 CO 1.15 -0.15 -0.07 -0.22 -0.73 0.00 0.00 179.01 178.99 3hwo h LYS 237 N -0.23 -0.03 -0.02 1.92 3.11 -1.97 0.43 116.57 119.78 3hwo h LYS 237 Ca 0.19 0.00 -0.16 0.00 -2.81 0.00 0.00 60.65 57.87 3hwo h LYS 237 Cb 0.55 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.77 3hwo h LYS 237 CO -0.60 -0.02 -0.72 -0.44 -2.81 0.00 0.00 179.45 174.86 3hwo h ASP 238 N -0.03 0.16 -0.48 4.20 3.32 -1.77 -1.79 116.42 120.03 3hwo h ASP 238 Ca 0.11 -0.11 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 3hwo h ASP 238 Cb 0.19 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 3hwo h ASP 238 CO -0.24 0.83 -0.13 0.03 -1.72 0.00 0.00 179.24 178.01 3hwo h ARG 239 N 0.09 0.93 0.02 3.56 2.47 0.12 -1.89 114.38 119.67 3hwo h ARG 239 Ca -0.02 -0.37 -0.00 0.00 -1.26 0.00 0.00 59.98 58.34 3hwo h ARG 239 Cb 1.28 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 29.55 3hwo h ARG 239 CO 0.10 1.03 -0.01 1.25 0.56 0.00 0.00 179.97 182.90 3hwo h HIS 240 N 0.78 -0.02 -0.99 3.04 2.76 -0.82 -0.10 115.15 119.81 3hwo h HIS 240 Ca 0.12 -0.00 0.19 0.00 -2.20 0.00 0.00 60.37 58.48 3hwo h HIS 240 Cb 0.69 0.01 -0.10 0.00 1.55 0.00 0.00 27.41 29.56 3hwo h HIS 240 CO 0.05 0.01 0.61 1.49 -1.30 0.00 0.00 177.93 178.79 3hwo h GLU 241 N -0.05 0.65 0.09 5.26 4.81 -1.33 -1.88 114.58 122.14 3hwo h GLU 241 Ca -0.00 -0.04 -0.25 0.00 -0.13 0.00 0.00 59.36 58.94 3hwo h GLU 241 Cb 0.04 -0.15 0.02 0.00 0.63 0.00 0.00 28.75 29.30 3hwo h GLU 241 CO 0.00 0.43 -1.04 1.25 -0.73 0.00 0.00 179.01 178.92 3hwo h HIS 242 N 0.67 0.88 -0.90 0.92 2.76 -0.98 -3.27 115.15 115.23 3hwo h HIS 242 Ca 0.55 -0.54 0.04 0.00 -2.20 0.00 0.00 60.37 58.22 3hwo h HIS 242 Cb 0.98 -0.08 -0.06 0.00 1.55 0.00 0.00 27.41 29.81 3hwo h HIS 242 CO -0.00 1.39 0.58 1.49 -1.30 0.00 0.00 177.93 180.09 3hwo h GLU 243 N 0.13 1.09 -0.28 5.26 4.57 -0.69 -0.99 114.58 123.67 3hwo h GLU 243 Ca -0.15 -0.07 0.05 0.00 -1.18 0.00 0.00 59.36 58.01 3hwo h GLU 243 Cb 1.74 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 30.07 3hwo h GLU 243 CO 0.20 0.72 0.19 -0.07 -1.18 0.00 0.00 179.01 178.87 3hwo h LEU 244 N 1.12 0.14 0.00 1.64 3.38 -1.40 -2.01 115.31 118.18 3hwo h LEU 244 Ca 0.37 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.34 3hwo h LEU 244 Cb 0.04 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.76 3hwo h LEU 244 CO -0.13 0.09 -0.00 0.58 0.09 0.00 0.00 178.44 179.07 3hwo h VAL 245 N 0.16 1.61 -0.07 1.22 2.07 -1.27 -3.19 116.25 116.78 3hwo h VAL 245 Ca 0.13 -1.88 -0.17 0.00 0.82 0.00 0.00 66.70 65.60 3hwo h VAL 245 Cb 0.30 2.88 -0.01 0.00 -1.52 0.00 0.00 31.29 32.94 3hwo h VAL 245 CO -0.02 0.48 -0.68 0.71 0.02 0.00 0.00 177.57 178.09 3hwo h THR 246 N -0.81 1.40 -0.65 2.57 1.35 -1.31 -2.73 112.91 112.73 3hwo h THR 246 Ca -0.00 -2.11 -0.05 0.00 -0.55 0.00 0.00 66.41 63.70 3hwo h THR 246 Cb 0.80 2.09 -0.03 0.00 -1.73 0.00 0.00 68.15 69.28 3hwo h THR 246 CO 0.00 0.63 0.22 -0.61 -0.25 0.00 0.00 175.52 175.51 3hwo h GLN 247 N 0.21 1.00 -0.14 4.72 5.75 -1.51 -1.32 115.11 123.83 3hwo h GLN 247 Ca -0.02 -0.20 -0.01 0.00 -0.15 0.00 0.00 58.65 58.26 3hwo h GLN 247 Cb 1.22 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 29.62 3hwo h GLN 247 CO 0.11 0.86 0.04 0.00 -2.65 0.00 0.00 178.83 177.19 3hwo h ALA 248 N 1.09 0.18 -0.96 3.38 0.00 -1.52 -2.86 119.26 118.57 3hwo h ALA 248 Ca 0.21 -0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3hwo h ALA 248 Cb 0.27 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 3hwo h ALA 248 CO -0.01 -0.19 0.64 0.52 0.00 0.00 0.00 179.25 180.21 3hwo h MET 249 N 0.03 1.27 -0.44 0.00 2.86 -1.37 -1.58 114.93 115.70 3hwo h MET 249 Ca 0.04 -0.08 0.03 0.00 -2.06 0.00 0.00 59.70 57.64 3hwo h MET 249 Cb 0.24 -0.28 -0.04 0.00 0.06 0.00 0.00 31.60 31.58 3hwo h MET 249 CO -0.00 0.84 0.22 0.87 1.06 0.00 0.00 176.91 179.90 3hwo h LYS 250 N 1.30 0.43 -0.92 1.72 1.57 -1.18 -1.65 116.57 117.85 3hwo h LYS 250 Ca 0.35 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 59.10 3hwo h LYS 250 Cb -0.15 -0.10 -0.04 0.00 0.08 0.00 0.00 32.23 32.02 3hwo h LYS 250 CO -0.08 0.28 0.56 1.49 -0.57 0.00 0.00 179.45 181.14 3hwo h GLU 251 N 0.44 1.24 -0.04 3.15 4.57 -1.17 -2.25 114.58 120.54 3hwo h GLU 251 Ca 0.19 -0.11 -0.14 0.00 -1.18 0.00 0.00 59.36 58.12 3hwo h GLU 251 Cb 0.09 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 28.40 3hwo h GLU 251 CO -0.13 0.87 -0.61 0.28 -1.18 0.00 0.00 179.01 178.24 3hwo h VAL 252 N 1.26 1.41 0.00 0.32 2.07 -0.97 -2.77 116.25 117.58 3hwo h VAL 252 Ca 0.33 -2.03 0.00 0.00 0.82 0.00 0.00 66.70 65.82 3hwo h VAL 252 Cb -0.06 2.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 3hwo h VAL 252 CO -0.06 0.59 -0.20 0.18 0.02 0.00 0.00 177.57 178.10 3hwo n LEU 253 N -3.85 0.20 0.20 2.57 4.32 -0.65 -4.55 117.00 115.24 3hwo n LEU 253 Ca -0.02 0.31 -0.16 0.00 -0.02 0.00 0.00 56.01 56.12 3hwo n LEU 253 Cb 0.61 -0.40 -0.09 0.00 -1.62 0.00 0.00 43.42 41.92 3hwo n LEU 253 CO 0.43 0.05 0.52 -0.09 -1.22 0.00 0.00 177.39 177.08 3hwo h ARG 254 N 0.00 -0.80 -1.02 3.23 2.43 -1.11 -2.26 114.38 114.85 3hwo h ARG 254 Ca 0.00 0.05 -0.48 0.00 -0.81 0.00 0.00 59.98 58.74 3hwo h ARG 254 Cb 0.50 0.18 -0.27 0.00 -0.42 0.00 0.00 29.97 29.96 3hwo h ARG 254 CO 0.00 -0.53 0.61 0.39 -1.51 0.00 0.00 179.97 178.93 3hwo n GLU 255 N -5.21 2.16 0.00 0.20 1.02 -1.26 -4.11 120.64 113.44 3hwo n GLU 255 Ca -0.10 -2.68 0.00 0.00 -0.02 0.00 0.00 57.16 54.36 3hwo n GLU 255 Cb 0.40 -2.05 0.00 0.00 -0.02 0.00 0.00 31.44 29.77 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 -0.89 0.28 -3.90 3.49 5.12 -0.88 -5.10 116.66 114.78 3hwo n ARG 256 Ca 0.53 -0.47 -0.08 0.00 -1.93 0.00 0.00 57.85 55.90 3hwo n ARG 256 Cb 1.37 -0.59 -0.02 0.00 -1.16 0.00 0.00 32.46 32.07 3hwo n ARG 256 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 3hwo s SER 257 N -0.11 -0.10 0.15 0.55 1.04 -1.02 -4.52 113.70 109.69 3hwo s SER 257 Ca 0.00 -0.84 -0.06 0.00 0.48 0.00 0.00 55.95 55.53 3hwo s SER 257 Cb 0.00 0.71 -0.02 0.00 0.10 0.00 0.00 66.02 66.81 3hwo s SER 257 CO 0.00 -1.35 0.21 -0.94 0.98 0.00 0.00 173.24 172.13 3hwo s SER 258 N -2.99 0.13 -1.49 7.02 1.04 -0.39 -4.90 113.70 112.13 3hwo s SER 258 Ca 0.16 -0.96 -0.13 0.00 0.48 0.00 0.00 55.95 55.51 3hwo s SER 258 Cb -0.04 0.38 0.09 0.00 0.10 0.00 0.00 66.02 66.55 3hwo s SER 258 CO 0.09 -0.83 0.80 -0.62 0.98 0.00 0.00 173.24 173.66 3hwo n GLU 259 N -0.16 -4.63 -2.67 4.02 1.02 -1.26 -0.68 120.64 116.27 3hwo n GLU 259 Ca -0.07 0.56 -0.43 0.00 -0.02 0.00 0.00 57.16 57.20 3hwo n GLU 259 Cb 0.63 -5.39 -0.02 0.00 -0.02 0.00 0.00 31.44 26.64 3hwo n GLU 259 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3hwo s LEU 260 N -7.03 4.02 -0.19 -4.62 1.98 -1.26 -4.44 118.68 107.14 3hwo s LEU 260 Ca 0.58 1.18 -0.03 0.00 -2.89 0.00 0.00 54.13 52.97 3hwo s LEU 260 Cb -0.30 -3.51 -0.02 0.00 0.66 0.00 0.00 46.19 43.03 3hwo s LEU 260 CO 0.72 -0.76 -0.05 -2.28 -1.89 0.00 0.00 176.35 172.09 3hwo s HIS 261 N 3.38 2.96 -0.04 5.38 5.65 0.15 -4.97 115.29 127.81 3hwo s HIS 261 Ca 0.44 -0.67 -0.01 0.00 0.25 0.00 0.00 55.06 55.07 3hwo s HIS 261 Cb -0.14 -2.03 0.03 0.00 -1.18 0.00 0.00 32.58 29.26 3hwo s HIS 261 CO 0.11 -0.33 0.08 0.54 -0.65 0.00 0.00 174.74 174.48 3hwo s VAL 262 N 1.00 -0.09 0.57 0.89 0.11 -1.26 -1.57 120.40 120.05 3hwo s VAL 262 Ca 0.00 0.27 -0.20 0.00 -2.93 0.00 0.00 61.98 59.13 3hwo s VAL 262 Cb -0.15 -0.15 -0.04 0.00 -1.53 0.00 0.00 36.38 34.51 3hwo s VAL 262 CO 0.01 0.11 1.23 -2.84 -3.33 0.00 0.00 175.10 170.27 3hwo s PRO 263 N 1.46 3.07 0.00 1.54 0.02 -1.26 -4.91 135.00 134.91 3hwo s PRO 263 Ca -0.05 1.89 0.26 0.00 0.02 0.00 0.00 61.00 63.12 3hwo s PRO 263 Cb -0.12 -2.02 0.69 0.00 0.02 0.00 0.00 34.50 33.07 3hwo s PRO 263 CO -0.04 -1.14 1.53 -1.13 -0.33 0.00 0.00 177.00 175.88 3hwo n SER 264 N -1.40 0.89 -4.16 2.53 3.41 -1.26 -4.78 113.62 108.85 3hwo n SER 264 Ca 0.13 -0.73 -0.24 0.00 -0.26 0.00 0.00 58.87 57.77 3hwo n SER 264 Cb 0.49 0.17 -0.15 0.00 -0.26 0.00 0.00 64.21 64.45 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 -2.63 1.94 0.75 4.04 0.01 -1.26 -5.13 113.70 111.42 3hwo s SER 265 Ca 0.21 -0.33 -0.11 0.00 1.31 0.00 0.00 55.95 57.02 3hwo s SER 265 Cb 0.19 -0.20 0.04 0.00 0.21 0.00 0.00 66.02 66.25 3hwo s SER 265 CO 0.57 0.18 1.09 -2.16 0.41 0.00 0.00 173.24 173.32 3hwo s PRO 266 N -0.54 2.53 0.21 12.44 0.04 -1.26 -4.97 135.00 143.44 3hwo s PRO 266 Ca 0.06 0.61 0.11 0.00 0.04 0.00 0.00 61.00 61.81 3hwo s PRO 266 Cb -0.07 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.46 3hwo s PRO 266 CO -0.00 -1.30 -0.16 1.14 0.04 0.00 0.00 177.00 176.72 3hwo s GLN 267 N -5.22 1.81 0.30 4.56 -2.07 -0.43 -4.90 119.66 113.70 3hwo s GLN 267 Ca 0.59 -1.48 -0.28 0.00 -1.82 0.00 0.00 55.36 52.37 3hwo s GLN 267 Cb -0.13 -1.96 -0.09 0.00 -1.09 0.00 0.00 33.01 29.73 3hwo s GLN 267 CO 0.53 0.39 1.09 -0.51 -1.32 0.00 0.00 175.29 175.48 3hwo s LEU 268 N -2.99 4.48 0.28 2.60 1.43 -1.26 -0.52 118.68 122.69 3hwo s LEU 268 Ca 0.25 2.23 0.02 0.00 -1.03 0.00 0.00 54.13 55.61 3hwo s LEU 268 Cb -0.07 -3.73 -0.06 0.00 0.03 0.00 0.00 46.19 42.36 3hwo s LEU 268 CO 0.14 -0.21 0.07 0.27 0.23 0.00 0.00 176.35 176.84 3hwo s ILE 269 N -1.25 0.85 0.06 -0.59 -5.25 -0.45 -4.89 121.20 109.68 3hwo s ILE 269 Ca 0.47 -2.00 0.03 0.00 -0.99 0.00 0.00 60.65 58.16 3hwo s ILE 269 Cb -0.30 -2.67 -0.03 0.00 2.95 0.00 0.00 42.46 42.41 3hwo s ILE 269 CO 0.39 -0.04 -0.10 0.42 -1.79 0.00 0.00 174.94 173.82 3hwo s THR 270 N -3.54 0.78 0.46 8.37 -4.23 -1.26 -1.73 115.64 114.49 3hwo s THR 270 Ca 0.36 -1.30 0.05 0.00 -1.18 0.00 0.00 61.69 59.62 3hwo s THR 270 Cb 0.08 -0.94 -0.04 0.00 1.34 0.00 0.00 72.50 72.94 3hwo s THR 270 CO 0.14 -0.40 0.08 0.42 -0.54 0.00 0.00 174.62 174.31 3hwo s THR 271 N -1.69 1.70 0.60 3.99 -4.23 -0.36 -5.00 115.64 110.66 3hwo s THR 271 Ca -0.04 -1.90 0.29 0.00 -1.18 0.00 0.00 61.69 58.87 3hwo s THR 271 Cb -0.08 -2.60 0.36 0.00 1.34 0.00 0.00 72.50 71.52 3hwo s THR 271 CO 0.01 0.00 1.94 -0.65 -0.54 0.00 0.00 174.62 175.37 3hwo h PRO 272 N 1.45 0.00 0.00 3.99 0.11 -2.01 -3.17 132.00 132.37 3hwo h PRO 272 Ca -0.43 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.57 3hwo h PRO 272 Cb 1.28 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.37 3hwo h PRO 272 CO 0.74 0.00 -1.66 0.25 -0.21 0.00 0.00 178.00 177.12 3hwo n THR 273 N -3.56 0.40 -4.03 -1.15 -2.24 -1.26 -4.84 114.28 97.60 3hwo n THR 273 Ca 0.05 -0.38 -0.12 0.00 -2.27 0.00 0.00 64.05 61.33 3hwo n THR 273 Cb 0.54 -0.26 -0.12 0.00 -2.10 0.00 0.00 70.33 68.40 3hwo n THR 273 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3hwo s LEU 274 N -4.35 2.21 0.13 3.22 1.43 -1.20 -1.35 118.68 118.77 3hwo s LEU 274 Ca -0.05 -0.45 -0.15 0.00 -1.03 0.00 0.00 54.13 52.44 3hwo s LEU 274 Cb 0.05 -0.08 -0.07 0.00 0.03 0.00 0.00 46.19 46.13 3hwo s LEU 274 CO 0.48 -0.20 0.55 0.26 0.23 0.00 0.00 176.35 177.68 3hwo s TRP 275 N -1.19 3.65 0.09 0.29 0.52 0.11 -1.22 118.94 121.19 3hwo s TRP 275 Ca -0.10 1.11 0.05 0.00 0.02 0.00 0.00 56.10 57.18 3hwo s TRP 275 Cb -0.09 -2.40 -0.03 0.00 -1.15 0.00 0.00 33.47 29.80 3hwo s TRP 275 CO -0.00 0.47 -0.12 -1.01 0.02 0.00 0.00 176.95 176.30 3hwo s HIS 276 N -1.38 1.18 -0.03 -1.98 3.76 -0.71 -1.73 115.29 114.41 3hwo s HIS 276 Ca 0.36 -0.56 -0.24 0.00 -0.15 0.00 0.00 55.06 54.46 3hwo s HIS 276 Cb -0.16 -0.64 -0.04 0.00 1.11 0.00 0.00 32.58 32.85 3hwo s HIS 276 CO 0.19 0.05 0.74 -0.51 -0.85 0.00 0.00 174.74 174.36 3hwo s LEU 277 N -2.18 4.36 0.03 0.89 1.43 -1.03 -1.34 118.68 120.83 3hwo s LEU 277 Ca 0.03 1.30 0.05 0.00 -1.03 0.00 0.00 54.13 54.48 3hwo s LEU 277 Cb -0.06 -3.16 -0.02 0.00 0.03 0.00 0.00 46.19 42.98 3hwo s LEU 277 CO 0.02 -0.09 -0.14 0.00 0.23 0.00 0.00 176.35 176.37 3hwo s ALA 278 N 0.55 1.13 -0.21 4.21 0.00 0.32 -2.54 121.76 125.22 3hwo s ALA 278 Ca 0.39 -0.76 -0.04 0.00 0.00 0.00 0.00 51.96 51.55 3hwo s ALA 278 Cb -0.19 -0.20 0.07 0.00 0.00 0.00 0.00 23.12 22.81 3hwo s ALA 278 CO 0.20 0.23 0.09 0.99 0.00 0.00 0.00 175.76 177.27 3hwo s THR 279 N -0.72 0.10 -0.03 0.00 2.01 -0.84 -1.32 115.64 114.84 3hwo s THR 279 Ca 0.02 -0.45 -0.30 0.00 0.31 0.00 0.00 61.69 61.27 3hwo s THR 279 Cb -0.07 -0.82 -0.03 0.00 0.01 0.00 0.00 72.50 71.58 3hwo s THR 279 CO 0.01 -0.39 1.13 -2.16 -0.69 0.00 0.00 174.62 172.52 3hwo s PRO 280 N 2.04 4.42 -0.13 4.92 0.04 -1.26 -3.55 135.00 141.48 3hwo s PRO 280 Ca 0.03 1.60 -0.06 0.00 0.04 0.00 0.00 61.00 62.60 3hwo s PRO 280 Cb -0.16 -3.49 -0.04 0.00 0.04 0.00 0.00 34.50 30.84 3hwo s PRO 280 CO -0.16 -0.31 0.11 -0.06 0.04 0.00 0.00 177.00 176.62 3hwo s PHE 281 N 1.73 3.48 -0.04 0.56 0.40 0.74 -4.24 117.98 120.61 3hwo s PHE 281 Ca 0.54 0.42 -0.01 0.00 -0.60 0.00 0.00 56.93 57.28 3hwo s PHE 281 Cb -0.24 -1.95 0.03 0.00 0.51 0.00 0.00 43.02 41.37 3hwo s PHE 281 CO 0.24 0.60 0.03 -1.21 0.70 0.00 0.00 175.22 175.58 3hwo s GLU 282 N -0.75 0.11 0.00 0.44 2.02 -0.61 -2.37 118.70 117.55 3hwo s GLU 282 Ca 0.13 0.24 0.00 0.00 0.02 0.00 0.00 54.97 55.36 3hwo s GLU 282 Cb -0.12 -0.52 0.00 0.00 0.10 0.00 0.00 34.13 33.59 3hwo s GLU 282 CO 0.03 -0.25 0.00 0.41 0.02 0.00 0.00 175.26 175.47 3hwo n GLY 283 N 4.81 4.38 3.10 -1.39 0.00 -0.98 0.33 105.19 115.44 3hwo n GLY 283 Ca -0.14 -1.57 -0.24 0.00 0.00 0.00 0.00 46.02 44.07 3hwo n GLY 283 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hwo s LYS 284 N -0.98 1.51 -0.15 1.61 1.02 0.14 -2.56 119.74 120.32 3hwo s LYS 284 Ca 0.00 -0.52 -0.08 0.00 0.02 0.00 0.00 55.97 55.39 3hwo s LYS 284 Cb 0.00 -1.34 -0.04 0.00 -0.52 0.00 0.00 37.83 35.92 3hwo s LYS 284 CO 0.00 0.22 0.14 0.00 -0.92 0.00 0.00 175.35 174.79 3hwo s ALA 285 N 0.04 3.80 0.63 5.17 0.00 0.18 -1.26 121.76 130.32 3hwo s ALA 285 Ca -0.03 -0.65 -0.17 0.00 0.00 0.00 0.00 51.96 51.11 3hwo s ALA 285 Cb -0.10 -2.06 -0.09 0.00 0.00 0.00 0.00 23.12 20.87 3hwo s ALA 285 CO 0.01 0.43 0.31 -1.71 0.00 0.00 0.00 175.76 174.80 3hwo n ASN 286 N 2.61 -1.96 0.00 0.00 4.05 -1.26 -4.83 115.26 113.87 3hwo n ASN 286 Ca -0.18 0.64 0.10 0.00 0.45 0.00 0.00 54.58 55.59 3hwo n ASN 286 Cb 0.54 -1.09 0.58 0.00 1.23 0.00 0.00 39.78 41.03 3hwo n ASN 286 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 177.26 173.97 3hwo n SER 287 N 0.85 0.00 -0.66 1.20 2.88 -1.26 -2.07 113.62 114.56 3hwo n SER 287 Ca 0.09 -0.45 0.06 0.00 -1.33 0.00 0.00 58.87 57.24 3hwo n SER 287 Cb 0.49 -0.08 0.16 0.00 -0.75 0.00 0.00 64.21 64.02 3hwo n SER 287 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hwo n GLN 288 N -1.08 1.83 -4.21 -1.46 6.02 -1.26 -4.90 117.38 112.32 3hwo n GLN 288 Ca 0.14 -1.28 -0.29 0.00 -0.01 0.00 0.00 57.00 55.56 3hwo n GLN 288 Cb 0.10 -1.28 -0.09 0.00 1.02 0.00 0.00 30.24 29.99 3hwo n GLN 288 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3hwo s GLU 289 N -1.53 2.27 0.37 -1.09 0.41 -0.88 -4.75 118.70 113.50 3hwo s GLU 289 Ca 0.24 -1.03 0.04 0.00 -0.41 0.00 0.00 54.97 53.80 3hwo s GLU 289 Cb 0.12 -2.35 -0.02 0.00 -1.78 0.00 0.00 34.13 30.11 3hwo s GLU 289 CO 0.16 0.49 0.15 0.27 -0.49 0.00 0.00 175.26 175.84 3hwo n ASN 290 N 0.41 0.99 0.17 -0.19 0.23 -1.26 -4.94 115.26 110.65 3hwo n ASN 290 Ca -0.12 -3.01 0.15 0.00 -0.53 0.00 0.00 54.58 51.07 3hwo n ASN 290 Cb 0.53 1.02 0.73 0.00 -2.08 0.00 0.00 39.78 39.99 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 1.67 2.06 0.00 -2.53 0.00 -1.79 -2.90 119.26 115.77 3hwo h ALA 291 Ca -0.28 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.32 3hwo h ALA 291 Cb 1.12 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.88 3hwo h ALA 291 CO 0.45 -0.29 -1.74 -0.11 0.00 0.00 0.00 179.25 177.56 3hwo n LEU 292 N -4.21 0.90 -0.21 0.00 7.94 -1.26 -2.04 117.00 118.12 3hwo n LEU 292 Ca 0.02 0.40 -0.08 0.00 -1.11 0.00 0.00 56.01 55.24 3hwo n LEU 292 Cb 0.32 0.14 0.03 0.00 0.53 0.00 0.00 43.42 44.44 3hwo n LEU 292 CO 0.32 0.40 0.94 0.71 -1.11 0.00 0.00 177.39 178.65 3hwo h THR 293 N 0.00 1.24 -0.11 1.96 1.35 -1.65 -1.11 112.91 114.58 3hwo h THR 293 Ca -0.30 -0.84 -0.19 0.00 -0.55 0.00 0.00 66.41 64.53 3hwo h THR 293 Cb 2.02 0.67 -0.00 0.00 -1.73 0.00 0.00 68.15 69.11 3hwo h THR 293 CO 0.08 0.32 -0.72 -0.07 -0.25 0.00 0.00 175.52 174.87 3hwo h LEU 294 N 0.84 0.63 -0.27 3.87 3.38 -1.62 -2.45 115.31 119.69 3hwo h LEU 294 Ca 0.19 -0.41 -0.05 0.00 0.09 0.00 0.00 57.88 57.70 3hwo h LEU 294 Cb 0.30 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 3hwo h LEU 294 CO -0.00 1.16 -0.02 0.00 0.09 0.00 0.00 178.44 179.67 3hwo h ALA 295 N 0.83 0.37 -0.32 1.53 0.00 -1.34 -2.14 119.26 118.19 3hwo h ALA 295 Ca -0.03 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 3hwo h ALA 295 Cb 1.31 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3hwo h ALA 295 CO 0.13 0.13 0.01 0.00 0.00 0.00 0.00 179.25 179.53 3hwo h LEU 297 N 0.47 0.79 0.05 0.00 5.85 -1.35 -3.30 115.31 117.82 3hwo h LEU 297 Ca 0.10 -0.34 -0.21 0.00 0.84 0.00 0.00 57.88 58.28 3hwo h LEU 297 Cb 0.29 -0.21 0.02 0.00 0.37 0.00 0.00 40.66 41.12 3hwo h LEU 297 CO 0.01 0.94 -0.85 -0.07 -0.34 0.00 0.00 178.44 178.12 3hwo h LEU 298 N 0.62 0.67 -9.60 2.25 3.38 -1.02 -3.47 115.31 108.15 3hwo h LEU 298 Ca 0.11 -0.80 -0.58 0.00 0.09 0.00 0.00 57.88 56.70 3hwo h LEU 298 Cb 0.56 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.05 3hwo h LEU 298 CO 0.03 1.39 -0.10 -2.28 0.09 0.00 0.00 178.44 177.57 3hwo s HIS 299 N -3.07 3.71 0.30 1.13 2.46 0.76 -3.03 115.29 117.55 3hwo s HIS 299 Ca -0.12 1.11 -0.19 0.00 0.47 0.00 0.00 55.06 56.34 3hwo s HIS 299 Cb 0.04 -2.46 -0.09 0.00 -0.13 0.00 0.00 32.58 29.94 3hwo s HIS 299 CO 0.87 0.50 0.78 -1.25 -2.47 0.00 0.00 174.74 173.16 3hwo s PRO 300 N -0.65 4.18 0.63 2.88 0.05 -1.26 -4.79 135.00 136.04 3hwo s PRO 300 Ca 0.27 0.87 -0.06 0.00 0.05 0.00 0.00 61.00 62.13 3hwo s PRO 300 Cb -0.18 -2.60 0.03 0.00 0.05 0.00 0.00 34.50 31.80 3hwo s PRO 300 CO 0.15 0.23 0.93 0.95 0.05 0.00 0.00 177.00 179.32 3hwo s THR 301 N -1.80 3.05 -1.97 1.26 -4.23 -1.17 -4.74 115.64 106.05 3hwo s THR 301 Ca 0.51 -0.16 0.04 0.00 -1.18 0.00 0.00 61.69 60.90 3hwo s THR 301 Cb -0.13 -3.24 0.12 0.00 1.34 0.00 0.00 72.50 70.58 3hwo s THR 301 CO 0.19 -0.25 0.75 -2.65 -0.54 0.00 0.00 174.62 172.12 3hwo n PRO 302 N -2.69 0.13 0.21 3.99 -0.02 -1.26 -0.67 135.00 134.70 3hwo n PRO 302 Ca 0.06 0.02 0.10 0.00 -2.02 0.00 0.00 63.50 61.65 3hwo n PRO 302 Cb 0.59 -1.50 0.25 0.00 -0.02 0.00 0.00 33.50 32.82 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 2.26 0.91 0.00 3.55 0.00 -1.89 -3.34 119.26 120.76 3hwo h ALA 303 Ca 0.00 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3hwo h ALA 303 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3hwo h ALA 303 CO 0.00 0.22 -1.20 1.28 0.00 0.00 0.00 179.25 179.56 3hwo n LEU 304 N -3.18 0.00 0.00 0.00 7.99 0.16 -4.77 117.00 117.19 3hwo n LEU 304 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 56.01 56.02 3hwo n LEU 304 Cb 0.54 0.07 0.00 0.00 -0.11 0.00 0.00 43.42 43.92 3hwo n LEU 304 CO 0.35 0.07 0.00 -1.54 -1.51 0.00 0.00 177.39 174.76 3hwo n SER 305 N -2.09 0.00 0.00 -1.43 3.41 -0.56 -4.67 113.62 108.27 3hwo n SER 305 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 3hwo n SER 305 Cb 0.58 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 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 2.72 -0.54 3.23 5.00 0.00 -1.25 -0.59 105.19 113.75 3hwo n GLY 306 Ca 0.00 -1.33 -0.12 0.00 0.00 0.00 0.00 46.02 44.58 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 -0.48 0.64 1.61 5.36 0.05 -3.65 117.98 118.62 3hwo s PHE 307 Ca 0.00 1.08 -0.18 0.00 -0.96 0.00 0.00 56.93 56.87 3hwo s PHE 307 Cb 0.00 0.18 -0.02 0.00 -0.34 0.00 0.00 43.02 42.84 3hwo s PHE 307 CO 0.00 -0.26 1.13 -2.30 -1.46 0.00 0.00 175.22 172.33 3hwo n PRO 308 N 3.72 0.95 -0.12 10.12 -0.02 -1.26 -0.03 135.00 148.35 3hwo n PRO 308 Ca -0.20 0.38 -0.06 0.00 -2.02 0.00 0.00 63.50 61.60 3hwo n PRO 308 Cb 0.56 -2.36 0.02 0.00 -0.02 0.00 0.00 33.50 31.70 3hwo n PRO 308 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3hwo h HIS 309 N 0.40 0.27 -0.07 6.00 -0.00 -1.94 -2.12 115.15 117.69 3hwo h HIS 309 Ca -0.50 0.02 -0.12 0.00 -0.00 0.00 0.00 60.37 59.77 3hwo h HIS 309 Cb 1.35 -0.06 0.01 0.00 -0.00 0.00 0.00 27.41 28.70 3hwo h HIS 309 CO 0.39 0.12 -0.44 0.37 -0.00 0.00 0.00 177.93 178.37 3hwo h GLN 310 N 0.32 0.41 -0.76 5.26 4.15 -1.98 -1.53 115.11 120.97 3hwo h GLN 310 Ca 0.17 -0.36 0.15 0.00 0.77 0.00 0.00 58.65 59.39 3hwo h GLN 310 Cb 0.14 0.08 -0.05 0.00 0.21 0.00 0.00 27.48 27.86 3hwo h GLN 310 CO -0.16 1.00 0.51 0.00 -1.93 0.00 0.00 178.83 178.25 3hwo h ALA 311 N 0.42 2.14 -0.03 3.38 0.00 -1.89 -2.51 119.26 120.77 3hwo h ALA 311 Ca -0.04 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 3hwo h ALA 311 Cb 1.10 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3hwo h ALA 311 CO 0.09 -0.35 -0.20 0.00 0.00 0.00 0.00 179.25 178.79 3hwo h ALA 312 N 1.64 0.06 0.00 0.00 0.00 -1.00 -2.68 119.26 117.28 3hwo h ALA 312 Ca 0.38 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3hwo h ALA 312 Cb 0.89 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 3hwo h ALA 312 CO -0.12 0.05 -0.01 1.79 0.00 0.00 0.00 179.25 180.95 3hwo h THR 313 N -0.43 0.74 0.00 0.00 1.35 -1.00 -0.09 112.91 113.49 3hwo h THR 313 Ca -0.02 -0.06 -0.00 0.00 -0.55 0.00 0.00 66.41 65.79 3hwo h THR 313 Cb 0.89 1.03 0.00 0.00 -1.73 0.00 0.00 68.15 68.35 3hwo h THR 313 CO 0.04 0.01 -0.00 1.56 -0.25 0.00 0.00 175.52 176.88 3hwo h GLN 314 N 0.00 -0.01 -0.84 4.72 4.20 -1.44 -1.72 115.11 120.02 3hwo h GLN 314 Ca -0.00 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.78 3hwo h GLN 314 Cb 0.03 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.76 3hwo h GLN 314 CO 0.00 0.50 0.55 0.28 -0.67 0.00 0.00 178.83 179.49 3hwo h VAL 315 N -0.52 1.03 -0.34 -0.54 2.07 -1.04 -2.32 116.25 114.60 3hwo h VAL 315 Ca -0.00 -0.31 -0.02 0.00 0.82 0.00 0.00 66.70 67.19 3hwo h VAL 315 Cb 0.51 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 3hwo h VAL 315 CO 0.00 0.17 0.14 0.40 0.02 0.00 0.00 177.57 178.30 3hwo h ILE 316 N 0.91 1.18 -0.60 4.57 2.04 -0.95 -1.44 117.51 123.21 3hwo h ILE 316 Ca 0.37 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.69 3hwo h ILE 316 Cb 0.26 0.90 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 3hwo h ILE 316 CO -0.14 0.19 0.38 0.00 0.00 0.00 0.00 178.15 178.59 3hwo h ALA 317 N 0.99 0.77 -0.62 1.87 0.00 -1.03 0.82 119.26 122.06 3hwo h ALA 317 Ca 0.11 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3hwo h ALA 317 Cb 0.16 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3hwo h ALA 317 CO -0.01 0.22 0.22 0.93 0.00 0.00 0.00 179.25 180.61 3hwo h GLU 318 N 0.81 0.92 0.01 0.00 5.08 -1.32 -3.36 114.58 116.72 3hwo h GLU 318 Ca 0.22 -0.16 -0.37 0.00 -1.00 0.00 0.00 59.36 58.04 3hwo h GLU 318 Cb -0.06 -0.15 -0.06 0.00 0.50 0.00 0.00 28.75 28.98 3hwo h GLU 318 CO -0.04 0.77 -2.35 1.28 -1.00 0.00 0.00 179.01 177.67 3hwo n LEU 319 N -4.30 1.76 -4.71 1.33 4.77 -0.55 -4.92 117.00 110.38 3hwo n LEU 319 Ca 0.05 -0.02 -0.41 0.00 -0.03 0.00 0.00 56.01 55.60 3hwo n LEU 319 Cb 0.19 -0.36 -0.04 0.00 -2.33 0.00 0.00 43.42 40.88 3hwo n LEU 319 CO 0.40 0.74 0.55 -1.61 -1.33 0.00 0.00 177.39 176.14 3hwo s GLU 320 N -2.52 4.50 -0.05 3.23 2.02 0.25 -4.94 118.70 121.18 3hwo s GLU 320 Ca -0.23 1.17 0.04 0.00 0.02 0.00 0.00 54.97 55.97 3hwo s GLU 320 Cb 0.08 -3.46 0.22 0.00 0.10 0.00 0.00 34.13 31.07 3hwo s GLU 320 CO 0.71 -0.01 0.91 -0.35 0.02 0.00 0.00 175.26 176.55 3hwo n PRO 321 N 3.89 1.95 -4.04 0.39 -0.04 -1.26 -4.85 135.00 131.04 3hwo n PRO 321 Ca 0.03 -0.84 -0.10 0.00 -0.04 0.00 0.00 63.50 62.54 3hwo n PRO 321 Cb 0.51 -1.59 -0.07 0.00 -0.04 0.00 0.00 33.50 32.31 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 -1.54 0.59 -0.20 0.54 -0.71 -1.26 -5.07 117.98 110.32 3hwo s PHE 322 Ca 0.15 -0.92 -0.11 0.00 -1.04 0.00 0.00 56.93 55.00 3hwo s PHE 322 Cb 0.11 -0.12 -0.05 0.00 -1.21 0.00 0.00 43.02 41.75 3hwo s PHE 322 CO 0.05 -0.78 0.20 0.34 -1.34 0.00 0.00 175.22 173.69 3hwo s ASP 323 N -3.03 6.25 0.24 1.98 2.15 -1.26 -4.99 116.67 118.00 3hwo s ASP 323 Ca 0.24 0.28 -0.04 0.00 0.43 0.00 0.00 52.55 53.46 3hwo s ASP 323 Cb 0.03 -2.13 0.25 0.00 -0.30 0.00 0.00 42.92 40.78 3hwo s ASP 323 CO 0.06 0.10 1.71 0.03 -0.17 0.00 0.00 175.17 176.91 3hwo h ARG 324 N 6.99 0.85 0.00 4.34 3.08 -1.99 -3.47 114.38 124.18 3hwo h ARG 324 Ca -0.40 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.40 3hwo h ARG 324 Cb 1.16 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.12 3hwo h ARG 324 CO 0.72 0.87 0.00 0.39 -1.07 0.00 0.00 179.97 180.89 3hwo n GLU 325 N -4.19 0.00 0.15 0.04 1.02 -1.26 -1.99 120.64 114.42 3hwo n GLU 325 Ca 0.02 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.28 3hwo n GLU 325 Cb 0.33 0.00 0.20 0.00 -0.02 0.00 0.00 31.44 31.95 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 -9.65 -4.62 3.38 -1.91 -0.79 115.31 101.72 3hwo h LEU 326 Ca 0.00 -0.03 -0.53 0.00 0.09 0.00 0.00 57.88 57.42 3hwo h LEU 326 Cb 0.00 0.00 0.04 0.00 0.09 0.00 0.00 40.66 40.79 3hwo h LEU 326 CO 0.00 0.01 0.75 -0.36 0.09 0.00 0.00 178.44 178.94 3hwo s PHE 327 N -3.21 3.13 0.00 1.13 2.99 -0.84 -1.88 117.98 119.30 3hwo s PHE 327 Ca 0.06 0.96 0.00 0.00 0.00 0.00 0.00 56.93 57.96 3hwo s PHE 327 Cb 0.09 -3.76 0.00 0.00 0.00 0.00 0.00 43.02 39.34 3hwo s PHE 327 CO 0.68 -2.59 0.00 0.41 -0.00 0.00 0.00 175.22 173.72 3hwo n GLY 328 N 2.89 0.86 0.00 4.36 0.00 -0.15 -4.21 105.19 108.93 3hwo n GLY 328 Ca 0.09 0.00 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 -2.27 0.60 3.35 -0.02 0.00 -0.79 -4.46 105.19 101.60 3hwo n GLY 329 Ca 0.00 -1.70 -0.24 0.00 0.00 0.00 0.00 46.02 44.08 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 0.77 1.98 0.03 -0.61 -4.36 -0.78 -0.57 121.20 117.67 3hwo s ILE 330 Ca 0.00 -1.88 0.03 0.00 -0.26 0.00 0.00 60.65 58.54 3hwo s ILE 330 Cb 0.00 -1.89 -0.02 0.00 1.25 0.00 0.00 42.46 41.81 3hwo s ILE 330 CO 0.00 -0.19 -0.10 0.54 0.24 0.00 0.00 174.94 175.44 3hwo s VAL 331 N -1.73 0.73 -4.47 8.37 0.11 -0.37 -0.45 120.40 122.59 3hwo s VAL 331 Ca 0.15 -0.86 0.00 0.00 -2.93 0.00 0.00 61.98 58.35 3hwo s VAL 331 Cb -0.07 -0.70 0.00 0.00 -1.53 0.00 0.00 36.38 34.07 3hwo s VAL 331 CO 0.07 -0.13 0.00 0.61 -3.33 0.00 0.00 175.10 172.33 3hwo n GLY 332 N 1.96 -0.52 3.37 6.54 0.00 -0.43 -0.83 105.19 115.28 3hwo n GLY 332 Ca -0.19 -0.73 -0.10 0.00 0.00 0.00 0.00 46.02 45.01 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 0.14 -0.16 1.61 1.48 -0.21 -2.01 118.94 115.79 3hwo s TRP 333 Ca 0.00 -0.50 -0.14 0.00 -1.06 0.00 0.00 56.10 54.40 3hwo s TRP 333 Cb 0.00 0.11 0.04 0.00 -1.16 0.00 0.00 33.47 32.46 3hwo s TRP 333 CO 0.00 -0.75 0.42 0.00 -4.06 0.00 0.00 176.95 172.56 3hwo n ASP 335 N 2.93 2.20 -0.02 0.00 5.68 -0.02 -0.13 116.55 127.18 3hwo n ASP 335 Ca -0.14 -1.96 0.12 0.00 -0.50 0.00 0.00 54.79 52.31 3hwo n ASP 335 Cb 0.57 0.06 0.20 0.00 -1.14 0.00 0.00 41.12 40.82 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 -1.58 0.63 -1.02 -1.12 3.41 -1.24 -3.52 113.62 109.18 3hwo n SER 336 Ca -0.05 -0.42 0.08 0.00 -0.26 0.00 0.00 58.87 58.22 3hwo n SER 336 Cb 0.30 0.35 0.26 0.00 -0.26 0.00 0.00 64.21 64.86 3hwo n SER 336 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 3hwo n GLU 337 N -1.42 3.21 -0.40 4.33 0.28 -1.26 -4.98 120.64 120.41 3hwo n GLU 337 Ca 0.06 -2.72 0.00 0.00 -0.16 0.00 0.00 57.16 54.33 3hwo n GLU 337 Cb 0.34 -1.78 0.00 0.00 1.43 0.00 0.00 31.44 31.43 3hwo n GLU 337 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3hwo n GLY 338 N -0.02 0.78 3.90 -1.84 0.00 -1.23 -4.97 105.19 101.81 3hwo n GLY 338 Ca 0.20 -0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.81 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 -2.19 5.44 0.00 1.61 -0.87 -1.26 -3.03 114.94 114.64 3hwo s ASN 339 Ca 0.00 -0.45 0.00 0.00 -1.57 0.00 0.00 52.86 50.84 3hwo s ASN 339 Cb 0.00 -0.95 0.00 0.00 -0.02 0.00 0.00 41.25 40.28 3hwo s ASN 339 CO 0.00 -0.44 0.00 0.61 -2.57 0.00 0.00 177.10 174.70 3hwo n GLY 340 N -1.50 1.45 3.03 0.66 0.00 -1.16 -0.84 105.19 106.84 3hwo n GLY 340 Ca 0.00 -1.05 -0.13 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.00 0.18 -0.06 1.61 2.12 -0.47 -1.37 118.70 118.71 3hwo s GLU 341 Ca 0.00 0.27 0.00 0.00 0.36 0.00 0.00 54.97 55.61 3hwo s GLU 341 Cb 0.00 0.04 0.02 0.00 0.26 0.00 0.00 34.13 34.45 3hwo s GLU 341 CO 0.00 -0.05 -0.03 -1.58 -0.54 0.00 0.00 175.26 173.06 3hwo s TRP 342 N 0.33 0.77 0.21 5.30 0.52 -0.44 -1.05 118.94 124.58 3hwo s TRP 342 Ca -0.02 -0.23 0.09 0.00 0.02 0.00 0.00 56.10 55.96 3hwo s TRP 342 Cb -0.03 -0.75 -0.05 0.00 -1.15 0.00 0.00 33.47 31.49 3hwo s TRP 342 CO -0.01 -0.26 -0.17 0.14 0.02 0.00 0.00 176.95 176.67 3hwo s VAL 343 N 1.35 1.91 0.29 4.03 -7.23 -0.01 -0.81 120.40 119.93 3hwo s VAL 343 Ca -0.04 -2.17 -0.29 0.00 -1.81 0.00 0.00 61.98 57.67 3hwo s VAL 343 Cb -0.13 -2.04 -0.10 0.00 0.56 0.00 0.00 36.38 34.67 3hwo s VAL 343 CO -0.02 -0.48 1.11 -0.69 -0.31 0.00 0.00 175.10 174.70 3hwo s VAL 344 N -2.63 3.46 -1.08 1.32 1.01 -0.21 -1.23 120.40 121.04 3hwo s VAL 344 Ca 0.22 1.44 -0.19 0.00 0.00 0.00 0.00 61.98 63.45 3hwo s VAL 344 Cb -0.03 -3.90 0.11 0.00 0.00 0.00 0.00 36.38 32.56 3hwo s VAL 344 CO 0.08 0.32 1.38 -0.89 0.00 0.00 0.00 175.10 175.99 3hwo s THR 345 N -1.20 4.48 0.30 3.92 2.01 0.27 -4.77 115.64 120.65 3hwo s THR 345 Ca 0.46 -1.66 0.03 0.00 0.31 0.00 0.00 61.69 60.83 3hwo s THR 345 Cb -0.32 -4.95 -0.02 0.00 0.01 0.00 0.00 72.50 67.22 3hwo s THR 345 CO 0.41 -1.73 0.30 0.27 -0.69 0.00 0.00 174.62 173.18 3hwo s ILE 346 N 3.30 0.00 -1.38 1.82 -4.36 -1.26 -0.98 121.20 118.34 3hwo s ILE 346 Ca 0.42 -1.88 -0.07 0.00 -0.26 0.00 0.00 60.65 58.86 3hwo s ILE 346 Cb -0.02 -2.52 0.00 0.00 1.25 0.00 0.00 42.46 41.18 3hwo s ILE 346 CO -0.05 0.00 0.39 0.54 0.24 0.00 0.00 174.94 176.07 3hwo n ARG 347 N -0.53 -2.08 -4.10 0.37 5.12 -1.26 -4.22 116.66 109.96 3hwo n ARG 347 Ca 0.05 0.29 -0.13 0.00 -1.93 0.00 0.00 57.85 56.13 3hwo n ARG 347 Cb 0.63 -4.00 -0.06 0.00 -1.16 0.00 0.00 32.46 27.86 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 -3.59 -0.93 -0.30 0.00 0.00 0.60 -3.27 121.76 114.27 3hwo s ALA 349 Ca 0.31 0.59 -0.04 0.00 0.00 0.00 0.00 51.96 52.82 3hwo s ALA 349 Cb 0.01 -0.07 0.04 0.00 0.00 0.00 0.00 23.12 23.10 3hwo s ALA 349 CO 0.16 -0.26 0.03 0.21 0.00 0.00 0.00 175.76 175.90 3hwo s LYS 350 N -1.01 2.63 -0.07 0.00 2.47 -0.06 -1.06 119.74 122.65 3hwo s LYS 350 Ca -0.11 -1.14 0.01 0.00 -1.56 0.00 0.00 55.97 53.18 3hwo s LYS 350 Cb -0.04 -3.25 -0.03 0.00 -1.46 0.00 0.00 37.83 33.05 3hwo s LYS 350 CO 0.04 -0.57 -0.10 -0.48 0.16 0.00 0.00 175.35 174.40 3hwo s LEU 351 N 1.34 3.00 -0.13 5.43 0.05 -0.06 -1.04 118.68 127.27 3hwo s LEU 351 Ca -0.02 -0.10 -0.04 0.00 0.05 0.00 0.00 54.13 54.02 3hwo s LEU 351 Cb -0.19 -1.64 0.06 0.00 -2.05 0.00 0.00 46.19 42.37 3hwo s LEU 351 CO -0.00 0.34 0.20 -0.60 -0.55 0.00 0.00 176.35 175.73 3hwo s ARG 352 N -0.66 0.10 7.98 1.48 3.52 -0.24 -0.53 118.95 130.60 3hwo s ARG 352 Ca 0.10 0.48 0.00 0.00 -0.13 0.00 0.00 55.73 56.18 3hwo s ARG 352 Cb -0.11 -0.53 0.00 0.00 -1.56 0.00 0.00 34.95 32.74 3hwo s ARG 352 CO 0.01 -0.41 0.00 0.39 -0.81 0.00 0.00 175.30 174.48 3hwo n GLU 353 N 5.33 0.00 -0.52 5.12 -0.58 -1.26 -1.69 120.64 127.04 3hwo n GLU 353 Ca -0.05 0.00 0.05 0.00 -0.42 0.00 0.00 57.16 56.74 3hwo n GLU 353 Cb 0.50 0.00 0.25 0.00 -0.57 0.00 0.00 31.44 31.61 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 8.69 3.76 -3.92 1.62 2.04 -1.26 0.53 115.26 126.73 3hwo n ASN 354 Ca 0.00 -2.50 -0.20 0.00 -0.44 0.00 0.00 54.58 51.44 3hwo n ASN 354 Cb 0.00 -0.57 -0.16 0.00 -2.53 0.00 0.00 39.78 36.52 3hwo n ASN 354 CO 0.00 0.00 0.00 -1.10 -0.44 0.00 0.00 177.26 175.72 3hwo s GLN 355 N -2.00 0.85 -0.03 -3.83 -1.52 -0.68 0.65 119.66 113.09 3hwo s GLN 355 Ca 0.34 -0.15 0.02 0.00 -1.95 0.00 0.00 55.36 53.61 3hwo s GLN 355 Cb 0.25 -0.83 0.01 0.00 -0.22 0.00 0.00 33.01 32.22 3hwo s GLN 355 CO 0.12 -0.03 -0.06 0.54 -0.25 0.00 0.00 175.29 175.61 3hwo s VAL 356 N 0.71 0.55 -0.18 1.09 0.11 0.15 -1.08 120.40 121.75 3hwo s VAL 356 Ca -0.10 -0.19 -0.01 0.00 -2.93 0.00 0.00 61.98 58.75 3hwo s VAL 356 Cb -0.13 -0.54 -0.00 0.00 -1.53 0.00 0.00 36.38 34.18 3hwo s VAL 356 CO 0.00 0.20 -0.12 -0.60 -3.33 0.00 0.00 175.10 171.26 3hwo s ARG 357 N 0.52 3.26 0.05 1.54 3.52 -0.21 -0.49 118.95 127.14 3hwo s ARG 357 Ca -0.07 -0.71 -0.00 0.00 -0.13 0.00 0.00 55.73 54.82 3hwo s ARG 357 Cb -0.11 -2.75 -0.04 0.00 -1.56 0.00 0.00 34.95 30.50 3hwo s ARG 357 CO 0.00 -0.07 0.19 -0.51 -0.81 0.00 0.00 175.30 174.10 3hwo s LEU 358 N 1.06 4.29 0.02 -0.88 1.43 -0.50 -0.88 118.68 123.21 3hwo s LEU 358 Ca -0.00 0.25 0.04 0.00 -1.03 0.00 0.00 54.13 53.39 3hwo s LEU 358 Cb -0.15 -2.83 -0.02 0.00 0.03 0.00 0.00 46.19 43.23 3hwo s LEU 358 CO -0.03 0.19 -0.13 0.12 0.23 0.00 0.00 176.35 176.73 3hwo s PHE 359 N -1.46 1.16 -0.11 0.29 5.36 -1.20 -2.22 117.98 119.79 3hwo s PHE 359 Ca 0.33 -0.30 -0.24 0.00 -0.96 0.00 0.00 56.93 55.76 3hwo s PHE 359 Cb -0.13 -0.71 0.06 0.00 -0.34 0.00 0.00 43.02 41.90 3hwo s PHE 359 CO 0.25 0.01 0.59 0.00 -1.46 0.00 0.00 175.22 174.61 3hwo s ALA 360 N -0.63 -1.50 0.29 11.12 0.00 -0.94 -4.39 121.76 125.72 3hwo s ALA 360 Ca 0.03 1.30 0.04 0.00 0.00 0.00 0.00 51.96 53.33 3hwo s ALA 360 Cb -0.07 -0.37 -0.06 0.00 0.00 0.00 0.00 23.12 22.62 3hwo s ALA 360 CO 0.00 -0.32 0.02 0.20 0.00 0.00 0.00 175.76 175.67 3hwo s GLY 361 N -0.63 1.89 -0.04 0.00 0.00 -1.26 -0.70 107.32 106.58 3hwo s GLY 361 Ca -0.07 -1.95 -0.07 0.00 0.00 0.00 0.00 44.72 42.62 3hwo s GLY 361 CO 0.05 -1.78 0.18 0.00 0.00 0.00 0.00 173.10 171.56 3hwo s ALA 362 N -3.28 -0.44 0.02 3.20 0.00 -0.01 -4.82 121.76 116.43 3hwo s ALA 362 Ca 0.33 0.28 -0.30 0.00 0.00 0.00 0.00 51.96 52.27 3hwo s ALA 362 Cb 0.07 -0.14 -0.05 0.00 0.00 0.00 0.00 23.12 23.01 3hwo s ALA 362 CO 0.13 -0.14 1.17 0.20 0.00 0.00 0.00 175.76 177.12 3hwo s GLY 363 N -0.53 2.39 -0.19 0.00 0.00 -1.26 -1.67 107.32 106.05 3hwo s GLY 363 Ca -0.06 0.74 -0.04 0.00 0.00 0.00 0.00 44.72 45.36 3hwo s GLY 363 CO 0.01 2.05 -0.03 -0.42 0.00 0.00 0.00 173.10 174.70 3hwo s ILE 364 N 1.39 3.66 0.38 0.90 -1.09 0.53 -4.98 121.20 121.99 3hwo s ILE 364 Ca 0.57 -0.42 0.04 0.00 -2.23 0.00 0.00 60.65 58.61 3hwo s ILE 364 Cb -0.27 -2.64 -0.05 0.00 -1.58 0.00 0.00 42.46 37.93 3hwo s ILE 364 CO 0.27 0.45 0.07 0.68 -1.23 0.00 0.00 174.94 175.18 3hwo s VAL 365 N 0.98 1.08 0.35 2.92 -7.23 -1.26 -2.36 120.40 114.89 3hwo s VAL 365 Ca 0.01 -2.00 0.12 0.00 -1.81 0.00 0.00 61.98 58.30 3hwo s VAL 365 Cb -0.15 -2.61 0.34 0.00 0.56 0.00 0.00 36.38 34.52 3hwo s VAL 365 CO 0.01 0.00 1.78 -0.65 -0.31 0.00 0.00 175.10 175.93 3hwo h PRO 366 N 1.91 0.55 -0.04 4.82 0.11 -1.84 -0.89 132.00 136.62 3hwo h PRO 366 Ca -0.40 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3hwo h PRO 366 Cb 1.26 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.25 3hwo h PRO 366 CO 0.67 0.37 0.00 0.00 -0.21 0.00 0.00 178.00 178.83 3hwo n ALA 367 N -2.40 2.60 -1.77 -0.75 0.00 -1.26 -4.87 120.51 112.07 3hwo n ALA 367 Ca 0.24 -0.33 -0.41 0.00 0.00 0.00 0.00 53.44 52.93 3hwo n ALA 367 Cb 0.71 -1.27 -0.01 0.00 0.00 0.00 0.00 19.45 18.88 3hwo n ALA 367 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hwo n SER 368 N -0.30 3.83 -4.68 0.00 7.64 -0.34 -5.00 113.62 114.78 3hwo n SER 368 Ca 0.19 1.20 -0.39 0.00 1.01 0.00 0.00 58.87 60.88 3hwo n SER 368 Cb 0.23 -1.61 -0.07 0.00 -1.01 0.00 0.00 64.21 61.75 3hwo n SER 368 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3hwo s SER 369 N 0.09 6.59 0.16 6.43 0.15 -1.26 -4.99 113.70 120.86 3hwo s SER 369 Ca 0.57 0.71 -0.16 0.00 0.70 0.00 0.00 55.95 57.77 3hwo s SER 369 Cb -0.48 -2.29 0.02 0.00 -1.71 0.00 0.00 66.02 61.56 3hwo s SER 369 CO 0.59 -0.12 1.82 -0.65 1.20 0.00 0.00 173.24 176.07 3hwo h PRO 370 N 7.23 0.54 -0.53 5.44 0.11 -1.93 -0.16 132.00 142.70 3hwo h PRO 370 Ca -0.36 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.73 3hwo h PRO 370 Cb 1.16 -0.12 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 3hwo h PRO 370 CO 0.74 0.36 0.34 1.25 -0.21 0.00 0.00 178.00 180.48 3hwo h LEU 371 N 0.56 0.56 -1.46 2.35 5.85 -1.95 -0.77 115.31 120.45 3hwo h LEU 371 Ca 0.15 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 3hwo h LEU 371 Cb -0.06 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 3hwo h LEU 371 CO -0.04 0.40 -0.00 1.23 -0.34 0.00 0.00 178.44 179.69 3hwo h GLY 372 N 0.68 0.37 1.38 3.75 0.00 -1.90 -1.08 103.07 106.27 3hwo h GLY 372 Ca 0.20 -0.19 -0.25 0.00 0.00 0.00 0.00 47.33 47.09 3hwo h GLY 372 CO -0.07 0.18 -1.04 0.83 0.00 0.00 0.00 176.54 176.44 3hwo h GLU 373 N 0.33 0.54 -0.45 4.80 4.39 -0.81 0.13 114.58 123.52 3hwo h GLU 373 Ca 0.08 -0.62 0.06 0.00 0.34 0.00 0.00 59.36 59.22 3hwo h GLU 373 Cb 0.23 0.18 -0.05 0.00 -0.10 0.00 0.00 28.75 29.01 3hwo h GLU 373 CO 0.01 1.23 0.14 2.35 -1.16 0.00 0.00 179.01 181.58 3hwo h TRP 374 N 0.29 0.24 -0.34 4.33 2.91 -0.81 -0.80 115.95 121.78 3hwo h TRP 374 Ca -0.12 0.02 -0.15 0.00 1.13 0.00 0.00 58.89 59.78 3hwo h TRP 374 Cb 1.69 -0.04 -0.01 0.00 -0.51 0.00 0.00 29.16 30.29 3hwo h TRP 374 CO 0.08 0.07 -0.39 0.00 -1.03 0.00 0.00 178.44 177.17 3hwo h ARG 375 N 0.30 0.81 -0.33 2.65 3.08 -1.11 -1.50 114.38 118.28 3hwo h ARG 375 Ca 0.22 -0.43 -0.02 0.00 0.07 0.00 0.00 59.98 59.82 3hwo h ARG 375 Cb 0.24 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 3hwo h ARG 375 CO -0.24 1.06 0.13 1.49 -1.07 0.00 0.00 179.97 181.34 3hwo h GLU 376 N 0.67 0.50 0.00 0.04 4.81 -0.61 -0.82 114.58 119.15 3hwo h GLU 376 Ca 0.05 -0.09 -0.06 0.00 -0.13 0.00 0.00 59.36 59.13 3hwo h GLU 376 Cb 0.96 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.25 3hwo h GLU 376 CO 0.09 0.49 -0.30 1.79 -0.73 0.00 0.00 179.01 180.35 3hwo h THR 377 N 0.39 1.01 -0.42 0.32 1.35 -1.12 -2.06 112.91 112.37 3hwo h THR 377 Ca 0.11 -1.11 0.01 0.00 -0.55 0.00 0.00 66.41 64.86 3hwo h THR 377 Cb 0.18 1.64 -0.02 0.00 -1.73 0.00 0.00 68.15 68.22 3hwo h THR 377 CO -0.01 0.30 0.28 1.23 -0.25 0.00 0.00 175.52 177.06 3hwo h GLY 378 N 1.22 0.60 1.62 5.82 0.00 -0.48 -0.99 103.07 110.87 3hwo h GLY 378 Ca -0.00 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.03 3hwo h GLY 378 CO 0.04 0.21 -0.17 -2.08 0.00 0.00 0.00 176.54 174.54 3hwo h VAL 379 N 0.57 1.24 -0.15 4.60 2.07 -0.86 -2.50 116.25 121.21 3hwo h VAL 379 Ca 0.16 -1.08 -0.01 0.00 0.82 0.00 0.00 66.70 66.59 3hwo h VAL 379 Cb -0.06 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3hwo h VAL 379 CO -0.04 0.35 0.05 0.11 0.02 0.00 0.00 177.57 178.06 3hwo h LYS 380 N 0.42 0.23 -0.28 1.57 1.57 -1.04 -2.72 116.57 116.31 3hwo h LYS 380 Ca 0.07 -0.05 0.08 0.00 -1.87 0.00 0.00 60.65 58.89 3hwo h LYS 380 Cb 0.54 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.80 3hwo h LYS 380 CO 0.03 0.34 0.24 -0.07 -0.57 0.00 0.00 179.45 179.42 3hwo h LEU 381 N 0.08 0.00 -1.34 2.94 3.38 -1.08 -3.04 115.31 116.26 3hwo h LEU 381 Ca 0.05 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.95 3hwo h LEU 381 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 3hwo h LEU 381 CO -0.00 0.00 -0.33 0.77 0.09 0.00 0.00 178.44 178.97 3hwo h SER 382 N 0.00 0.00 -0.73 -0.43 4.64 -1.11 -1.28 113.55 114.64 3hwo h SER 382 Ca 0.13 0.00 0.16 0.00 -0.47 0.00 0.00 61.79 61.61 3hwo h SER 382 Cb 0.61 0.00 -0.11 0.00 -0.31 0.00 0.00 62.40 62.59 3hwo h SER 382 CO -0.00 0.33 0.14 0.74 -0.87 0.00 0.00 176.83 177.17 3hwo h THR 383 N 0.00 0.48 0.00 2.95 2.02 -1.64 0.56 112.91 117.28 3hwo h THR 383 Ca -0.00 -0.08 -0.25 0.00 0.77 0.00 0.00 66.41 66.85 3hwo h THR 383 Cb 0.60 0.23 -0.04 0.00 -1.74 0.00 0.00 68.15 67.20 3hwo h THR 383 CO 0.04 0.04 -1.50 -0.03 0.37 0.00 0.00 175.52 174.45 3hwo h MET 384 N 0.23 0.00 -0.59 6.66 -1.53 -1.62 -3.09 114.93 114.99 3hwo h MET 384 Ca 0.41 0.00 -0.10 0.00 -3.44 0.00 0.00 59.70 56.57 3hwo h MET 384 Cb 0.71 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.74 3hwo h MET 384 CO -0.54 0.55 -0.03 -0.07 0.14 0.00 0.00 176.91 176.97 3hwo h LEU 385 N 0.00 1.05 -1.66 3.39 3.38 -0.89 -2.63 115.31 117.95 3hwo h LEU 385 Ca -0.21 -0.32 0.03 0.00 0.09 0.00 0.00 57.88 57.48 3hwo h LEU 385 Cb 1.89 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 42.33 3hwo h LEU 385 CO 0.08 1.11 0.28 0.78 0.09 0.00 0.00 178.44 180.79 3hwo h ASN 386 N 0.96 0.38 -0.24 -0.43 2.35 0.04 0.14 115.58 118.78 3hwo h ASN 386 Ca 0.16 -0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.84 3hwo h ASN 386 Cb 0.59 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.86 3hwo h ASN 386 CO 0.04 0.26 -0.07 0.58 -1.65 0.00 0.00 177.43 176.59 3hwo h VAL 387 N 0.44 1.23 -0.06 2.81 2.07 -1.38 -2.49 116.25 118.87 3hwo h VAL 387 Ca 0.17 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.71 3hwo h VAL 387 Cb 0.14 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 3hwo h VAL 387 CO -0.04 0.33 0.00 0.49 0.02 0.00 0.00 177.57 178.37 3hwo n PHE 388 N -4.22 0.06 -0.99 1.57 3.72 -0.75 -4.87 117.46 111.98 3hwo n PHE 388 Ca 0.01 -0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 3hwo n PHE 388 Cb 0.31 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.85 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 1.16 0.44 3.93 1.37 0.00 -0.52 -5.02 105.19 106.56 3hwo n GLY 389 Ca 0.18 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.95 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 0.00 3.40 0.00 0.99 1.43 0.39 -4.95 118.68 119.94 3hwo s LEU 390 Ca 0.00 0.53 0.11 0.00 -1.03 0.00 0.00 54.13 53.74 3hwo s LEU 390 Cb 0.00 -3.38 0.09 0.00 0.03 0.00 0.00 46.19 42.93 3hwo s LEU 390 CO 0.00 -0.92 0.86 1.41 0.23 0.00 0.00 176.35 177.93