#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cpu s SER 3 N 0.00 6.88 0.55 7.72 0.01 -1.26 -4.91 113.70 122.69 2cpu s SER 3 Ca 0.00 1.05 0.32 0.00 1.31 0.00 0.00 55.95 58.63 2cpu s SER 3 Cb 0.00 -2.35 1.59 0.00 0.21 0.00 0.00 66.02 65.47 2cpu s SER 3 CO 0.00 0.03 2.09 -0.65 0.41 0.00 0.00 173.24 175.12 2cpu h PRO 4 N 6.18 0.00 -0.47 12.44 0.11 -1.95 -3.36 132.00 144.94 2cpu h PRO 4 Ca -0.43 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.47 2cpu h PRO 4 Cb 1.19 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.22 2cpu h PRO 4 CO 0.72 0.07 -0.18 0.09 -0.21 0.00 0.00 178.00 178.49 2cpu n ASN 5 N -3.35 -4.26 -4.82 -2.05 3.02 -1.26 -4.73 115.26 97.80 2cpu n ASN 5 Ca -0.01 0.25 -0.31 0.00 -0.03 0.00 0.00 54.58 54.48 2cpu n ASN 5 Cb 0.24 -2.64 0.06 0.00 -0.61 0.00 0.00 39.78 36.83 2cpu n ASN 5 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2cpu s THR 6 N -2.35 3.66 0.44 3.41 -4.23 -1.26 -4.94 115.64 110.36 2cpu s THR 6 Ca 0.00 0.54 -0.24 0.00 -1.18 0.00 0.00 61.69 60.81 2cpu s THR 6 Cb 0.00 -3.32 -0.08 0.00 1.34 0.00 0.00 72.50 70.44 2cpu s THR 6 CO 0.00 -0.70 1.23 -1.58 -0.54 0.00 0.00 174.62 173.03 2cpu s GLN 7 N -5.12 3.83 -0.01 3.99 0.74 -1.26 -4.89 119.66 116.93 2cpu s GLN 7 Ca 0.59 1.97 -0.37 0.00 0.05 0.00 0.00 55.36 57.61 2cpu s GLN 7 Cb -0.14 -2.58 -0.15 0.00 1.10 0.00 0.00 33.01 31.25 2cpu s GLN 7 CO 0.54 -0.55 1.58 1.04 -0.55 0.00 0.00 175.29 177.35 2cpu n GLN 8 N -0.20 1.53 -0.05 1.67 1.13 -1.26 -1.28 117.38 118.92 2cpu n GLN 8 Ca 0.06 0.56 0.00 0.00 -1.94 0.00 0.00 57.00 55.67 2cpu n GLN 8 Cb 0.46 -2.27 0.00 0.00 0.11 0.00 0.00 30.24 28.54 2cpu n GLN 8 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2cpu n GLY 9 N 3.42 0.42 3.33 1.08 0.00 -1.26 -5.05 105.19 107.12 2cpu n GLY 9 Ca 0.21 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 2cpu n GLY 9 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cpu s ARG 10 N -0.91 3.42 0.00 1.61 0.52 -0.41 -4.69 118.95 118.49 2cpu s ARG 10 Ca 0.00 -0.61 0.06 0.00 -0.52 0.00 0.00 55.73 54.66 2cpu s ARG 10 Cb 0.00 -3.03 0.09 0.00 0.52 0.00 0.00 34.95 32.53 2cpu s ARG 10 CO 0.00 -0.17 0.86 0.25 0.02 0.00 0.00 175.30 176.25 2cpu n THR 11 N 4.74 0.38 -4.08 0.02 -2.24 -1.26 -4.66 114.28 107.18 2cpu n THR 11 Ca -0.18 -0.69 -0.08 0.00 -2.27 0.00 0.00 64.05 60.83 2cpu n THR 11 Cb 0.51 0.89 -0.10 0.00 -2.10 0.00 0.00 70.33 69.53 2cpu n THR 11 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2cpu s SER 12 N -0.69 0.54 0.27 3.42 0.01 -1.26 -4.10 113.70 111.89 2cpu s SER 12 Ca 0.09 -0.90 0.12 0.00 1.31 0.00 0.00 55.95 56.57 2cpu s SER 12 Cb 0.06 0.16 -0.05 0.00 0.21 0.00 0.00 66.02 66.40 2cpu s SER 12 CO 0.08 -0.52 -0.20 0.27 0.41 0.00 0.00 173.24 173.28 2cpu s ILE 13 N -3.35 2.46 -0.02 1.44 -4.36 -0.98 -0.57 121.20 115.81 2cpu s ILE 13 Ca 0.03 -2.37 0.06 0.00 -0.26 0.00 0.00 60.65 58.12 2cpu s ILE 13 Cb 0.04 -2.28 -0.01 0.00 1.25 0.00 0.00 42.46 41.46 2cpu s ILE 13 CO -0.07 -0.37 -0.21 0.54 0.24 0.00 0.00 174.94 175.07 2cpu s VAL 14 N -2.41 1.70 -0.60 8.37 0.11 -0.02 -0.86 120.40 126.67 2cpu s VAL 14 Ca 0.29 -0.91 -0.22 0.00 -2.93 0.00 0.00 61.98 58.21 2cpu s VAL 14 Cb -0.05 -1.42 0.06 0.00 -1.53 0.00 0.00 36.38 33.44 2cpu s VAL 14 CO 0.14 0.48 0.91 -2.28 -3.33 0.00 0.00 175.10 171.02 2cpu s HIS 15 N -0.40 2.77 -1.27 1.54 2.46 0.50 -0.40 115.29 120.49 2cpu s HIS 15 Ca 0.05 -0.40 -0.12 0.00 0.47 0.00 0.00 55.06 55.06 2cpu s HIS 15 Cb -0.09 -4.12 0.15 0.00 -0.13 0.00 0.00 32.58 28.39 2cpu s HIS 15 CO 0.00 -1.47 1.72 1.28 -2.47 0.00 0.00 174.74 173.80 2cpu n LEU 16 N 7.39 6.02 -4.61 8.88 4.77 -1.02 -1.99 117.00 136.45 2cpu n LEU 16 Ca -0.03 -4.50 -0.47 0.00 -0.03 0.00 0.00 56.01 50.98 2cpu n LEU 16 Cb 0.46 -1.56 -0.05 0.00 -2.33 0.00 0.00 43.42 39.94 2cpu n LEU 16 CO 0.63 1.04 1.66 0.33 -1.33 0.00 0.00 177.39 179.71 2cpu n PHE 17 N 4.95 2.10 -1.15 -1.77 7.35 -1.17 -2.29 117.46 125.47 2cpu n PHE 17 Ca 0.40 -0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 57.03 2cpu n PHE 17 Cb 0.39 -2.66 -0.02 0.00 0.35 0.00 0.00 39.48 37.54 2cpu n PHE 17 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2cpu n GLU 18 N 7.57 -1.02 -2.36 -4.13 -0.58 -1.26 -4.81 120.64 114.06 2cpu n GLU 18 Ca 0.28 0.57 -0.34 0.00 -0.42 0.00 0.00 57.16 57.25 2cpu n GLU 18 Cb 0.33 -4.50 -0.02 0.00 -0.57 0.00 0.00 31.44 26.68 2cpu n GLU 18 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 2cpu s TRP 19 N -1.87 2.94 0.55 -0.32 0.52 -0.97 -4.93 118.94 114.85 2cpu s TRP 19 Ca 0.00 1.55 -0.17 0.00 0.02 0.00 0.00 56.10 57.51 2cpu s TRP 19 Cb 0.00 -3.09 -0.06 0.00 -1.15 0.00 0.00 33.47 29.17 2cpu s TRP 19 CO 0.00 -1.04 1.02 1.03 0.02 0.00 0.00 176.95 177.99 2cpu s ARG 20 N -3.48 3.64 0.21 4.98 0.52 -1.26 -4.77 118.95 118.79 2cpu s ARG 20 Ca 0.67 1.12 -0.09 0.00 -0.52 0.00 0.00 55.73 56.91 2cpu s ARG 20 Cb -0.17 -2.08 0.15 0.00 0.52 0.00 0.00 34.95 33.37 2cpu s ARG 20 CO 0.26 -0.54 1.81 -1.49 0.02 0.00 0.00 175.30 175.36 2cpu h TRP 21 N 0.78 1.10 -0.21 -0.53 -0.00 -1.07 -2.20 115.95 113.83 2cpu h TRP 21 Ca -0.47 -0.05 -0.04 0.00 -0.00 0.00 0.00 58.89 58.33 2cpu h TRP 21 Cb 1.20 -0.35 -0.01 0.00 -0.00 0.00 0.00 29.16 30.01 2cpu h TRP 21 CO 0.60 0.80 -0.07 -0.24 -0.00 0.00 0.00 178.44 179.54 2cpu h VAL 22 N 1.09 1.17 -0.26 1.49 3.04 -1.83 -0.81 116.25 120.14 2cpu h VAL 22 Ca 0.27 -0.72 -0.17 0.00 -1.01 0.00 0.00 66.70 65.07 2cpu h VAL 22 Cb 0.10 1.09 -0.00 0.00 -2.01 0.00 0.00 31.29 30.46 2cpu h VAL 22 CO -0.04 0.23 -0.53 0.44 -1.01 0.00 0.00 177.57 176.67 2cpu h ASP 23 N 0.31 0.83 -0.31 3.17 3.32 -1.84 -2.54 116.42 119.37 2cpu h ASP 23 Ca 0.07 -0.44 -0.08 0.00 0.02 0.00 0.00 57.03 56.60 2cpu h ASP 23 Cb 0.32 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 2cpu h ASP 23 CO 0.01 1.20 -0.10 0.40 -1.72 0.00 0.00 179.24 179.03 2cpu h ILE 24 N 0.58 1.29 -0.50 0.35 2.04 -0.98 -1.29 117.51 118.99 2cpu h ILE 24 Ca 0.02 -1.17 0.06 0.00 1.00 0.00 0.00 64.86 64.77 2cpu h ILE 24 Cb 1.11 1.41 -0.05 0.00 -0.74 0.00 0.00 36.82 38.55 2cpu h ILE 24 CO 0.11 0.37 0.21 0.00 0.00 0.00 0.00 178.15 178.85 2cpu h ALA 25 N 0.78 0.63 -0.52 1.87 0.00 -1.13 0.15 119.26 121.05 2cpu h ALA 25 Ca 0.07 0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2cpu h ALA 25 Cb 0.60 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 2cpu h ALA 25 CO 0.04 -0.17 0.16 -0.07 0.00 0.00 0.00 179.25 179.21 2cpu h LEU 26 N 0.41 0.76 -1.32 0.00 3.38 -1.41 -2.71 115.31 114.42 2cpu h LEU 26 Ca 0.23 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.96 2cpu h LEU 26 Cb 0.21 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 2cpu h LEU 26 CO -0.21 0.76 0.07 -0.08 0.09 0.00 0.00 178.44 179.07 2cpu h GLU 27 N 0.71 0.53 -0.43 1.13 4.57 -0.42 0.13 114.58 120.81 2cpu h GLU 27 Ca 0.17 -0.09 -0.00 0.00 -1.18 0.00 0.00 59.36 58.25 2cpu h GLU 27 Cb 0.28 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.76 2cpu h GLU 27 CO -0.00 0.50 0.25 0.00 -1.18 0.00 0.00 179.01 178.58 2cpu h GLU 29 N 0.56 0.40 0.00 0.00 5.08 -1.23 -0.42 114.58 118.97 2cpu h GLU 29 Ca 0.15 -0.49 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 2cpu h GLU 29 Cb 0.01 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.42 2cpu h GLU 29 CO -0.03 1.16 -0.44 0.07 -1.00 0.00 0.00 179.01 178.78 2cpu h ARG 30 N -0.14 0.00 0.00 2.33 0.11 -0.77 -3.42 114.38 112.48 2cpu h ARG 30 Ca -0.10 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.98 2cpu h ARG 30 Cb 1.45 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.53 2cpu h ARG 30 CO 0.14 0.00 0.00 0.98 0.10 0.00 0.00 179.97 181.19 2cpu n TYR 31 N -2.71 -0.59 -0.03 4.08 9.36 -0.17 -4.83 117.16 122.27 2cpu n TYR 31 Ca 0.03 0.08 -0.09 0.00 3.32 0.00 0.00 57.90 61.23 2cpu n TYR 31 Cb 0.51 0.56 -0.03 0.00 -0.63 0.00 0.00 39.34 39.75 2cpu n TYR 31 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 2cpu h LEU 32 N 0.00 -0.11 0.39 2.98 3.38 -0.84 -0.41 115.31 120.71 2cpu h LEU 32 Ca 0.00 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2cpu h LEU 32 Cb 0.00 0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2cpu h LEU 32 CO 0.00 -0.03 -0.19 0.00 0.09 0.00 0.00 178.44 178.31 2cpu h ALA 33 N 1.15 -0.53 0.00 1.53 0.00 -1.29 -0.00 119.26 120.13 2cpu h ALA 33 Ca 0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2cpu h ALA 33 Cb 0.11 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 2cpu h ALA 33 CO -0.15 -0.67 -0.06 -1.00 0.00 0.00 0.00 179.25 177.36 2cpu h PRO 34 N -0.79 0.00 -0.03 0.00 0.13 -1.79 -1.74 132.00 127.79 2cpu h PRO 34 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2cpu h PRO 34 Cb 0.53 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.66 2cpu h PRO 34 CO 0.09 0.06 0.00 1.63 -0.23 0.00 0.00 178.00 179.55 2cpu n LYS 35 N -4.45 1.35 -1.47 0.86 4.01 -0.17 -4.93 118.16 113.37 2cpu n LYS 35 Ca -0.03 -0.52 -0.01 0.00 -0.51 0.00 0.00 58.31 57.24 2cpu n LYS 35 Cb 0.14 -1.44 -0.00 0.00 -0.51 0.00 0.00 35.03 33.22 2cpu n LYS 35 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2cpu n GLY 36 N 1.05 0.41 3.75 0.72 0.00 -0.65 -4.66 105.19 105.81 2cpu n GLY 36 Ca 0.19 -0.94 -0.40 0.00 0.00 0.00 0.00 46.02 44.87 2cpu n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2cpu s PHE 37 N -2.06 3.87 0.15 1.61 0.40 -0.07 -4.55 117.98 117.34 2cpu s PHE 37 Ca 0.00 1.85 -0.00 0.00 -0.60 0.00 0.00 56.93 58.18 2cpu s PHE 37 Cb 0.00 -3.07 -0.03 0.00 0.51 0.00 0.00 43.02 40.43 2cpu s PHE 37 CO 0.00 0.16 1.36 0.78 0.70 0.00 0.00 175.22 178.22 2cpu h GLY 38 N 4.13 0.32 -1.82 4.36 0.00 -1.12 -3.43 103.07 105.51 2cpu h GLY 38 Ca -0.45 -0.56 0.34 0.00 0.00 0.00 0.00 47.33 46.66 2cpu h GLY 38 CO 0.68 0.49 0.89 -0.32 0.00 0.00 0.00 176.54 178.28 2cpu s GLY 39 N -4.46 -0.10 -0.06 4.60 0.00 -1.14 -1.88 107.32 104.28 2cpu s GLY 39 Ca -0.04 -0.02 0.02 0.00 0.00 0.00 0.00 44.72 44.68 2cpu s GLY 39 CO 0.84 5.76 -0.10 0.14 0.00 0.00 0.00 173.10 179.74 2cpu s VAL 40 N -2.02 0.98 -0.21 1.40 1.01 0.16 -0.84 120.40 120.87 2cpu s VAL 40 Ca 0.30 -0.39 -0.19 0.00 0.00 0.00 0.00 61.98 61.70 2cpu s VAL 40 Cb -0.01 -0.91 -0.03 0.00 0.00 0.00 0.00 36.38 35.43 2cpu s VAL 40 CO -0.00 0.32 0.54 -1.58 0.00 0.00 0.00 175.10 174.37 2cpu s GLN 41 N 0.69 4.16 0.25 2.72 0.74 0.46 -0.35 119.66 128.33 2cpu s GLN 41 Ca -0.13 0.43 0.05 0.00 0.05 0.00 0.00 55.36 55.76 2cpu s GLN 41 Cb -0.15 -3.59 -0.03 0.00 1.10 0.00 0.00 33.01 30.34 2cpu s GLN 41 CO 0.03 -0.21 0.34 0.14 -0.55 0.00 0.00 175.29 175.04 2cpu s VAL 42 N 1.84 5.06 0.75 1.34 -7.23 -0.43 -2.43 120.40 119.30 2cpu s VAL 42 Ca 0.24 -1.05 -0.11 0.00 -1.81 0.00 0.00 61.98 59.25 2cpu s VAL 42 Cb -0.15 -3.76 0.05 0.00 0.56 0.00 0.00 36.38 33.07 2cpu s VAL 42 CO 0.09 -0.32 1.09 -0.44 -0.31 0.00 0.00 175.10 175.21 2cpu s SER 43 N -3.97 4.65 -0.20 4.85 0.01 -1.26 -3.17 113.70 114.60 2cpu s SER 43 Ca 0.35 1.82 -0.40 0.00 1.31 0.00 0.00 55.95 59.03 2cpu s SER 43 Cb -0.09 -2.52 -0.16 0.00 0.21 0.00 0.00 66.02 63.46 2cpu s SER 43 CO 0.29 -1.94 1.63 -2.65 0.41 0.00 0.00 173.24 170.97 2cpu n PRO 44 N -3.38 1.05 0.00 12.44 -0.02 -1.26 -4.59 135.00 139.24 2cpu n PRO 44 Ca 0.09 0.38 0.13 0.00 -2.02 0.00 0.00 63.50 62.09 2cpu n PRO 44 Cb 0.53 -2.04 0.49 0.00 -0.02 0.00 0.00 33.50 32.46 2cpu n PRO 44 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2cpu n PRO 45 N 4.53 0.69 -3.17 0.52 -0.04 -1.26 -4.92 135.00 131.35 2cpu n PRO 45 Ca 0.25 -0.33 -0.30 0.00 -0.04 0.00 0.00 63.50 63.08 2cpu n PRO 45 Cb 0.13 -1.49 -0.04 0.00 -0.04 0.00 0.00 33.50 32.06 2cpu n PRO 45 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2cpu s ASN 46 N -2.53 6.51 0.21 3.54 4.22 -1.26 -3.03 114.94 122.61 2cpu s ASN 46 Ca 0.25 0.92 -0.32 0.00 -2.14 0.00 0.00 52.86 51.58 2cpu s ASN 46 Cb 0.19 -2.23 -0.14 0.00 1.28 0.00 0.00 41.25 40.35 2cpu s ASN 46 CO 0.51 -0.25 1.31 1.21 -2.04 0.00 0.00 177.10 177.84 2cpu n GLU 47 N -0.92 1.70 -4.42 3.55 2.13 0.51 -4.77 120.64 118.42 2cpu n GLU 47 Ca 0.00 0.61 -0.21 0.00 0.66 0.00 0.00 57.16 58.22 2cpu n GLU 47 Cb 0.54 -2.20 -0.10 0.00 0.27 0.00 0.00 31.44 29.95 2cpu n GLU 47 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2cpu s ASN 48 N 0.18 2.08 0.15 4.31 4.22 -1.26 -1.75 114.94 122.87 2cpu s ASN 48 Ca 0.70 -1.49 -0.30 0.00 -2.14 0.00 0.00 52.86 49.63 2cpu s ASN 48 Cb -0.73 0.21 -0.08 0.00 1.28 0.00 0.00 41.25 41.93 2cpu s ASN 48 CO 0.51 -0.77 1.30 -0.69 -2.04 0.00 0.00 177.10 175.40 2cpu s VAL 49 N -3.43 3.44 -0.46 3.54 1.01 -0.69 -0.99 120.40 122.82 2cpu s VAL 49 Ca 0.33 1.11 -0.23 0.00 0.00 0.00 0.00 61.98 63.20 2cpu s VAL 49 Cb 0.06 -3.71 0.03 0.00 0.00 0.00 0.00 36.38 32.76 2cpu s VAL 49 CO 0.15 0.13 0.78 0.00 0.00 0.00 0.00 175.10 176.16 2cpu s ALA 50 N 0.55 3.29 -0.21 5.51 0.00 0.84 -4.71 121.76 127.03 2cpu s ALA 50 Ca 0.59 -1.07 -0.09 0.00 0.00 0.00 0.00 51.96 51.39 2cpu s ALA 50 Cb -0.35 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.25 2cpu s ALA 50 CO 0.34 -1.96 0.10 0.42 0.00 0.00 0.00 175.76 174.66 2cpu s ILE 51 N 3.29 4.96 -0.90 0.00 1.01 -1.26 -4.78 121.20 123.52 2cpu s ILE 51 Ca 0.29 0.04 0.14 0.00 0.00 0.00 0.00 60.65 61.11 2cpu s ILE 51 Cb -0.13 -3.28 -0.09 0.00 0.01 0.00 0.00 42.46 38.97 2cpu s ILE 51 CO 0.22 0.40 0.66 -1.22 0.00 0.00 0.00 174.94 174.99 2cpu n TYR 52 N 4.02 0.00 -3.62 3.97 4.01 -1.26 0.00 117.16 124.29 2cpu n TYR 52 Ca -0.16 0.00 -0.29 0.00 -0.16 0.00 0.00 57.90 57.29 2cpu n TYR 52 Cb 0.52 0.00 -0.14 0.00 -0.31 0.00 0.00 39.34 39.41 2cpu n TYR 52 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2cpu s ASN 53 N -2.06 3.56 1.10 7.72 2.47 -1.26 -2.91 114.94 123.56 2cpu s ASN 53 Ca 0.08 -1.98 -0.14 0.00 0.42 0.00 0.00 52.86 51.24 2cpu s ASN 53 Cb 0.11 -0.69 0.24 0.00 -1.45 0.00 0.00 41.25 39.45 2cpu s ASN 53 CO 0.48 -0.35 1.07 -2.16 -3.72 0.00 0.00 177.10 172.42 2cpu s PRO 54 N 1.23 -0.36 -0.50 0.43 0.04 -1.26 -5.06 135.00 129.51 2cpu s PRO 54 Ca 0.14 0.46 -0.28 0.00 0.04 0.00 0.00 61.00 61.36 2cpu s PRO 54 Cb -0.20 -1.65 0.00 0.00 0.04 0.00 0.00 34.50 32.69 2cpu s PRO 54 CO -0.13 -3.25 1.56 0.12 0.04 0.00 0.00 177.00 175.34 2cpu s PHE 55 N -2.82 2.11 -0.97 0.56 5.36 -1.14 -4.24 117.98 116.83 2cpu s PHE 55 Ca 0.67 0.59 -0.13 0.00 -0.96 0.00 0.00 56.93 57.10 2cpu s PHE 55 Cb -0.19 -4.28 0.01 0.00 -0.34 0.00 0.00 43.02 38.23 2cpu s PHE 55 CO 0.59 -2.22 0.65 0.54 -1.46 0.00 0.00 175.22 173.32 2cpu n ARG 56 N 8.59 -1.08 -1.86 10.12 5.12 0.10 -4.53 116.66 133.12 2cpu n ARG 56 Ca 0.17 0.56 -0.33 0.00 -1.93 0.00 0.00 57.85 56.31 2cpu n ARG 56 Cb 0.49 -2.73 0.03 0.00 -1.16 0.00 0.00 32.46 29.09 2cpu n ARG 56 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2cpu s PRO 57 N -5.72 3.00 0.44 5.56 0.04 -1.26 -3.48 135.00 133.59 2cpu s PRO 57 Ca 0.20 1.32 0.12 0.00 0.04 0.00 0.00 61.00 62.68 2cpu s PRO 57 Cb -0.10 -1.98 1.01 0.00 0.04 0.00 0.00 34.50 33.47 2cpu s PRO 57 CO 0.91 -1.08 2.04 0.11 0.04 0.00 0.00 177.00 179.01 2cpu h TRP 58 N 0.18 0.39 0.00 0.56 5.08 -1.60 -2.29 115.95 118.27 2cpu h TRP 58 Ca -0.47 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.51 2cpu h TRP 58 Cb 1.24 -0.13 0.00 0.00 -3.00 0.00 0.00 29.16 27.27 2cpu h TRP 58 CO 0.56 0.22 0.00 -2.67 -1.28 0.00 0.00 178.44 175.27 2cpu n TRP 59 N -4.48 0.00 0.30 0.12 4.27 -1.26 -2.70 117.44 113.70 2cpu n TRP 59 Ca 0.05 0.00 0.19 0.00 -3.89 0.00 0.00 57.50 53.85 2cpu n TRP 59 Cb 0.22 -0.26 0.87 0.00 -1.36 0.00 0.00 31.31 30.78 2cpu n TRP 59 CO 0.00 0.00 0.00 1.05 -2.29 0.00 0.00 177.69 176.45 2cpu h GLU 60 N 0.00 0.00 0.00 -2.67 4.11 -1.72 -2.40 114.58 111.90 2cpu h GLU 60 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2cpu h GLU 60 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 2cpu h GLU 60 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 179.01 179.62 2cpu n ARG 61 N -2.97 0.51 -0.63 1.06 1.74 -1.10 -2.41 116.66 112.86 2cpu n ARG 61 Ca -0.01 0.03 0.08 0.00 -0.77 0.00 0.00 57.85 57.18 2cpu n ARG 61 Cb 0.19 -1.50 0.33 0.00 -1.02 0.00 0.00 32.46 30.46 2cpu n ARG 61 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2cpu n TYR 62 N -1.20 1.44 -3.69 -1.55 4.01 -0.90 -4.66 117.16 110.60 2cpu n TYR 62 Ca 0.15 -0.75 -0.27 0.00 -0.16 0.00 0.00 57.90 56.86 2cpu n TYR 62 Cb 0.17 -0.36 -0.11 0.00 -0.31 0.00 0.00 39.34 38.74 2cpu n TYR 62 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2cpu n GLN 63 N 0.27 1.50 -1.71 -0.72 6.02 -1.01 -4.88 117.38 116.85 2cpu n GLN 63 Ca 0.24 -4.16 -0.38 0.00 -0.01 0.00 0.00 57.00 52.69 2cpu n GLN 63 Cb 0.98 -2.09 0.06 0.00 1.02 0.00 0.00 30.24 30.20 2cpu n GLN 63 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 2cpu n PRO 64 N 1.98 1.31 -0.00 -1.09 -0.02 -1.26 -1.70 135.00 134.21 2cpu n PRO 64 Ca 0.24 0.50 -0.00 0.00 -2.02 0.00 0.00 63.50 62.21 2cpu n PRO 64 Cb 0.40 -2.48 -0.00 0.00 -0.02 0.00 0.00 33.50 31.40 2cpu n PRO 64 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2cpu n VAL 65 N -1.51 0.01 -3.67 -1.45 0.31 -0.72 -2.37 118.33 108.93 2cpu n VAL 65 Ca 0.13 -0.01 -0.02 0.00 -0.01 0.00 0.00 64.34 64.43 2cpu n VAL 65 Cb 0.46 -0.44 0.01 0.00 -0.91 0.00 0.00 33.84 32.96 2cpu n VAL 65 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2cpu n SER 66 N -1.82 -1.05 -0.93 4.52 3.41 -1.22 -4.71 113.62 111.83 2cpu n SER 66 Ca -0.00 -1.58 0.08 0.00 -0.26 0.00 0.00 58.87 57.11 2cpu n SER 66 Cb 0.32 1.71 0.25 0.00 -0.26 0.00 0.00 64.21 66.22 2cpu n SER 66 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2cpu n TYR 67 N -0.40 0.92 -2.20 7.33 4.01 -1.26 -3.67 117.16 121.88 2cpu n TYR 67 Ca -0.02 -0.76 -0.41 0.00 -0.16 0.00 0.00 57.90 56.56 2cpu n TYR 67 Cb 0.34 -0.25 -0.03 0.00 -0.31 0.00 0.00 39.34 39.09 2cpu n TYR 67 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 2cpu s LYS 68 N -2.30 4.42 -1.39 -0.72 1.02 -1.26 -4.75 119.74 114.75 2cpu s LYS 68 Ca 0.39 2.11 -0.15 0.00 0.02 0.00 0.00 55.97 58.34 2cpu s LYS 68 Cb 0.29 -3.12 0.07 0.00 -0.52 0.00 0.00 37.83 34.54 2cpu s LYS 68 CO 0.12 -0.13 2.04 1.28 -0.92 0.00 0.00 175.35 177.73 2cpu n LEU 69 N 1.30 6.29 -3.44 3.17 4.32 -1.26 -0.36 117.00 127.02 2cpu n LEU 69 Ca 0.01 -4.15 -0.21 0.00 -0.02 0.00 0.00 56.01 51.65 2cpu n LEU 69 Cb 0.42 -1.66 -0.11 0.00 -1.62 0.00 0.00 43.42 40.45 2cpu n LEU 69 CO 0.58 0.88 -0.22 0.00 -1.22 0.00 0.00 177.39 177.40 2cpu n THR 71 N 5.20 0.00 0.38 0.00 -2.24 -0.69 -3.72 114.28 113.21 2cpu n THR 71 Ca -0.02 -1.41 0.10 0.00 -2.27 0.00 0.00 64.05 60.45 2cpu n THR 71 Cb 0.45 0.72 0.44 0.00 -2.10 0.00 0.00 70.33 69.83 2cpu n THR 71 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2cpu n ARG 72 N -0.38 0.13 0.20 -0.78 1.74 -1.26 -2.01 116.66 114.31 2cpu n ARG 72 Ca 0.04 0.41 0.11 0.00 -0.77 0.00 0.00 57.85 57.64 2cpu n ARG 72 Cb 0.36 -1.78 0.13 0.00 -1.02 0.00 0.00 32.46 30.16 2cpu n ARG 72 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 2cpu h SER 73 N 0.00 0.00 -2.88 0.55 0.02 -1.91 -3.43 113.55 105.90 2cpu h SER 73 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2cpu h SER 73 Cb 0.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2cpu h SER 73 CO 0.00 0.07 0.00 0.61 -1.14 0.00 0.00 176.83 176.37 2cpu n GLY 74 N 1.13 0.05 1.02 -3.77 0.00 -0.85 -0.39 105.19 102.37 2cpu n GLY 74 Ca 0.03 -1.76 -0.06 0.00 0.00 0.00 0.00 46.02 44.24 2cpu n GLY 74 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2cpu n ASN 75 N 3.00 0.81 -0.17 1.61 0.23 -1.26 -1.70 115.26 117.77 2cpu n ASN 75 Ca 0.00 -1.43 -0.06 0.00 -0.53 0.00 0.00 54.58 52.56 2cpu n ASN 75 Cb 0.00 -0.08 0.10 0.00 -2.08 0.00 0.00 39.78 37.72 2cpu n ASN 75 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 2cpu h GLU 76 N 0.00 0.94 -0.53 -3.83 4.81 -1.51 -0.97 114.58 113.50 2cpu h GLU 76 Ca -0.08 -0.26 -0.09 0.00 -0.13 0.00 0.00 59.36 58.80 2cpu h GLU 76 Cb 0.33 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 2cpu h GLU 76 CO 0.11 0.90 -0.04 -0.44 -0.73 0.00 0.00 179.01 178.82 2cpu h ASP 77 N 0.88 0.95 -0.31 1.04 3.32 -1.96 -1.14 116.42 119.20 2cpu h ASP 77 Ca 0.17 -0.32 -0.09 0.00 0.02 0.00 0.00 57.03 56.80 2cpu h ASP 77 Cb 0.46 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 2cpu h ASP 77 CO 0.02 1.05 -0.12 -0.33 -1.72 0.00 0.00 179.24 178.13 2cpu h GLU 78 N 0.83 0.74 -0.11 3.56 5.08 -1.90 -0.81 114.58 121.98 2cpu h GLU 78 Ca 0.15 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.25 2cpu h GLU 78 Cb 0.58 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 2cpu h GLU 78 CO 0.03 0.83 0.02 0.35 -1.00 0.00 0.00 179.01 179.24 2cpu h PHE 79 N 0.67 0.19 -0.65 4.33 3.57 -1.00 -1.36 116.94 122.70 2cpu h PHE 79 Ca 0.11 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.59 2cpu h PHE 79 Cb 0.59 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.25 2cpu h PHE 79 CO 0.03 0.38 0.43 0.00 -2.23 0.00 0.00 178.31 176.92 2cpu h ARG 80 N -0.05 0.85 -0.72 1.11 3.08 -1.10 -1.29 114.38 116.26 2cpu h ARG 80 Ca 0.03 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.06 2cpu h ARG 80 Cb 0.30 -0.19 -0.05 0.00 0.08 0.00 0.00 29.97 30.11 2cpu h ARG 80 CO 0.00 0.57 0.45 -0.97 -1.07 0.00 0.00 179.97 178.95 2cpu h ASN 81 N 0.88 0.74 -0.35 7.04 -0.73 -1.01 -0.70 115.58 121.44 2cpu h ASN 81 Ca 0.24 0.00 -0.02 0.00 1.87 0.00 0.00 56.30 58.39 2cpu h ASN 81 Cb -0.10 -0.16 -0.02 0.00 0.27 0.00 0.00 38.32 38.32 2cpu h ASN 81 CO -0.05 0.51 0.14 -0.03 -0.37 0.00 0.00 177.43 177.62 2cpu h MET 82 N 0.88 0.52 -0.74 6.67 4.05 -0.71 -1.07 114.93 124.52 2cpu h MET 82 Ca 0.29 -0.10 -0.05 0.00 -0.28 0.00 0.00 59.70 59.56 2cpu h MET 82 Cb 0.02 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 30.71 2cpu h MET 82 CO -0.11 0.51 0.25 0.28 0.23 0.00 0.00 176.91 178.07 2cpu h VAL 83 N 0.41 1.26 0.01 -5.77 2.07 -0.84 -1.11 116.25 112.28 2cpu h VAL 83 Ca 0.12 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.76 2cpu h VAL 83 Cb 0.19 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2cpu h VAL 83 CO -0.01 0.35 -0.00 0.74 0.02 0.00 0.00 177.57 178.66 2cpu h THR 84 N 1.09 1.18 -0.41 2.57 2.02 -0.99 -1.27 112.91 117.10 2cpu h THR 84 Ca 0.24 -0.57 -0.08 0.00 0.77 0.00 0.00 66.41 66.77 2cpu h THR 84 Cb 0.28 1.57 -0.02 0.00 -1.74 0.00 0.00 68.15 68.24 2cpu h THR 84 CO -0.01 0.15 -0.08 0.03 0.37 0.00 0.00 175.52 175.97 2cpu h ARG 85 N -0.26 0.71 -0.24 6.66 3.08 -1.13 -1.25 114.38 121.95 2cpu h ARG 85 Ca -0.00 -0.21 -0.13 0.00 0.07 0.00 0.00 59.98 59.71 2cpu h ARG 85 Cb 0.25 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.23 2cpu h ARG 85 CO 0.00 0.78 -0.35 0.00 -1.07 0.00 0.00 179.97 179.33 2cpu h ASN 87 N 0.37 0.95 0.15 0.00 2.35 -1.08 -0.37 115.58 117.94 2cpu h ASN 87 Ca 0.02 -0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 2cpu h ASN 87 Cb 0.94 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 39.07 2cpu h ASN 87 CO 0.08 0.82 0.00 0.59 -1.65 0.00 0.00 177.43 177.27 2cpu n ASN 88 N -4.42 0.00 -0.09 5.81 3.02 -0.48 -0.49 115.26 118.61 2cpu n ASN 88 Ca 0.06 0.23 0.01 0.00 -0.03 0.00 0.00 54.58 54.85 2cpu n ASN 88 Cb 0.13 -0.32 0.02 0.00 -0.61 0.00 0.00 39.78 39.01 2cpu n ASN 88 CO 0.00 0.00 0.00 0.55 -2.62 0.00 0.00 177.26 175.19 2cpu n VAL 89 N -1.32 0.63 -0.78 2.41 3.14 -0.84 -5.00 118.33 116.58 2cpu n VAL 89 Ca 0.03 -0.82 0.00 0.00 -2.96 0.00 0.00 64.34 60.59 2cpu n VAL 89 Cb 0.06 0.70 0.00 0.00 -1.06 0.00 0.00 33.84 33.54 2cpu n VAL 89 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2cpu n GLY 90 N -0.17 0.60 3.41 7.55 0.00 0.36 -4.82 105.19 112.12 2cpu n GLY 90 Ca 0.02 -0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.62 2cpu n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cpu s VAL 91 N -2.00 4.20 0.48 1.61 1.01 -0.21 -4.32 120.40 121.17 2cpu s VAL 91 Ca 0.00 -0.38 -0.14 0.00 0.00 0.00 0.00 61.98 61.46 2cpu s VAL 91 Cb 0.00 -3.05 -0.07 0.00 0.00 0.00 0.00 36.38 33.26 2cpu s VAL 91 CO 0.00 0.23 0.91 -0.13 0.00 0.00 0.00 175.10 176.11 2cpu s ARG 92 N 1.57 3.86 -0.14 2.72 1.81 -0.79 -3.12 118.95 124.87 2cpu s ARG 92 Ca 0.05 0.76 -0.00 0.00 -1.72 0.00 0.00 55.73 54.82 2cpu s ARG 92 Cb -0.16 -2.23 -0.01 0.00 -0.45 0.00 0.00 34.95 32.10 2cpu s ARG 92 CO 0.03 -0.20 -0.13 0.42 -0.68 0.00 0.00 175.30 174.74 2cpu s ILE 93 N -2.57 3.03 -0.16 1.52 -1.09 -1.26 0.36 121.20 121.03 2cpu s ILE 93 Ca 0.56 -0.66 0.01 0.00 -2.23 0.00 0.00 60.65 58.32 2cpu s ILE 93 Cb -0.10 -2.28 0.01 0.00 -1.58 0.00 0.00 42.46 38.50 2cpu s ILE 93 CO 0.33 0.51 -0.17 -0.31 -1.23 0.00 0.00 174.94 174.07 2cpu s TYR 94 N 0.51 2.77 -0.04 3.97 2.02 0.53 -1.40 117.35 125.71 2cpu s TYR 94 Ca -0.09 -1.25 -0.16 0.00 -0.37 0.00 0.00 57.07 55.19 2cpu s TYR 94 Cb -0.16 -1.90 -0.05 0.00 -0.40 0.00 0.00 41.96 39.45 2cpu s TYR 94 CO 0.04 -0.60 0.45 0.08 -1.57 0.00 0.00 175.55 173.95 2cpu s VAL 95 N 1.00 5.06 -0.58 0.71 1.01 -0.76 -1.32 120.40 125.52 2cpu s VAL 95 Ca -0.02 0.91 -0.28 0.00 0.00 0.00 0.00 61.98 62.59 2cpu s VAL 95 Cb -0.15 -3.77 0.02 0.00 0.00 0.00 0.00 36.38 32.49 2cpu s VAL 95 CO -0.04 0.48 1.31 -0.62 0.00 0.00 0.00 175.10 176.22 2cpu s ASP 96 N -0.41 6.28 -0.37 3.32 -1.08 -1.19 -0.85 116.67 122.38 2cpu s ASP 96 Ca 0.25 0.18 -0.16 0.00 -0.52 0.00 0.00 52.55 52.30 2cpu s ASP 96 Cb -0.16 -2.55 0.00 0.00 -1.46 0.00 0.00 42.92 38.75 2cpu s ASP 96 CO 0.13 -1.61 0.40 0.00 0.52 0.00 0.00 175.17 174.61 2cpu s ALA 97 N 5.53 3.47 -0.76 3.66 0.00 0.16 -4.18 121.76 129.63 2cpu s ALA 97 Ca 0.47 -1.31 -0.16 0.00 0.00 0.00 0.00 51.96 50.96 2cpu s ALA 97 Cb -0.09 -2.92 0.17 0.00 0.00 0.00 0.00 23.12 20.28 2cpu s ALA 97 CO 0.25 -1.27 0.78 0.08 0.00 0.00 0.00 175.76 175.60 2cpu s VAL 98 N 2.08 5.25 0.00 0.00 1.01 -1.26 -1.83 120.40 125.65 2cpu s VAL 98 Ca 0.12 -1.89 0.00 0.00 0.00 0.00 0.00 61.98 60.21 2cpu s VAL 98 Cb -0.17 -4.51 0.00 0.00 0.00 0.00 0.00 36.38 31.70 2cpu s VAL 98 CO 0.12 -1.11 0.31 2.30 0.00 0.00 0.00 175.10 176.73 2cpu n ILE 99 N 4.73 0.00 0.10 2.22 -5.35 -1.26 -4.65 119.36 115.15 2cpu n ILE 99 Ca 0.07 -0.45 -0.03 0.00 -0.27 0.00 0.00 62.75 62.07 2cpu n ILE 99 Cb 0.45 1.07 0.03 0.00 -1.74 0.00 0.00 39.64 39.45 2cpu n ILE 99 CO 0.00 0.00 0.00 -1.13 -1.76 0.00 0.00 176.55 173.66 2cpu h ASN 100 N 0.00 0.00 -5.20 7.28 -1.24 -1.88 -3.46 115.58 111.09 2cpu h ASN 100 Ca 0.00 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.93 2cpu h ASN 100 Cb 0.03 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 39.03 2cpu h ASN 100 CO 0.00 0.77 0.04 -1.38 -1.29 0.00 0.00 177.43 175.57 2cpu s HIS 101 N -3.11 0.38 0.00 0.67 -3.43 -1.26 -1.97 115.29 106.56 2cpu s HIS 101 Ca 0.00 -0.81 0.00 0.00 -0.80 0.00 0.00 55.06 53.45 2cpu s HIS 101 Cb 0.11 0.40 0.00 0.00 -1.43 0.00 0.00 32.58 31.66 2cpu s HIS 101 CO 0.78 -1.24 0.00 -1.33 -2.00 0.00 0.00 174.74 170.95 2cpu n MET 102 N -0.48 3.53 -2.15 -0.38 2.81 -0.16 -4.57 117.12 115.72 2cpu n MET 102 Ca -0.03 0.00 -0.25 0.00 -1.81 0.00 0.00 57.70 55.61 2cpu n MET 102 Cb 0.61 0.00 0.15 0.00 -0.71 0.00 0.00 33.22 33.27 2cpu n MET 102 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2cpu s GLY 104 N -5.37 2.56 0.58 0.00 0.00 -1.26 -1.49 107.32 102.34 2cpu s GLY 104 Ca 0.67 1.54 0.38 0.00 0.00 0.00 0.00 44.72 47.31 2cpu s GLY 104 CO 0.46 2.36 2.14 3.45 0.00 0.00 0.00 173.10 181.51 2cpu h ASN 105 N 3.93 0.00 0.14 1.64 -1.07 -1.34 -2.01 115.58 116.87 2cpu h ASN 105 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.88 2cpu h ASN 105 Cb 1.23 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.48 2cpu h ASN 105 CO 0.71 0.00 -0.39 0.00 0.07 0.00 0.00 177.43 177.83 2cpu n ALA 106 N -2.05 3.36 -1.74 4.14 0.00 -1.26 -4.16 120.51 118.80 2cpu n ALA 106 Ca -0.01 -0.51 -0.38 0.00 0.00 0.00 0.00 53.44 52.55 2cpu n ALA 106 Cb 0.17 -0.98 0.06 0.00 0.00 0.00 0.00 19.45 18.70 2cpu n ALA 106 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2cpu s VAL 107 N -2.53 2.01 0.16 0.00 1.01 -0.76 -4.95 120.40 115.34 2cpu s VAL 107 Ca 0.21 0.01 -0.30 0.00 0.00 0.00 0.00 61.98 61.90 2cpu s VAL 107 Cb 0.19 -3.00 -0.07 0.00 0.00 0.00 0.00 36.38 33.49 2cpu s VAL 107 CO 0.56 -0.00 0.99 -0.44 0.00 0.00 0.00 175.10 176.21 2cpu s SER 108 N -1.15 7.48 0.78 3.32 0.01 -1.26 -4.48 113.70 118.39 2cpu s SER 108 Ca 0.77 1.91 -0.13 0.00 1.31 0.00 0.00 55.95 59.82 2cpu s SER 108 Cb -0.40 -2.60 0.07 0.00 0.21 0.00 0.00 66.02 63.30 2cpu s SER 108 CO 0.44 -0.04 1.15 0.00 0.41 0.00 0.00 173.24 175.20 2cpu s ALA 109 N -0.39 2.03 0.00 1.44 0.00 -1.26 -4.84 121.76 118.74 2cpu s ALA 109 Ca 0.46 0.61 0.00 0.00 0.00 0.00 0.00 51.96 53.03 2cpu s ALA 109 Cb -0.26 -3.40 0.00 0.00 0.00 0.00 0.00 23.12 19.47 2cpu s ALA 109 CO 0.32 -1.99 0.00 0.41 0.00 0.00 0.00 175.76 174.49 2cpu n GLY 110 N -0.17 0.71 1.29 0.00 0.00 -0.25 -4.89 105.19 101.88 2cpu n GLY 110 Ca 0.11 -1.60 -0.03 0.00 0.00 0.00 0.00 46.02 44.51 2cpu n GLY 110 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cpu n THR 111 N 9.00 1.92 -1.54 2.61 -2.24 -1.26 -1.45 114.28 121.32 2cpu n THR 111 Ca 0.00 -3.18 -0.39 0.00 -2.27 0.00 0.00 64.05 58.20 2cpu n THR 111 Cb 0.00 -0.20 -0.02 0.00 -2.10 0.00 0.00 70.33 68.01 2cpu n THR 111 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 2cpu n SER 112 N -0.74 8.51 -4.60 3.42 2.88 -1.26 -4.45 113.62 117.37 2cpu n SER 112 Ca 0.23 -2.76 -0.26 0.00 -1.33 0.00 0.00 58.87 54.74 2cpu n SER 112 Cb 0.84 -1.49 -0.10 0.00 -0.75 0.00 0.00 64.21 62.70 2cpu n SER 112 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2cpu s SER 113 N 1.58 3.91 0.00 -3.46 1.04 -1.26 -0.11 113.70 115.40 2cpu s SER 113 Ca 0.64 -1.22 0.25 0.00 0.48 0.00 0.00 55.95 56.10 2cpu s SER 113 Cb 0.18 -0.41 1.29 0.00 0.10 0.00 0.00 66.02 67.19 2cpu s SER 113 CO -0.07 -0.33 1.83 0.35 0.98 0.00 0.00 173.24 176.00 2cpu n THR 114 N -0.92 0.18 -0.49 2.02 -2.24 -0.16 -3.15 114.28 109.52 2cpu n THR 114 Ca -0.05 0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2cpu n THR 114 Cb 0.65 -0.64 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 2cpu n THR 114 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2cpu n GLY 116 N -0.15 0.81 3.77 0.00 0.00 -1.19 -5.01 105.19 103.43 2cpu n GLY 116 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 2cpu n GLY 116 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cpu s SER 117 N -2.69 6.27 0.20 1.61 0.01 -1.26 -4.82 113.70 113.03 2cpu s SER 117 Ca 0.00 2.78 -0.17 0.00 1.31 0.00 0.00 55.95 59.87 2cpu s SER 117 Cb 0.00 -2.65 -0.08 0.00 0.21 0.00 0.00 66.02 63.50 2cpu s SER 117 CO 0.00 -0.89 0.66 -0.47 0.41 0.00 0.00 173.24 172.95 2cpu s TYR 118 N -1.21 3.62 0.06 2.43 5.04 -1.26 -4.44 117.35 121.58 2cpu s TYR 118 Ca 0.56 1.25 -0.19 0.00 -2.44 0.00 0.00 57.07 56.25 2cpu s TYR 118 Cb -0.41 -2.52 0.04 0.00 0.35 0.00 0.00 41.96 39.42 2cpu s TYR 118 CO 0.53 0.36 0.44 -0.59 -1.34 0.00 0.00 175.55 174.95 2cpu s PHE 119 N -1.53 -0.31 -0.37 4.97 -0.71 -0.53 -4.21 117.98 115.30 2cpu s PHE 119 Ca 0.42 0.26 0.01 0.00 -1.04 0.00 0.00 56.93 56.58 2cpu s PHE 119 Cb -0.16 0.26 0.15 0.00 -1.21 0.00 0.00 43.02 42.07 2cpu s PHE 119 CO 0.20 -0.61 0.27 1.21 -1.34 0.00 0.00 175.22 174.95 2cpu s ASN 120 N -2.09 2.29 0.24 1.98 3.84 0.17 -1.10 114.94 120.27 2cpu s ASN 120 Ca -0.04 -2.25 -0.06 0.00 0.21 0.00 0.00 52.86 50.72 2cpu s ASN 120 Cb -0.00 -0.20 0.42 0.00 -0.55 0.00 0.00 41.25 40.91 2cpu s ASN 120 CO -0.03 -0.27 1.71 -0.65 -2.79 0.00 0.00 177.10 175.07 2cpu h PRO 121 N 6.71 0.34 -0.93 0.43 0.11 -1.78 -0.12 132.00 136.76 2cpu h PRO 121 Ca 0.10 -0.02 0.12 0.00 0.11 0.00 0.00 66.00 66.31 2cpu h PRO 121 Cb 0.97 -0.08 -0.08 0.00 0.11 0.00 0.00 31.00 31.92 2cpu h PRO 121 CO 0.27 0.23 0.56 0.78 -0.21 0.00 0.00 178.00 179.63 2cpu h GLY 122 N 0.36 1.51 -2.69 -0.55 0.00 -1.80 -0.36 103.07 99.54 2cpu h GLY 122 Ca 0.39 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2cpu h GLY 122 CO -0.43 0.13 0.00 -1.14 0.00 0.00 0.00 176.54 175.10 2cpu n SER 123 N -4.69 3.96 -2.91 0.19 3.41 -1.00 -4.94 113.62 107.64 2cpu n SER 123 Ca 0.17 -2.09 -0.22 0.00 -0.26 0.00 0.00 58.87 56.47 2cpu n SER 123 Cb 0.34 -0.49 0.02 0.00 -0.26 0.00 0.00 64.21 63.82 2cpu n SER 123 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2cpu n ARG 124 N 1.47 -4.19 -3.82 4.33 3.00 -0.14 -4.32 116.66 112.99 2cpu n ARG 124 Ca 0.24 0.90 -0.36 0.00 -0.01 0.00 0.00 57.85 58.62 2cpu n ARG 124 Cb 0.65 -5.72 -0.13 0.00 0.00 0.00 0.00 32.46 27.26 2cpu n ARG 124 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2cpu s ASP 125 N -2.57 4.96 -0.52 0.55 -0.00 -0.15 -3.18 116.67 115.75 2cpu s ASP 125 Ca 0.25 -0.24 0.06 0.00 -0.00 0.00 0.00 52.55 52.62 2cpu s ASP 125 Cb -0.11 -1.88 0.21 0.00 -0.00 0.00 0.00 42.92 41.14 2cpu s ASP 125 CO 0.31 -0.02 0.52 0.49 -0.00 0.00 0.00 175.17 176.46 2cpu n PHE 126 N 4.81 1.16 0.07 4.23 3.01 -0.90 0.44 117.46 130.28 2cpu n PHE 126 Ca -0.17 -3.79 0.21 0.00 1.01 0.00 0.00 57.45 54.71 2cpu n PHE 126 Cb 0.51 -0.28 0.74 0.00 -0.01 0.00 0.00 39.48 40.44 2cpu n PHE 126 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2cpu h PRO 127 N 4.80 0.00 0.00 -1.08 0.13 -1.78 -1.56 132.00 132.51 2cpu h PRO 127 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2cpu h PRO 127 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2cpu h PRO 127 CO 0.58 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.35 2cpu n ALA 128 N -2.40 1.80 -0.06 -0.56 0.00 -1.26 -3.92 120.51 114.10 2cpu n ALA 128 Ca 0.08 0.05 -0.03 0.00 0.00 0.00 0.00 53.44 53.54 2cpu n ALA 128 Cb 0.62 -1.39 -0.01 0.00 0.00 0.00 0.00 19.45 18.67 2cpu n ALA 128 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2cpu h VAL 129 N 0.00 0.00 -2.62 0.00 2.07 -1.67 -3.44 116.25 110.60 2cpu h VAL 129 Ca 0.00 -0.93 -0.55 0.00 0.82 0.00 0.00 66.70 66.03 2cpu h VAL 129 Cb 0.43 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 2cpu h VAL 129 CO 0.00 0.00 -0.50 -2.16 0.02 0.00 0.00 177.57 174.93 2cpu s PRO 130 N -1.92 3.25 0.07 1.57 0.04 -1.25 -5.01 135.00 131.74 2cpu s PRO 130 Ca -0.09 -0.69 0.05 0.00 0.04 0.00 0.00 61.00 60.32 2cpu s PRO 130 Cb 0.01 -2.85 -0.03 0.00 0.04 0.00 0.00 34.50 31.67 2cpu s PRO 130 CO 0.13 0.51 -0.14 0.71 0.04 0.00 0.00 177.00 178.25 2cpu s TYR 131 N -1.74 1.23 0.04 0.56 2.02 -0.65 -4.99 117.35 113.82 2cpu s TYR 131 Ca 0.33 -0.46 0.01 0.00 -0.37 0.00 0.00 57.07 56.58 2cpu s TYR 131 Cb -0.11 -0.69 -0.00 0.00 -0.40 0.00 0.00 41.96 40.76 2cpu s TYR 131 CO 0.27 0.06 0.02 -1.13 -1.57 0.00 0.00 175.55 173.20 2cpu n SER 132 N 1.29 0.70 0.13 2.29 3.41 -1.25 -2.13 113.62 118.06 2cpu n SER 132 Ca -0.21 -1.24 0.14 0.00 -0.26 0.00 0.00 58.87 57.30 2cpu n SER 132 Cb 0.54 0.13 0.67 0.00 -0.26 0.00 0.00 64.21 65.29 2cpu n SER 132 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2cpu h GLY 133 N 0.19 0.00 2.00 5.00 0.00 -1.74 -1.06 103.07 107.46 2cpu h GLY 133 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.30 2cpu h GLY 133 CO 0.05 0.00 0.00 0.79 0.00 0.00 0.00 176.54 177.38 2cpu n TRP 134 N -4.45 0.55 0.20 5.60 7.02 -1.26 -3.14 117.44 121.96 2cpu n TRP 134 Ca 0.03 0.22 0.11 0.00 -1.02 0.00 0.00 57.50 56.84 2cpu n TRP 134 Cb 0.35 -0.85 0.27 0.00 -2.42 0.00 0.00 31.31 28.66 2cpu n TRP 134 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 2cpu n ASP 135 N -2.00 3.32 -4.57 -0.99 8.00 -0.40 -4.93 116.55 114.98 2cpu n ASP 135 Ca 0.03 -1.97 -0.24 0.00 0.71 0.00 0.00 54.79 53.31 2cpu n ASP 135 Cb 0.21 -0.33 -0.09 0.00 -0.02 0.00 0.00 41.12 40.89 2cpu n ASP 135 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2cpu s PHE 136 N -1.34 2.47 -0.97 1.24 0.08 -1.19 -0.52 117.98 117.77 2cpu s PHE 136 Ca 0.41 -0.36 0.06 0.00 0.12 0.00 0.00 56.93 57.16 2cpu s PHE 136 Cb 0.22 -1.23 0.31 0.00 -0.57 0.00 0.00 43.02 41.75 2cpu s PHE 136 CO 0.30 0.61 1.04 0.09 -0.10 0.00 0.00 175.22 177.16 2cpu n ASN 137 N -0.80 2.61 -0.24 1.36 3.02 0.84 -4.48 115.26 117.55 2cpu n ASN 137 Ca -0.05 -2.29 0.05 0.00 -0.03 0.00 0.00 54.58 52.25 2cpu n ASN 137 Cb 0.61 -0.50 0.16 0.00 -0.61 0.00 0.00 39.78 39.44 2cpu n ASN 137 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2cpu h ASP 138 N 1.60 -0.21 1.17 6.41 3.32 -1.86 0.92 116.42 127.76 2cpu h ASP 138 Ca 0.00 0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.22 2cpu h ASP 138 Cb 0.94 0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.78 2cpu h ASP 138 CO 0.16 -0.12 -0.08 0.61 -1.72 0.00 0.00 179.24 178.08 2cpu n GLY 139 N -1.39 -1.57 0.13 2.75 0.00 -1.26 -3.82 105.19 100.03 2cpu n GLY 139 Ca 0.13 -0.09 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 2cpu n GLY 139 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2cpu h LYS 140 N 0.00 0.27 -6.81 1.61 3.64 -1.21 -3.46 116.57 110.60 2cpu h LYS 140 Ca 0.00 -0.46 -0.53 0.00 -1.27 0.00 0.00 60.65 58.39 2cpu h LYS 140 Cb 0.62 0.17 0.07 0.00 -0.41 0.00 0.00 32.23 32.69 2cpu h LYS 140 CO 0.00 1.14 0.79 0.00 -2.27 0.00 0.00 179.45 179.11 2cpu n LYS 142 N 1.79 1.79 -2.09 0.00 4.01 -1.26 -4.98 118.16 117.42 2cpu n LYS 142 Ca 0.05 -1.67 -0.32 0.00 -0.51 0.00 0.00 58.31 55.87 2cpu n LYS 142 Cb 0.39 -1.26 -0.00 0.00 -0.51 0.00 0.00 35.03 33.65 2cpu n LYS 142 CO 0.00 0.00 0.00 0.95 -1.11 0.00 0.00 177.40 177.24 2cpu s THR 143 N -1.00 4.30 0.36 -0.18 -4.23 -1.26 -4.96 115.64 108.67 2cpu s THR 143 Ca 0.20 0.98 0.11 0.00 -1.18 0.00 0.00 61.69 61.79 2cpu s THR 143 Cb 0.12 -3.61 0.09 0.00 1.34 0.00 0.00 72.50 70.44 2cpu s THR 143 CO 0.16 -0.75 1.82 1.23 -0.54 0.00 0.00 174.62 176.54 2cpu h GLY 144 N 0.33 0.10 1.01 3.99 0.00 -1.95 -2.99 103.07 103.57 2cpu h GLY 144 Ca -0.46 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 46.79 2cpu h GLY 144 CO 0.60 0.08 -0.82 1.48 0.00 0.00 0.00 176.54 177.87 2cpu h SER 145 N 0.08 0.00 0.00 0.19 4.64 -2.00 -3.47 113.55 112.99 2cpu h SER 145 Ca 0.01 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 2cpu h SER 145 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 2cpu h SER 145 CO 0.05 0.08 0.00 0.61 -0.87 0.00 0.00 176.83 176.70 2cpu n GLY 146 N 1.29 1.45 3.89 -0.77 0.00 -1.13 -5.02 105.19 104.91 2cpu n GLY 146 Ca 0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.83 2cpu n GLY 146 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2cpu s ASP 147 N -3.17 5.01 -0.12 1.61 1.01 -1.26 -2.37 116.67 117.37 2cpu s ASP 147 Ca 0.00 -0.81 -0.29 0.00 0.71 0.00 0.00 52.55 52.15 2cpu s ASP 147 Cb 0.00 -0.38 -0.02 0.00 1.01 0.00 0.00 42.92 43.52 2cpu s ASP 147 CO 0.00 -0.76 1.27 -0.63 0.21 0.00 0.00 175.17 175.26 2cpu s ILE 148 N -2.52 4.21 -0.03 0.77 1.01 -0.52 -4.63 121.20 119.47 2cpu s ILE 148 Ca 0.47 1.49 0.06 0.00 0.00 0.00 0.00 60.65 62.67 2cpu s ILE 148 Cb -0.03 -3.96 -0.09 0.00 0.01 0.00 0.00 42.46 38.38 2cpu s ILE 148 CO 0.28 -0.09 0.09 -0.62 0.00 0.00 0.00 174.94 174.60 2cpu n GLU 149 N 6.22 1.42 -3.57 2.79 1.02 -1.26 -4.84 120.64 122.43 2cpu n GLU 149 Ca 0.13 -0.04 -0.17 0.00 -0.02 0.00 0.00 57.16 57.06 2cpu n GLU 149 Cb 0.45 -1.16 -0.14 0.00 -0.02 0.00 0.00 31.44 30.57 2cpu n GLU 149 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2cpu s ASN 150 N -3.22 1.08 0.00 1.62 3.04 -1.26 -5.01 114.94 111.19 2cpu s ASN 150 Ca -0.03 0.04 0.25 0.00 0.04 0.00 0.00 52.86 53.16 2cpu s ASN 150 Cb 0.03 0.39 1.46 0.00 -1.54 0.00 0.00 41.25 41.59 2cpu s ASN 150 CO 0.27 -0.29 1.84 -1.22 -3.04 0.00 0.00 177.10 174.66 2cpu n TYR 151 N 5.32 0.00 1.39 0.43 4.01 -1.26 -2.59 117.16 124.47 2cpu n TYR 151 Ca -0.05 0.00 0.14 0.00 -0.16 0.00 0.00 57.90 57.82 2cpu n TYR 151 Cb 0.50 -0.02 0.55 0.00 -0.31 0.00 0.00 39.34 40.06 2cpu n TYR 151 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2cpu n ASN 152 N -1.02 0.70 -4.12 7.72 5.03 -1.26 -4.46 115.26 117.85 2cpu n ASN 152 Ca 0.18 -0.76 -0.36 0.00 0.87 0.00 0.00 54.58 54.51 2cpu n ASN 152 Cb 0.09 -0.01 -0.11 0.00 -1.02 0.00 0.00 39.78 38.74 2cpu n ASN 152 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2cpu s ASP 153 N -2.42 5.27 0.64 6.41 2.15 -1.07 -4.82 116.67 122.84 2cpu s ASP 153 Ca 0.29 -2.21 0.38 0.00 0.43 0.00 0.00 52.55 51.44 2cpu s ASP 153 Cb 0.20 -1.84 2.12 0.00 -0.30 0.00 0.00 42.92 43.10 2cpu s ASP 153 CO 0.47 -0.51 2.27 0.00 -0.17 0.00 0.00 175.17 177.22 2cpu h ALA 154 N 7.84 1.25 -0.03 3.66 0.00 -1.85 -2.81 119.26 127.32 2cpu h ALA 154 Ca -0.11 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2cpu h ALA 154 Cb 1.03 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2cpu h ALA 154 CO 0.71 -0.07 -0.08 1.15 0.00 0.00 0.00 179.25 180.96 2cpu h THR 155 N 0.00 1.47 0.00 0.00 2.02 -1.94 -3.19 112.91 111.27 2cpu h THR 155 Ca 0.01 -1.50 -0.06 0.00 0.77 0.00 0.00 66.41 65.63 2cpu h THR 155 Cb 0.13 2.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.93 2cpu h THR 155 CO -0.00 0.40 -0.28 0.06 0.37 0.00 0.00 175.52 176.07 2cpu h GLN 156 N -0.47 0.00 0.00 6.66 3.07 -1.84 -1.12 115.11 121.41 2cpu h GLN 156 Ca -0.00 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 58.71 2cpu h GLN 156 Cb 0.70 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.25 2cpu h GLN 156 CO 0.02 0.28 -0.13 0.28 0.09 0.00 0.00 178.83 179.37 2cpu h VAL 157 N 0.00 0.95 0.01 1.86 2.07 -1.53 -1.32 116.25 118.29 2cpu h VAL 157 Ca -0.00 -0.47 -0.35 0.00 0.82 0.00 0.00 66.70 66.69 2cpu h VAL 157 Cb 0.75 1.26 -0.06 0.00 -1.52 0.00 0.00 31.29 31.72 2cpu h VAL 157 CO 0.04 0.13 -2.19 0.54 0.02 0.00 0.00 177.57 176.10 2cpu n ARG 158 N -4.17 0.68 -0.00 1.57 3.00 -0.89 -4.48 116.66 112.37 2cpu n ARG 158 Ca -0.02 0.13 0.09 0.00 -0.01 0.00 0.00 57.85 58.03 2cpu n ARG 158 Cb 0.21 -1.61 -0.11 0.00 0.00 0.00 0.00 32.46 30.95 2cpu n ARG 158 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2cpu n ASP 159 N -2.99 0.87 -4.95 0.55 8.00 -0.48 -4.69 116.55 112.86 2cpu n ASP 159 Ca -0.31 -0.88 -0.20 0.00 0.71 0.00 0.00 54.79 54.10 2cpu n ASP 159 Cb 1.09 1.07 0.01 0.00 -0.02 0.00 0.00 41.12 43.27 2cpu n ASP 159 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2cpu s ARG 161 N -4.34 4.35 -0.36 0.00 0.52 -1.00 -4.69 118.95 113.43 2cpu s ARG 161 Ca 0.51 1.41 -0.28 0.00 -0.52 0.00 0.00 55.73 56.85 2cpu s ARG 161 Cb -0.05 -3.59 -0.01 0.00 0.52 0.00 0.00 34.95 31.81 2cpu s ARG 161 CO 0.31 -0.47 1.69 -1.17 0.02 0.00 0.00 175.30 175.69 2cpu s LEU 162 N 2.56 3.52 -1.31 2.53 2.96 -1.25 -1.44 118.68 126.24 2cpu s LEU 162 Ca 0.47 1.14 -0.14 0.00 -0.22 0.00 0.00 54.13 55.38 2cpu s LEU 162 Cb -0.18 -3.48 0.02 0.00 0.50 0.00 0.00 46.19 43.05 2cpu s LEU 162 CO 0.13 -1.65 0.27 0.35 -1.32 0.00 0.00 176.35 174.13 2cpu n THR 163 N 7.31 -1.57 0.00 3.68 -2.24 -1.26 -1.23 114.28 118.97 2cpu n THR 163 Ca 0.21 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.49 2cpu n THR 163 Cb 0.47 -1.41 0.00 0.00 -2.10 0.00 0.00 70.33 67.29 2cpu n THR 163 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cpu n GLY 164 N -2.29 2.54 3.67 3.38 0.00 -1.24 -4.96 105.19 106.29 2cpu n GLY 164 Ca -0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 2cpu n GLY 164 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cpu s LEU 165 N 0.00 4.35 0.01 0.99 1.02 -0.37 -0.85 118.68 123.83 2cpu s LEU 165 Ca 0.00 2.35 -0.34 0.00 0.02 0.00 0.00 54.13 56.15 2cpu s LEU 165 Cb 0.00 -3.54 -0.13 0.00 0.02 0.00 0.00 46.19 42.54 2cpu s LEU 165 CO 0.00 -0.91 1.74 0.18 0.02 0.00 0.00 176.35 177.38 2cpu n LEU 166 N 6.62 3.24 -4.60 1.79 4.77 -0.55 -3.96 117.00 124.31 2cpu n LEU 166 Ca 0.17 1.02 -0.41 0.00 -0.03 0.00 0.00 56.01 56.77 2cpu n LEU 166 Cb 0.42 -1.38 -0.07 0.00 -2.33 0.00 0.00 43.42 40.05 2cpu n LEU 166 CO 0.63 -0.18 0.28 -0.62 -1.33 0.00 0.00 177.39 176.16 2cpu s ASP 167 N 2.70 6.42 0.30 -1.43 2.15 -1.26 -0.99 116.67 124.57 2cpu s ASP 167 Ca 0.87 0.37 -0.29 0.00 0.43 0.00 0.00 52.55 53.93 2cpu s ASP 167 Cb -0.70 -2.29 -0.10 0.00 -0.30 0.00 0.00 42.92 39.53 2cpu s ASP 167 CO 0.46 -0.38 1.22 -0.76 -0.17 0.00 0.00 175.17 175.54 2cpu s LEU 168 N 2.41 4.48 -1.26 -1.34 1.43 -0.83 -0.11 118.68 123.45 2cpu s LEU 168 Ca 0.22 2.50 -0.17 0.00 -1.03 0.00 0.00 54.13 55.64 2cpu s LEU 168 Cb -0.15 -3.64 0.10 0.00 0.03 0.00 0.00 46.19 42.53 2cpu s LEU 168 CO 0.11 -0.36 1.64 0.00 0.23 0.00 0.00 176.35 177.97 2cpu s ALA 169 N -1.10 3.50 -1.83 4.21 0.00 0.33 -4.62 121.76 122.24 2cpu s ALA 169 Ca 0.47 -3.03 0.10 0.00 0.00 0.00 0.00 51.96 49.51 2cpu s ALA 169 Cb -0.36 -4.50 0.58 0.00 0.00 0.00 0.00 23.12 18.84 2cpu s ALA 169 CO 0.47 -3.16 1.10 1.28 0.00 0.00 0.00 175.76 175.45 2cpu n LEU 170 N 7.63 0.00 0.10 0.00 4.77 -1.26 -1.97 117.00 126.27 2cpu n LEU 170 Ca 0.45 0.09 0.12 0.00 -0.03 0.00 0.00 56.01 56.64 2cpu n LEU 170 Cb 0.45 -0.09 0.18 0.00 -2.33 0.00 0.00 43.42 41.64 2cpu n LEU 170 CO 0.72 -0.06 0.44 1.05 -1.33 0.00 0.00 177.39 178.22 2cpu h GLU 171 N 0.00 0.00 -6.49 3.23 9.09 -1.95 -3.43 114.58 115.03 2cpu h GLU 171 Ca 0.00 0.00 -0.53 0.00 0.05 0.00 0.00 59.36 58.88 2cpu h GLU 171 Cb 0.03 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.11 2cpu h GLU 171 CO 0.00 0.00 0.41 0.15 0.05 0.00 0.00 179.01 179.62 2cpu s LYS 172 N -3.20 4.58 0.26 1.06 1.02 -0.83 -4.95 119.74 117.68 2cpu s LYS 172 Ca 0.06 1.53 -0.05 0.00 0.02 0.00 0.00 55.97 57.53 2cpu s LYS 172 Cb 0.11 -3.40 0.31 0.00 -0.52 0.00 0.00 37.83 34.34 2cpu s LYS 172 CO 0.71 -0.00 1.94 0.22 -0.92 0.00 0.00 175.35 177.29 2cpu h ASP 173 N 6.28 1.10 -0.26 2.83 3.58 -1.89 -1.33 116.42 126.74 2cpu h ASP 173 Ca -0.42 -0.03 0.05 0.00 0.42 0.00 0.00 57.03 57.05 2cpu h ASP 173 Cb 1.22 -0.28 -0.05 0.00 1.72 0.00 0.00 39.33 41.94 2cpu h ASP 173 CO 0.75 0.80 -0.05 0.22 -2.88 0.00 0.00 179.24 178.08 2cpu h TYR 174 N 1.30 -0.11 -0.56 0.28 3.20 -1.95 0.28 116.97 119.42 2cpu h TYR 174 Ca 0.35 0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.19 2cpu h TYR 174 Cb -0.15 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 2cpu h TYR 174 CO 0.00 -0.10 0.15 0.28 -1.64 0.00 0.00 178.16 176.86 2cpu h VAL 175 N 0.02 1.24 -0.77 1.81 2.07 -1.75 -1.13 116.25 117.75 2cpu h VAL 175 Ca 0.12 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.80 2cpu h VAL 175 Cb 0.18 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.64 2cpu h VAL 175 CO -0.25 0.32 0.50 0.03 0.02 0.00 0.00 177.57 178.18 2cpu h ARG 176 N 0.80 1.02 -0.26 1.57 3.08 -0.69 -2.23 114.38 117.67 2cpu h ARG 176 Ca 0.18 -0.07 -0.17 0.00 0.07 0.00 0.00 59.98 60.00 2cpu h ARG 176 Cb 0.32 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 2cpu h ARG 176 CO -0.00 0.69 -0.50 0.77 -1.07 0.00 0.00 179.97 179.86 2cpu h SER 177 N 1.05 0.80 -0.13 7.04 0.02 -0.10 -0.47 113.55 121.75 2cpu h SER 177 Ca 0.28 -0.41 -0.11 0.00 -0.84 0.00 0.00 61.79 60.71 2cpu h SER 177 Cb -0.10 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.20 2cpu h SER 177 CO -0.06 1.16 -0.29 0.11 -1.14 0.00 0.00 176.83 176.60 2cpu h LYS 178 N 0.57 0.61 -0.27 3.45 1.79 -0.78 0.64 116.57 122.57 2cpu h LYS 178 Ca 0.02 -0.26 -0.18 0.00 -2.18 0.00 0.00 60.65 58.06 2cpu h LYS 178 Cb 1.07 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.70 2cpu h LYS 178 CO 0.10 0.83 -0.52 0.82 -1.08 0.00 0.00 179.45 179.61 2cpu h ILE 179 N 0.52 1.28 -0.26 1.86 2.04 -1.36 -2.68 117.51 118.92 2cpu h ILE 179 Ca 0.07 -1.71 -0.09 0.00 1.00 0.00 0.00 64.86 64.12 2cpu h ILE 179 Cb 0.77 1.67 -0.01 0.00 -0.74 0.00 0.00 36.82 38.51 2cpu h ILE 179 CO 0.06 0.55 -0.22 0.00 0.00 0.00 0.00 178.15 178.55 2cpu h ALA 180 N 0.66 1.14 -0.85 1.87 0.00 -0.89 -1.02 119.26 120.17 2cpu h ALA 180 Ca 0.01 -0.33 0.01 0.00 0.00 0.00 0.00 54.91 54.60 2cpu h ALA 180 Cb 1.13 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 2cpu h ALA 180 CO 0.12 0.54 0.56 1.49 0.00 0.00 0.00 179.25 181.95 2cpu h GLU 181 N 0.44 1.12 -0.07 0.00 4.81 -0.79 0.30 114.58 120.40 2cpu h GLU 181 Ca 0.07 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 2cpu h GLU 181 Cb 0.62 -0.25 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 2cpu h GLU 181 CO 0.04 0.75 -0.01 -0.92 -0.73 0.00 0.00 179.01 178.15 2cpu h TYR 182 N 1.15 0.14 -0.36 0.92 3.20 -1.10 -1.99 116.97 118.92 2cpu h TYR 182 Ca 0.31 -0.03 -0.10 0.00 3.14 0.00 0.00 58.73 62.05 2cpu h TYR 182 Cb -0.12 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.10 2cpu h TYR 182 CO -0.01 0.42 -0.19 0.52 -1.64 0.00 0.00 178.16 177.26 2cpu h MET 183 N -0.18 0.69 -0.02 1.82 2.86 -0.92 -2.48 114.93 116.70 2cpu h MET 183 Ca 0.02 -0.25 -0.10 0.00 -2.06 0.00 0.00 59.70 57.31 2cpu h MET 183 Cb 0.37 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 2cpu h MET 183 CO 0.00 0.83 -0.44 -0.91 1.06 0.00 0.00 176.91 177.45 2cpu h ASN 184 N 0.61 0.04 -0.39 1.22 2.35 -0.39 -0.22 115.58 118.81 2cpu h ASN 184 Ca 0.09 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.83 2cpu h ASN 184 Cb 0.66 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 39.00 2cpu h ASN 184 CO 0.05 0.47 0.23 -0.74 -1.65 0.00 0.00 177.43 175.80 2cpu h HIS 185 N 0.03 0.51 -0.40 1.19 2.76 -0.95 -0.63 115.15 117.66 2cpu h HIS 185 Ca -0.00 -0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.06 2cpu h HIS 185 Cb 0.79 -0.17 -0.01 0.00 1.55 0.00 0.00 27.41 29.57 2cpu h HIS 185 CO 0.00 0.36 -0.16 -0.07 -1.30 0.00 0.00 177.93 176.77 2cpu h LEU 186 N 0.51 0.83 -0.19 0.26 3.38 -1.01 -2.30 115.31 116.79 2cpu h LEU 186 Ca 0.14 -0.39 0.01 0.00 0.09 0.00 0.00 57.88 57.73 2cpu h LEU 186 Cb 0.00 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 2cpu h LEU 186 CO -0.03 1.03 0.11 0.40 0.09 0.00 0.00 178.44 180.04 2cpu h ILE 187 N 0.62 1.01 0.00 1.22 2.04 -0.86 -1.80 117.51 119.75 2cpu h ILE 187 Ca 0.09 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.86 2cpu h ILE 187 Cb 0.70 0.77 -0.00 0.00 -0.74 0.00 0.00 36.82 37.55 2cpu h ILE 187 CO 0.05 0.04 -0.08 0.44 0.00 0.00 0.00 178.15 178.60 2cpu h ASP 188 N 0.22 0.00 0.60 1.72 3.32 -1.05 0.11 116.42 121.35 2cpu h ASP 188 Ca 0.08 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.00 2cpu h ASP 188 Cb 0.00 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 2cpu h ASP 188 CO -0.04 0.08 -0.59 0.40 -1.72 0.00 0.00 179.24 177.36 2cpu h ILE 189 N 0.00 1.42 0.00 0.35 2.04 -0.76 -3.47 117.51 117.10 2cpu h ILE 189 Ca -0.00 -2.04 0.00 0.00 1.00 0.00 0.00 64.86 63.81 2cpu h ILE 189 Cb 0.34 2.10 0.00 0.00 -0.74 0.00 0.00 36.82 38.52 2cpu h ILE 189 CO 0.01 0.58 0.00 0.61 0.00 0.00 0.00 178.15 179.35 2cpu n GLY 190 N 0.19 0.13 3.78 5.37 0.00 0.03 -4.75 105.19 109.94 2cpu n GLY 190 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 2cpu n GLY 190 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2cpu s VAL 191 N -0.98 3.33 -0.96 1.61 -7.23 -0.98 -4.77 120.40 110.42 2cpu s VAL 191 Ca 0.00 0.96 0.23 0.00 -1.81 0.00 0.00 61.98 61.36 2cpu s VAL 191 Cb 0.00 -3.47 -0.12 0.00 0.56 0.00 0.00 36.38 33.35 2cpu s VAL 191 CO 0.00 -0.05 1.12 0.00 -0.31 0.00 0.00 175.10 175.87 2cpu n ALA 192 N -0.53 4.12 0.00 1.32 0.00 -0.49 -4.65 120.51 120.28 2cpu n ALA 192 Ca 0.07 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.04 2cpu n ALA 192 Cb 0.49 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 19.01 2cpu n ALA 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cpu n GLY 193 N 1.49 -1.35 3.17 0.00 0.00 -1.24 -1.09 105.19 106.16 2cpu n GLY 193 Ca 0.04 -0.96 -0.12 0.00 0.00 0.00 0.00 46.02 44.98 2cpu n GLY 193 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2cpu s PHE 194 N -2.66 -0.05 -0.30 1.61 0.40 0.75 -1.82 117.98 115.91 2cpu s PHE 194 Ca 0.00 0.01 -0.11 0.00 -0.60 0.00 0.00 56.93 56.22 2cpu s PHE 194 Cb 0.00 0.01 -0.03 0.00 0.51 0.00 0.00 43.02 43.51 2cpu s PHE 194 CO 0.00 -0.35 0.20 0.50 0.70 0.00 0.00 175.22 176.27 2cpu s ARG 195 N -1.54 3.73 -0.58 0.44 3.52 -0.03 -1.52 118.95 122.98 2cpu s ARG 195 Ca -0.13 -0.47 -0.21 0.00 -0.13 0.00 0.00 55.73 54.79 2cpu s ARG 195 Cb -0.06 -3.70 0.07 0.00 -1.56 0.00 0.00 34.95 29.70 2cpu s ARG 195 CO 0.02 -0.29 0.81 -0.51 -0.81 0.00 0.00 175.30 174.52 2cpu s LEU 196 N 1.73 4.67 0.35 -0.88 1.43 -0.06 -0.67 118.68 125.27 2cpu s LEU 196 Ca 0.06 -0.90 -0.28 0.00 -1.03 0.00 0.00 54.13 51.98 2cpu s LEU 196 Cb -0.17 -2.50 -0.11 0.00 0.03 0.00 0.00 46.19 43.45 2cpu s LEU 196 CO 0.10 -1.17 1.45 -0.62 0.23 0.00 0.00 176.35 176.34 2cpu s ASP 197 N 3.19 6.46 -1.41 2.29 2.15 -0.76 -1.45 116.67 127.15 2cpu s ASP 197 Ca 0.20 2.94 -0.09 0.00 0.43 0.00 0.00 52.55 56.03 2cpu s ASP 197 Cb -0.18 -2.66 0.04 0.00 -0.30 0.00 0.00 42.92 39.82 2cpu s ASP 197 CO 0.12 -0.79 1.01 0.00 -0.17 0.00 0.00 175.17 175.35 2cpu n ALA 198 N 0.75 -1.48 0.22 3.66 0.00 -1.26 -4.55 120.51 117.85 2cpu n ALA 198 Ca 0.01 0.19 0.06 0.00 0.00 0.00 0.00 53.44 53.70 2cpu n ALA 198 Cb 0.40 -4.24 0.50 0.00 0.00 0.00 0.00 19.45 16.11 2cpu n ALA 198 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2cpu h SER 199 N -2.25 0.00 0.08 0.00 0.02 -1.19 -1.24 113.55 108.97 2cpu h SER 199 Ca -0.58 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.36 2cpu h SER 199 Cb 1.37 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.91 2cpu h SER 199 CO 0.60 0.23 -0.03 0.50 -1.14 0.00 0.00 176.83 176.98 2cpu h LYS 200 N 0.00 0.00 -0.40 3.45 3.64 -1.88 -1.39 116.57 119.99 2cpu h LYS 200 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2cpu h LYS 200 Cb 0.43 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.25 2cpu h LYS 200 CO 0.03 0.03 0.00 0.72 -2.27 0.00 0.00 179.45 177.96 2cpu n HIS 201 N -3.91 0.53 -4.38 1.91 8.25 -0.47 -4.65 115.22 112.51 2cpu n HIS 201 Ca -0.03 -0.26 -0.23 0.00 -0.26 0.00 0.00 57.72 56.94 2cpu n HIS 201 Cb 0.12 -0.00 -0.13 0.00 1.12 0.00 0.00 29.99 31.10 2cpu n HIS 201 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2cpu s MET 202 N -1.48 1.14 0.17 -0.41 -1.94 -0.53 -4.33 119.30 111.92 2cpu s MET 202 Ca 0.26 -1.03 -0.30 0.00 -1.71 0.00 0.00 55.69 52.91 2cpu s MET 202 Cb 0.14 -1.31 -0.08 0.00 2.01 0.00 0.00 34.83 35.59 2cpu s MET 202 CO 0.18 0.31 1.16 -1.58 -0.01 0.00 0.00 175.02 175.08 2cpu s TRP 203 N -1.04 3.48 0.33 -0.03 0.52 -1.26 -4.91 118.94 116.04 2cpu s TRP 203 Ca 0.05 1.47 0.11 0.00 0.02 0.00 0.00 56.10 57.75 2cpu s TRP 203 Cb -0.09 -3.38 0.91 0.00 -1.15 0.00 0.00 33.47 29.76 2cpu s TRP 203 CO 0.03 -1.00 1.75 -1.35 0.02 0.00 0.00 176.95 176.39 2cpu h PRO 204 N 5.40 0.55 -0.12 4.98 0.11 -1.89 -0.87 132.00 140.15 2cpu h PRO 204 Ca -0.44 -0.03 -0.11 0.00 0.11 0.00 0.00 66.00 65.53 2cpu h PRO 204 Cb 1.21 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2cpu h PRO 204 CO 0.75 0.36 -0.40 0.78 -0.21 0.00 0.00 178.00 179.29 2cpu h GLY 205 N 0.57 0.29 1.05 -0.55 0.00 -1.93 -1.00 103.07 101.50 2cpu h GLY 205 Ca 0.62 -0.27 -0.15 0.00 0.00 0.00 0.00 47.33 47.53 2cpu h GLY 205 CO -0.42 0.24 -0.41 -0.55 0.00 0.00 0.00 176.54 175.41 2cpu h ASP 206 N 0.22 0.87 -0.39 0.19 3.32 -1.51 -2.22 116.42 116.90 2cpu h ASP 206 Ca 0.02 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.57 2cpu h ASP 206 Cb 0.80 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 2cpu h ASP 206 CO 0.06 1.20 0.25 0.40 -1.72 0.00 0.00 179.24 179.44 2cpu h ILE 207 N 0.56 1.10 -0.60 0.35 2.04 -1.19 -2.52 117.51 117.23 2cpu h ILE 207 Ca 0.03 -0.18 0.02 0.00 1.00 0.00 0.00 64.86 65.74 2cpu h ILE 207 Cb 1.00 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 37.57 2cpu h ILE 207 CO 0.09 0.09 0.37 0.50 0.00 0.00 0.00 178.15 179.21 2cpu h LYS 208 N 0.52 0.71 -0.25 2.37 1.63 -1.12 -1.23 116.57 119.21 2cpu h LYS 208 Ca 0.14 -0.04 0.02 0.00 -0.85 0.00 0.00 60.65 59.92 2cpu h LYS 208 Cb -0.06 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.40 2cpu h LYS 208 CO -0.03 0.47 0.17 0.00 -3.45 0.00 0.00 179.45 176.60 2cpu h ALA 209 N 1.26 1.93 -0.02 5.00 0.00 -1.15 -0.71 119.26 125.57 2cpu h ALA 209 Ca 0.24 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 2cpu h ALA 209 Cb 0.01 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.73 2cpu h ALA 209 CO -0.09 0.04 -0.29 0.82 0.00 0.00 0.00 179.25 179.72 2cpu h ILE 210 N 0.24 1.50 -0.02 0.00 2.04 -0.90 -3.20 117.51 117.17 2cpu h ILE 210 Ca 0.10 -1.87 0.01 0.00 1.00 0.00 0.00 64.86 64.10 2cpu h ILE 210 Cb 0.10 2.61 -0.00 0.00 -0.74 0.00 0.00 36.82 38.79 2cpu h ILE 210 CO -0.02 0.52 0.02 -0.07 0.00 0.00 0.00 178.15 178.60 2cpu h LEU 211 N -0.37 0.00 -0.96 1.44 3.38 -0.72 0.44 115.31 118.52 2cpu h LEU 211 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 2cpu h LEU 211 Cb 1.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2cpu h LEU 211 CO 0.06 0.00 0.00 0.44 0.09 0.00 0.00 178.44 179.03 2cpu h ASP 212 N 0.00 0.00 0.02 -0.43 3.32 -1.14 -2.29 116.42 115.90 2cpu h ASP 212 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2cpu h ASP 212 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 2cpu h ASP 212 CO -0.00 0.00 -0.17 0.29 -1.72 0.00 0.00 179.24 177.64 2cpu n LYS 213 N -2.46 1.63 -2.96 3.56 5.02 0.14 -4.98 118.16 118.10 2cpu n LYS 213 Ca 0.02 -1.21 -0.36 0.00 -2.02 0.00 0.00 58.31 54.73 2cpu n LYS 213 Cb 0.24 -1.47 -0.06 0.00 -0.02 0.00 0.00 35.03 33.71 2cpu n LYS 213 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2cpu s LEU 214 N -2.21 4.32 0.76 -0.35 1.02 -0.86 -4.97 118.68 116.38 2cpu s LEU 214 Ca 0.27 1.59 -0.11 0.00 0.02 0.00 0.00 54.13 55.90 2cpu s LEU 214 Cb 0.20 -3.81 0.05 0.00 0.02 0.00 0.00 46.19 42.64 2cpu s LEU 214 CO 0.42 -0.03 1.09 -1.00 0.02 0.00 0.00 176.35 176.84 2cpu s HIS 215 N -1.60 2.98 0.78 0.29 3.76 -1.26 -5.06 115.29 115.19 2cpu s HIS 215 Ca 0.47 1.18 -0.11 0.00 -0.15 0.00 0.00 55.06 56.45 2cpu s HIS 215 Cb -0.17 -3.06 0.06 0.00 1.11 0.00 0.00 32.58 30.52 2cpu s HIS 215 CO 0.22 -1.55 1.10 -0.80 -0.85 0.00 0.00 174.74 172.85 2cpu s ASN 216 N -3.97 4.62 0.76 1.40 0.02 -1.26 -4.58 114.94 111.93 2cpu s ASN 216 Ca 0.60 1.29 -0.14 0.00 -1.02 0.00 0.00 52.86 53.59 2cpu s ASN 216 Cb -0.14 -2.03 0.06 0.00 0.02 0.00 0.00 41.25 39.16 2cpu s ASN 216 CO 0.54 -1.88 1.17 -0.76 0.02 0.00 0.00 177.10 176.18 2cpu s LEU 217 N -5.72 3.21 -0.13 0.60 1.43 0.27 -4.85 118.68 113.48 2cpu s LEU 217 Ca 0.60 2.22 -0.35 0.00 -1.03 0.00 0.00 54.13 55.57 2cpu s LEU 217 Cb -0.14 -4.57 -0.12 0.00 0.03 0.00 0.00 46.19 41.39 2cpu s LEU 217 CO 0.54 -2.30 1.90 -3.20 0.23 0.00 0.00 176.35 173.51 2cpu n ASN 218 N -3.04 3.25 0.00 2.29 5.15 -1.26 -4.80 115.26 116.85 2cpu n ASN 218 Ca 0.12 0.93 0.06 0.00 -0.60 0.00 0.00 54.58 55.10 2cpu n ASN 218 Cb 0.51 -1.34 0.32 0.00 -0.53 0.00 0.00 39.78 38.74 2cpu n ASN 218 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2cpu n SER 219 N 6.84 0.00 0.17 1.20 3.41 -1.26 -0.94 113.62 123.03 2cpu n SER 219 Ca 0.24 0.13 0.13 0.00 -0.26 0.00 0.00 58.87 59.11 2cpu n SER 219 Cb 0.27 -0.30 0.30 0.00 -0.26 0.00 0.00 64.21 64.22 2cpu n SER 219 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 2cpu h ASN 220 N 0.00 0.00 0.00 4.04 2.35 -1.99 -3.36 115.58 116.62 2cpu h ASN 220 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2cpu h ASN 220 Cb 0.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.49 2cpu h ASN 220 CO 0.00 0.00 -0.64 0.79 -1.65 0.00 0.00 177.43 175.93 2cpu n TRP 221 N -2.72 0.00 -4.60 1.19 8.01 -0.81 -5.08 117.44 113.43 2cpu n TRP 221 Ca 0.04 0.00 -0.30 0.00 -1.31 0.00 0.00 57.50 55.93 2cpu n TRP 221 Cb 0.47 0.00 -0.13 0.00 -2.01 0.00 0.00 31.31 29.64 2cpu n TRP 221 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.69 176.62 2cpu s PHE 222 N -1.49 2.46 0.66 -5.99 0.08 -0.12 -5.09 117.98 108.50 2cpu s PHE 222 Ca 0.00 -0.31 -0.17 0.00 0.12 0.00 0.00 56.93 56.56 2cpu s PHE 222 Cb 0.00 -1.39 -0.01 0.00 -0.57 0.00 0.00 43.02 41.05 2cpu s PHE 222 CO 0.00 0.26 1.13 -0.35 -0.10 0.00 0.00 175.22 176.16 2cpu n PRO 223 N 1.35 0.87 -1.73 0.24 -0.04 -1.26 -4.22 135.00 130.20 2cpu n PRO 223 Ca -0.16 0.35 -0.42 0.00 -0.04 0.00 0.00 63.50 63.22 2cpu n PRO 223 Cb 0.52 -2.36 -0.01 0.00 -0.04 0.00 0.00 33.50 31.61 2cpu n PRO 223 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cpu n ALA 224 N -2.08 1.96 -0.66 0.55 0.00 -1.26 -2.47 120.51 116.55 2cpu n ALA 224 Ca 0.15 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.95 2cpu n ALA 224 Cb 0.48 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.56 2cpu n ALA 224 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cpu n GLY 225 N 1.34 0.70 3.72 0.00 0.00 -1.26 -5.03 105.19 104.66 2cpu n GLY 225 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2cpu n GLY 225 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cpu s SER 226 N -2.18 6.96 0.00 1.61 0.01 -1.03 -4.95 113.70 114.13 2cpu s SER 226 Ca 0.00 2.17 0.00 0.00 1.31 0.00 0.00 55.95 59.43 2cpu s SER 226 Cb 0.00 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.61 2cpu s SER 226 CO 0.00 -0.55 0.06 -0.54 0.41 0.00 0.00 173.24 172.62 2cpu s LYS 227 N 1.01 2.98 0.44 12.44 1.02 -1.26 -0.56 119.74 135.81 2cpu s LYS 227 Ca 0.61 -0.53 -0.25 0.00 0.02 0.00 0.00 55.97 55.81 2cpu s LYS 227 Cb -0.33 -2.80 -0.08 0.00 -0.52 0.00 0.00 37.83 34.10 2cpu s LYS 227 CO 0.30 0.63 1.40 -1.25 -0.92 0.00 0.00 175.35 175.51 2cpu s PRO 228 N -1.75 3.76 0.07 -1.68 0.04 -1.26 -4.86 135.00 129.32 2cpu s PRO 228 Ca 0.23 2.35 -0.31 0.00 0.04 0.00 0.00 61.00 63.31 2cpu s PRO 228 Cb -0.12 -2.68 -0.07 0.00 0.04 0.00 0.00 34.50 31.67 2cpu s PRO 228 CO 0.14 -0.73 1.36 0.12 0.04 0.00 0.00 177.00 177.93 2cpu s PHE 229 N -1.22 3.16 -0.15 0.56 5.36 -0.25 -4.71 117.98 120.74 2cpu s PHE 229 Ca 0.60 0.97 0.02 0.00 -0.96 0.00 0.00 56.93 57.55 2cpu s PHE 229 Cb -0.42 -3.64 0.01 0.00 -0.34 0.00 0.00 43.02 38.63 2cpu s PHE 229 CO 0.54 -2.24 -0.20 0.42 -1.46 0.00 0.00 175.22 172.29 2cpu s ILE 230 N 1.46 1.92 -0.10 3.12 -1.09 -1.26 -0.18 121.20 125.07 2cpu s ILE 230 Ca 0.64 -0.88 0.01 0.00 -2.23 0.00 0.00 60.65 58.18 2cpu s ILE 230 Cb -0.34 -1.72 0.02 0.00 -1.58 0.00 0.00 42.46 38.83 2cpu s ILE 230 CO 0.29 0.52 -0.11 -0.72 -1.23 0.00 0.00 174.94 173.69 2cpu s TYR 231 N 1.02 1.65 -0.20 3.97 1.13 -0.58 -0.40 117.35 123.94 2cpu s TYR 231 Ca -0.03 -0.78 -0.12 0.00 -1.41 0.00 0.00 57.07 54.74 2cpu s TYR 231 Cb -0.15 -1.27 -0.05 0.00 -1.10 0.00 0.00 41.96 39.40 2cpu s TYR 231 CO -0.05 -0.47 0.20 -0.65 -2.51 0.00 0.00 175.55 172.07 2cpu s GLN 232 N 1.28 4.18 -0.46 -3.49 -0.21 0.33 -0.88 119.66 120.41 2cpu s GLN 232 Ca -0.02 -0.12 -0.29 0.00 0.02 0.00 0.00 55.36 54.95 2cpu s GLN 232 Cb -0.14 -3.46 0.03 0.00 1.00 0.00 0.00 33.01 30.43 2cpu s GLN 232 CO -0.04 0.19 1.18 -2.00 -2.12 0.00 0.00 175.29 172.50 2cpu s GLU 233 N 0.66 3.72 -0.17 2.91 2.12 -0.53 -1.44 118.70 125.97 2cpu s GLU 233 Ca 0.11 0.66 -0.03 0.00 0.36 0.00 0.00 54.97 56.08 2cpu s GLU 233 Cb -0.12 -3.92 0.05 0.00 0.26 0.00 0.00 34.13 30.40 2cpu s GLU 233 CO 0.02 -1.38 0.03 0.08 -0.54 0.00 0.00 175.26 173.47 2cpu s VAL 234 N 4.56 0.49 -0.56 3.70 1.01 -1.26 -1.23 120.40 127.11 2cpu s VAL 234 Ca 0.50 -0.41 -0.26 0.00 0.00 0.00 0.00 61.98 61.81 2cpu s VAL 234 Cb -0.09 -0.93 0.04 0.00 0.00 0.00 0.00 36.38 35.40 2cpu s VAL 234 CO 0.31 -0.11 1.05 -0.63 0.00 0.00 0.00 175.10 175.72 2cpu s ILE 235 N 1.88 4.23 -0.48 2.22 1.01 -1.26 -4.62 121.20 124.18 2cpu s ILE 235 Ca 0.00 0.57 0.03 0.00 0.00 0.00 0.00 60.65 61.25 2cpu s ILE 235 Cb -0.16 -4.62 0.15 0.00 0.01 0.00 0.00 42.46 37.84 2cpu s ILE 235 CO -0.07 -1.21 0.30 -0.62 0.00 0.00 0.00 174.94 173.34 2cpu s ASP 236 N 2.88 3.49 0.00 3.58 2.15 -1.26 -5.02 116.67 122.49 2cpu s ASP 236 Ca 0.36 -2.92 0.00 0.00 0.43 0.00 0.00 52.55 50.42 2cpu s ASP 236 Cb -0.10 -1.04 0.00 0.00 -0.30 0.00 0.00 42.92 41.48 2cpu s ASP 236 CO 0.22 -0.22 0.00 0.18 -0.17 0.00 0.00 175.17 175.18 2cpu n LEU 237 N 3.15 0.00 -4.95 -1.34 4.77 -1.26 -4.66 117.00 112.70 2cpu n LEU 237 Ca 0.14 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.84 2cpu n LEU 237 Cb 0.37 0.00 0.19 0.00 -2.33 0.00 0.00 43.42 41.65 2cpu n LEU 237 CO 0.22 0.00 0.82 -0.83 -1.33 0.00 0.00 177.39 176.27 2cpu s GLY 238 N 0.00 1.81 -0.22 -0.72 0.00 -1.26 -4.75 107.32 102.18 2cpu s GLY 238 Ca 0.00 -1.47 -0.05 0.00 0.00 0.00 0.00 44.72 43.20 2cpu s GLY 238 CO 0.00 -0.68 0.10 0.61 0.00 0.00 0.00 173.10 173.13 2cpu n GLY 239 N -3.63 -0.13 3.32 0.20 0.00 -1.26 -5.00 105.19 98.70 2cpu n GLY 239 Ca 0.17 0.05 -0.23 0.00 0.00 0.00 0.00 46.02 46.01 2cpu n GLY 239 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cpu s GLU 240 N -5.21 1.24 0.52 1.61 2.02 -1.26 -5.02 118.70 112.60 2cpu s GLU 240 Ca 0.07 -1.31 0.30 0.00 0.02 0.00 0.00 54.97 54.05 2cpu s GLU 240 Cb -0.04 -1.42 1.37 0.00 0.10 0.00 0.00 34.13 34.13 2cpu s GLU 240 CO 0.17 0.31 2.00 -1.00 0.02 0.00 0.00 175.26 176.76 2cpu h PRO 241 N 3.61 0.00 -5.65 0.39 0.13 -1.88 -3.41 132.00 125.20 2cpu h PRO 241 Ca -0.45 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.10 2cpu h PRO 241 Cb 1.19 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.23 2cpu h PRO 241 CO 0.45 0.10 -0.13 0.42 -0.23 0.00 0.00 178.00 178.61 2cpu s ILE 242 N -3.85 5.18 0.08 -3.56 1.01 -1.26 -5.02 121.20 113.78 2cpu s ILE 242 Ca -0.01 0.91 0.08 0.00 0.00 0.00 0.00 60.65 61.63 2cpu s ILE 242 Cb 0.11 -3.80 -0.04 0.00 0.01 0.00 0.00 42.46 38.74 2cpu s ILE 242 CO 0.57 0.29 -0.17 -0.54 0.00 0.00 0.00 174.94 175.09 2cpu s LYS 243 N 0.91 1.97 0.47 2.79 1.02 -1.26 -4.96 119.74 120.68 2cpu s LYS 243 Ca 0.24 -1.06 0.32 0.00 0.02 0.00 0.00 55.97 55.49 2cpu s LYS 243 Cb -0.15 -2.17 1.35 0.00 -0.52 0.00 0.00 37.83 36.34 2cpu s LYS 243 CO 0.09 0.51 1.94 0.66 -0.92 0.00 0.00 175.35 177.63 2cpu h SER 244 N 4.14 0.00 0.67 2.83 4.64 -1.93 -2.41 113.55 121.49 2cpu h SER 244 Ca -0.49 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.81 2cpu h SER 244 Cb 1.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 2cpu h SER 244 CO 0.47 0.00 -0.12 0.77 -0.87 0.00 0.00 176.83 177.08 2cpu h SER 245 N 0.00 0.00 0.35 4.97 4.64 -2.02 -2.44 113.55 119.05 2cpu h SER 245 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2cpu h SER 245 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2cpu h SER 245 CO 0.00 0.12 0.00 0.44 -0.87 0.00 0.00 176.83 176.52 2cpu h ASP 246 N 0.00 0.00 -0.33 4.97 3.32 -1.85 -2.51 116.42 120.02 2cpu h ASP 246 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2cpu h ASP 246 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 2cpu h ASP 246 CO 0.02 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.32 2cpu n TYR 247 N -2.66 0.42 0.26 4.55 4.02 -0.92 -4.59 117.16 118.24 2cpu n TYR 247 Ca -0.01 -0.30 0.11 0.00 -0.01 0.00 0.00 57.90 57.69 2cpu n TYR 247 Cb 0.14 -0.01 0.71 0.00 -0.02 0.00 0.00 39.34 40.16 2cpu n TYR 247 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 176.86 176.59 2cpu h PHE 248 N 3.18 0.00 0.00 -0.72 0.04 -1.55 -2.19 116.94 115.70 2cpu h PHE 248 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 2cpu h PHE 248 Cb 0.79 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.94 2cpu h PHE 248 CO 0.21 0.08 0.00 0.41 -0.60 0.00 0.00 178.31 178.41 2cpu n GLY 249 N -1.09 -1.07 0.05 -1.45 0.00 -1.26 -3.38 105.19 96.99 2cpu n GLY 249 Ca -0.03 -0.09 -0.02 0.00 0.00 0.00 0.00 46.02 45.88 2cpu n GLY 249 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2cpu n ASN 250 N -1.36 1.03 0.00 1.61 3.02 -0.83 -5.05 115.26 113.68 2cpu n ASN 250 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 2cpu n ASN 250 Cb 0.20 1.22 0.00 0.00 -0.61 0.00 0.00 39.78 40.59 2cpu n ASN 250 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cpu n GLY 251 N 1.83 -0.37 3.84 7.41 0.00 -1.22 -4.80 105.19 111.88 2cpu n GLY 251 Ca -0.18 -1.13 -0.29 0.00 0.00 0.00 0.00 46.02 44.42 2cpu n GLY 251 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cpu s ARG 252 N -2.00 1.89 0.05 1.61 0.52 0.46 -4.42 118.95 117.07 2cpu s ARG 252 Ca 0.00 0.37 0.04 0.00 -0.52 0.00 0.00 55.73 55.62 2cpu s ARG 252 Cb 0.00 -1.92 -0.03 0.00 0.52 0.00 0.00 34.95 33.53 2cpu s ARG 252 CO 0.00 -1.69 -0.12 0.14 0.02 0.00 0.00 175.30 173.65 2cpu s VAL 253 N -3.34 0.91 0.05 3.52 -7.23 0.26 -0.51 120.40 114.06 2cpu s VAL 253 Ca 0.62 -1.14 -0.31 0.00 -1.81 0.00 0.00 61.98 59.34 2cpu s VAL 253 Cb -0.13 -0.89 -0.06 0.00 0.56 0.00 0.00 36.38 35.85 2cpu s VAL 253 CO 0.52 -0.22 1.38 0.42 -0.31 0.00 0.00 175.10 176.89 2cpu s THR 254 N -1.18 3.59 -0.78 5.32 -4.23 -0.52 -1.29 115.64 116.55 2cpu s THR 254 Ca -0.04 1.07 -0.16 0.00 -1.18 0.00 0.00 61.69 61.38 2cpu s THR 254 Cb -0.09 -3.68 0.17 0.00 1.34 0.00 0.00 72.50 70.24 2cpu s THR 254 CO 0.01 0.04 0.80 -0.70 -0.54 0.00 0.00 174.62 174.23 2cpu s GLU 255 N 1.79 3.45 0.10 3.99 2.56 -0.61 -4.52 118.70 125.47 2cpu s GLU 255 Ca 0.64 -2.07 0.23 0.00 0.00 0.00 0.00 54.97 53.76 2cpu s GLU 255 Cb -0.33 -4.49 0.90 0.00 2.00 0.00 0.00 34.13 32.21 2cpu s GLU 255 CO 0.28 -1.43 1.70 1.19 -0.56 0.00 0.00 175.26 176.45 2cpu n PHE 256 N 4.97 0.37 0.24 5.30 3.72 -1.26 -2.61 117.46 128.19 2cpu n PHE 256 Ca 0.09 0.13 0.13 0.00 -0.05 0.00 0.00 57.45 57.75 2cpu n PHE 256 Cb 0.46 -0.71 0.39 0.00 -0.94 0.00 0.00 39.48 38.69 2cpu n PHE 256 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2cpu h LYS 257 N 0.00 0.00 0.83 -1.08 1.57 -1.90 -3.17 116.57 112.83 2cpu h LYS 257 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2cpu h LYS 257 Cb 0.43 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.75 2cpu h LYS 257 CO 0.00 0.05 -0.40 -0.92 -0.57 0.00 0.00 179.45 177.61 2cpu h TYR 258 N 0.00 -1.04 -0.02 -1.35 5.03 -1.84 -1.87 116.97 115.88 2cpu h TYR 258 Ca -0.00 -0.02 -0.09 0.00 2.58 0.00 0.00 58.73 61.19 2cpu h TYR 258 Cb 0.81 0.34 -0.01 0.00 1.55 0.00 0.00 36.73 39.42 2cpu h TYR 258 CO 0.00 -0.65 -0.42 0.78 -1.32 0.00 0.00 178.16 176.55 2cpu h GLY 259 N -1.22 0.05 0.89 1.82 0.00 -1.66 -1.33 103.07 101.61 2cpu h GLY 259 Ca -0.11 -0.05 -0.05 0.00 0.00 0.00 0.00 47.33 47.12 2cpu h GLY 259 CO 0.19 0.04 -0.03 0.00 0.00 0.00 0.00 176.54 176.74 2cpu h ALA 260 N 1.54 0.41 0.01 3.60 0.00 -1.56 -1.27 119.26 121.99 2cpu h ALA 260 Ca 0.00 -0.25 -0.23 0.00 0.00 0.00 0.00 54.91 54.42 2cpu h ALA 260 Cb 0.76 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.45 2cpu h ALA 260 CO 0.06 0.19 -0.97 0.87 0.00 0.00 0.00 179.25 179.39 2cpu h LYS 261 N 0.33 0.45 -0.45 0.00 1.79 -1.29 -2.56 116.57 114.83 2cpu h LYS 261 Ca 0.08 -0.49 -0.05 0.00 -2.18 0.00 0.00 60.65 58.01 2cpu h LYS 261 Cb 0.48 0.14 -0.02 0.00 -1.58 0.00 0.00 32.23 31.25 2cpu h LYS 261 CO 0.02 1.14 0.08 1.25 -1.08 0.00 0.00 179.45 180.86 2cpu h LEU 262 N 0.25 0.65 -0.37 2.94 5.85 -1.25 -1.43 115.31 121.95 2cpu h LEU 262 Ca -0.09 -0.12 -0.05 0.00 0.84 0.00 0.00 57.88 58.46 2cpu h LEU 262 Cb 1.61 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.45 2cpu h LEU 262 CO 0.17 0.67 0.03 1.23 -0.34 0.00 0.00 178.44 180.20 2cpu h GLY 263 N 0.90 0.69 1.69 3.75 0.00 -1.12 -1.71 103.07 107.27 2cpu h GLY 263 Ca 0.15 -0.48 -0.12 0.00 0.00 0.00 0.00 47.33 46.87 2cpu h GLY 263 CO 0.00 0.44 -0.46 -0.91 0.00 0.00 0.00 176.54 175.62 2cpu h THR 264 N 0.47 1.33 -0.03 4.70 1.35 -1.24 -1.80 112.91 117.69 2cpu h THR 264 Ca 0.11 -1.65 -0.01 0.00 -0.55 0.00 0.00 66.41 64.31 2cpu h THR 264 Cb 0.41 1.73 -0.00 0.00 -1.73 0.00 0.00 68.15 68.56 2cpu h THR 264 CO 0.01 0.50 -0.02 0.58 -0.25 0.00 0.00 175.52 176.34 2cpu h VAL 265 N 0.27 1.37 -0.00 6.82 2.07 -1.22 0.32 116.25 125.88 2cpu h VAL 265 Ca 0.02 -1.14 -0.10 0.00 0.82 0.00 0.00 66.70 66.30 2cpu h VAL 265 Cb 0.92 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.76 2cpu h VAL 265 CO 0.08 0.30 -0.49 0.40 0.02 0.00 0.00 177.57 177.88 2cpu h ILE 266 N -0.39 1.35 0.00 4.57 2.04 -1.34 -1.72 117.51 122.02 2cpu h ILE 266 Ca 0.00 -1.68 0.00 0.00 1.00 0.00 0.00 64.86 64.18 2cpu h ILE 266 Cb 0.50 1.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.49 2cpu h ILE 266 CO 0.01 0.48 -0.09 0.54 0.00 0.00 0.00 178.15 179.08 2cpu n ARG 267 N -3.96 0.05 -3.20 2.37 1.74 -0.68 -4.92 116.66 108.07 2cpu n ARG 267 Ca -0.02 0.04 -0.19 0.00 -0.77 0.00 0.00 57.85 56.91 2cpu n ARG 267 Cb 0.51 -1.56 0.05 0.00 -1.02 0.00 0.00 32.46 30.44 2cpu n ARG 267 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2cpu n LYS 268 N -1.65 -5.59 -2.50 5.56 5.02 -0.59 -4.97 118.16 113.43 2cpu n LYS 268 Ca 0.06 0.71 -0.41 0.00 -2.02 0.00 0.00 58.31 56.65 2cpu n LYS 268 Cb 0.36 -5.28 -0.04 0.00 -0.02 0.00 0.00 35.03 30.05 2cpu n LYS 268 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2cpu s TRP 269 N -3.19 3.59 -1.29 2.13 0.52 0.10 -3.97 118.94 116.84 2cpu s TRP 269 Ca 0.39 1.61 -0.11 0.00 0.02 0.00 0.00 56.10 58.01 2cpu s TRP 269 Cb -0.17 -3.28 0.00 0.00 -1.15 0.00 0.00 33.47 28.87 2cpu s TRP 269 CO 0.49 -0.62 0.58 0.27 0.02 0.00 0.00 176.95 177.69 2cpu n ASN 270 N 2.22 -2.49 0.00 2.95 0.23 -1.26 -2.19 115.26 114.71 2cpu n ASN 270 Ca 0.02 -1.03 0.00 0.00 -0.53 0.00 0.00 54.58 53.04 2cpu n ASN 270 Cb 0.46 -3.08 0.00 0.00 -2.08 0.00 0.00 39.78 35.08 2cpu n ASN 270 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2cpu n GLY 271 N -1.88 0.96 3.77 4.83 0.00 -1.25 -5.00 105.19 106.62 2cpu n GLY 271 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 2cpu n GLY 271 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cpu s GLU 272 N -0.25 3.45 0.04 1.61 2.02 -0.93 -5.04 118.70 119.60 2cpu s GLU 272 Ca 0.00 1.78 -0.06 0.00 0.02 0.00 0.00 54.97 56.71 2cpu s GLU 272 Cb 0.00 -2.20 -0.01 0.00 0.10 0.00 0.00 34.13 32.02 2cpu s GLU 272 CO 0.00 -0.81 0.11 -1.59 0.02 0.00 0.00 175.26 173.00 2cpu s LYS 273 N -2.99 0.59 0.57 1.61 -2.85 -1.26 -4.49 119.74 110.92 2cpu s LYS 273 Ca 0.69 -0.70 0.26 0.00 -1.00 0.00 0.00 55.97 55.22 2cpu s LYS 273 Cb -0.29 0.24 1.64 0.00 -2.06 0.00 0.00 37.83 37.36 2cpu s LYS 273 CO 0.33 -0.15 2.18 0.52 0.10 0.00 0.00 175.35 178.33 2cpu h MET 274 N 3.69 0.00 0.00 1.78 2.86 -1.77 -1.51 114.93 119.98 2cpu h MET 274 Ca -0.32 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.32 2cpu h MET 274 Cb 1.19 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.85 2cpu h MET 274 CO 0.49 0.00 -0.01 0.66 1.06 0.00 0.00 176.91 179.11 2cpu h SER 275 N 0.00 0.00 0.85 1.22 4.64 -1.57 -0.74 113.55 117.96 2cpu h SER 275 Ca 0.04 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.36 2cpu h SER 275 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 2cpu h SER 275 CO -0.00 0.01 0.00 -1.22 -0.87 0.00 0.00 176.83 174.75 2cpu n TYR 276 N -3.27 0.11 1.98 4.77 4.01 -0.57 -3.24 117.16 120.96 2cpu n TYR 276 Ca -0.03 0.04 0.04 0.00 -0.16 0.00 0.00 57.90 57.79 2cpu n TYR 276 Cb 0.11 -0.56 0.25 0.00 -0.31 0.00 0.00 39.34 38.83 2cpu n TYR 276 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2cpu n LEU 277 N -1.60 0.00 -0.20 7.72 4.77 -0.28 -3.99 117.00 123.41 2cpu n LEU 277 Ca 0.05 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 56.04 2cpu n LEU 277 Cb 0.28 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.49 2cpu n LEU 277 CO 0.22 0.00 0.96 0.50 -1.33 0.00 0.00 177.39 177.74 2cpu h LYS 278 N 0.00 0.33 -0.76 3.23 3.64 -1.75 -2.23 116.57 119.02 2cpu h LYS 278 Ca 0.00 -0.02 -0.49 0.00 -1.27 0.00 0.00 60.65 58.87 2cpu h LYS 278 Cb 0.00 -0.07 -0.28 0.00 -0.41 0.00 0.00 32.23 31.47 2cpu h LYS 278 CO 0.00 0.22 0.16 0.27 -2.27 0.00 0.00 179.45 177.83 2cpu n ASN 279 N -5.06 5.03 -4.72 4.20 6.94 -1.26 -5.04 115.26 115.35 2cpu n ASN 279 Ca 0.09 -3.76 -0.41 0.00 -0.02 0.00 0.00 54.58 50.48 2cpu n ASN 279 Cb 0.31 -0.71 0.01 0.00 -2.36 0.00 0.00 39.78 37.03 2cpu n ASN 279 CO 0.00 0.00 0.00 1.87 -1.03 0.00 0.00 177.26 178.10 2cpu n TRP 280 N -0.96 2.37 0.00 -2.53 -0.00 -0.84 -3.80 117.44 111.69 2cpu n TRP 280 Ca 0.50 0.49 0.00 0.00 -0.00 0.00 0.00 57.50 58.48 2cpu n TRP 280 Cb 0.98 -2.42 0.00 0.00 -0.00 0.00 0.00 31.31 29.88 2cpu n TRP 280 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2cpu n GLY 281 N 0.71 0.11 0.35 5.87 0.00 -1.26 -4.65 105.19 106.32 2cpu n GLY 281 Ca 0.05 -1.74 0.11 0.00 0.00 0.00 0.00 46.02 44.44 2cpu n GLY 281 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2cpu h GLU 282 N 0.00 0.42 -0.06 1.61 3.07 -1.82 0.12 114.58 117.93 2cpu h GLU 282 Ca 0.00 -0.03 0.02 0.00 -0.50 0.00 0.00 59.36 58.85 2cpu h GLU 282 Cb 0.00 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 27.81 2cpu h GLU 282 CO 0.00 0.28 0.16 0.78 -1.40 0.00 0.00 179.01 178.83 2cpu h GLY 283 N 0.43 0.00 -1.93 -3.84 0.00 -1.83 0.23 103.07 96.13 2cpu h GLY 283 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.60 2cpu h GLY 283 CO -0.07 0.00 0.00 0.79 0.00 0.00 0.00 176.54 177.26 2cpu n TRP 284 N -3.27 0.69 -0.69 5.60 7.02 0.43 -4.89 117.44 122.32 2cpu n TRP 284 Ca -0.01 -0.35 0.00 0.00 -1.02 0.00 0.00 57.50 56.12 2cpu n TRP 284 Cb 0.24 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.13 2cpu n TRP 284 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 2cpu n GLY 285 N 1.34 0.60 3.89 6.99 0.00 0.80 -5.01 105.19 113.81 2cpu n GLY 285 Ca 0.18 -0.51 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 2cpu n GLY 285 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2cpu s PHE 286 N -2.00 3.35 0.90 1.61 0.08 -1.21 -5.02 117.98 115.69 2cpu s PHE 286 Ca 0.00 0.93 -0.11 0.00 0.12 0.00 0.00 56.93 57.87 2cpu s PHE 286 Cb 0.00 -2.87 0.13 0.00 -0.57 0.00 0.00 43.02 39.71 2cpu s PHE 286 CO 0.00 -0.95 1.10 0.14 -0.10 0.00 0.00 175.22 175.41 2cpu s VAL 287 N -3.18 2.60 0.47 -0.44 -7.23 -1.26 -4.50 120.40 106.86 2cpu s VAL 287 Ca 0.56 0.20 -0.24 0.00 -1.81 0.00 0.00 61.98 60.68 2cpu s VAL 287 Cb -0.11 -2.51 -0.08 0.00 0.56 0.00 0.00 36.38 34.24 2cpu s VAL 287 CO 0.49 -0.25 1.33 -2.65 -0.31 0.00 0.00 175.10 173.71 2cpu n PRO 288 N -4.01 1.94 -0.31 4.82 -0.02 -1.26 -4.63 135.00 131.53 2cpu n PRO 288 Ca 0.08 0.69 0.08 0.00 -2.02 0.00 0.00 63.50 62.34 2cpu n PRO 288 Cb 0.54 -2.49 0.24 0.00 -0.02 0.00 0.00 33.50 31.77 2cpu n PRO 288 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2cpu h SER 289 N 1.94 0.61 0.00 2.55 0.87 -1.95 0.19 113.55 117.77 2cpu h SER 289 Ca -0.49 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 2cpu h SER 289 Cb 1.29 -0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 2cpu h SER 289 CO 0.59 0.26 0.00 -0.90 -0.53 0.00 0.00 176.83 176.25 2cpu n ASP 290 N -4.83 0.00 -0.00 6.23 5.68 -1.26 -2.11 116.55 120.26 2cpu n ASP 290 Ca 0.18 -0.82 0.00 0.00 -0.50 0.00 0.00 54.79 53.65 2cpu n ASP 290 Cb 0.45 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 2cpu n ASP 290 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2cpu n ARG 291 N -0.87 2.48 -4.39 0.11 5.12 0.04 -4.90 116.66 114.26 2cpu n ARG 291 Ca 0.12 -1.34 -0.34 0.00 -1.93 0.00 0.00 57.85 54.35 2cpu n ARG 291 Cb 0.05 -0.92 -0.10 0.00 -1.16 0.00 0.00 32.46 30.33 2cpu n ARG 291 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2cpu s ALA 292 N -0.85 3.17 -0.30 7.54 0.00 -0.90 -0.58 121.76 129.86 2cpu s ALA 292 Ca 0.00 -0.82 -0.04 0.00 0.00 0.00 0.00 51.96 51.11 2cpu s ALA 292 Cb 0.00 -1.50 0.04 0.00 0.00 0.00 0.00 23.12 21.66 2cpu s ALA 292 CO 0.00 0.45 0.03 -1.17 0.00 0.00 0.00 175.76 175.07 2cpu s LEU 293 N -0.43 3.87 0.26 0.00 1.98 -0.41 -1.98 118.68 121.96 2cpu s LEU 293 Ca 0.08 -1.07 0.08 0.00 -2.89 0.00 0.00 54.13 50.33 2cpu s LEU 293 Cb -0.12 -1.77 -0.04 0.00 0.66 0.00 0.00 46.19 44.92 2cpu s LEU 293 CO 0.02 -0.24 0.08 0.68 -1.89 0.00 0.00 176.35 175.00 2cpu s VAL 294 N 1.34 3.89 -0.06 1.68 -7.23 -0.24 -1.57 120.40 118.22 2cpu s VAL 294 Ca -0.02 -1.69 -0.30 0.00 -1.81 0.00 0.00 61.98 58.16 2cpu s VAL 294 Cb -0.19 -3.09 0.11 0.00 0.56 0.00 0.00 36.38 33.77 2cpu s VAL 294 CO -0.00 -0.36 0.95 0.72 -0.31 0.00 0.00 175.10 176.09 2cpu s PHE 295 N -2.24 -0.33 -0.13 2.82 -0.71 -1.26 -0.74 117.98 115.39 2cpu s PHE 295 Ca 0.32 0.28 -0.26 0.00 -1.04 0.00 0.00 56.93 56.22 2cpu s PHE 295 Cb -0.07 0.52 -0.26 0.00 -1.21 0.00 0.00 43.02 42.00 2cpu s PHE 295 CO 0.22 -0.47 0.70 0.28 -1.34 0.00 0.00 175.22 174.62 2cpu h VAL 296 N 2.11 1.60 -4.08 -2.49 2.07 -1.93 -3.25 116.25 110.28 2cpu h VAL 296 Ca -0.20 -2.36 -0.16 0.00 0.82 0.00 0.00 66.70 64.80 2cpu h VAL 296 Cb 1.22 3.18 -0.15 0.00 -1.52 0.00 0.00 31.29 34.02 2cpu h VAL 296 CO 0.30 0.59 -0.69 1.51 0.02 0.00 0.00 177.57 179.30 2cpu s ASP 297 N -6.45 0.74 0.39 0.57 -4.77 -1.26 -4.50 116.67 101.38 2cpu s ASP 297 Ca -0.20 -1.00 0.03 0.00 -3.30 0.00 0.00 52.55 48.09 2cpu s ASP 297 Cb -0.01 0.16 -0.04 0.00 -1.09 0.00 0.00 42.92 41.94 2cpu s ASP 297 CO 0.70 -0.55 0.09 0.54 0.70 0.00 0.00 175.17 176.65 2cpu s ASN 298 N -2.97 2.75 0.54 2.11 4.22 -1.26 -4.68 114.94 115.65 2cpu s ASN 298 Ca 0.09 -1.56 0.21 0.00 -2.14 0.00 0.00 52.86 49.46 2cpu s ASN 298 Cb 0.07 0.29 1.39 0.00 1.28 0.00 0.00 41.25 44.28 2cpu s ASN 298 CO -0.08 -0.80 2.12 1.12 -2.04 0.00 0.00 177.10 177.42 2cpu h HIS 299 N 1.87 0.00 -0.29 1.54 2.07 -1.99 -2.43 115.15 115.92 2cpu h HIS 299 Ca -0.38 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.14 2cpu h HIS 299 Cb 1.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.25 2cpu h HIS 299 CO 1.16 0.00 0.00 -1.71 -3.07 0.00 0.00 177.93 174.31 2cpu n ASN 300 N -4.36 3.24 0.00 3.10 5.15 -1.26 -4.18 115.26 116.95 2cpu n ASN 300 Ca 0.00 -1.97 0.00 0.00 -0.60 0.00 0.00 54.58 52.01 2cpu n ASN 300 Cb 0.23 -0.18 0.00 0.00 -0.53 0.00 0.00 39.78 39.30 2cpu n ASN 300 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 2cpu n ASN 301 N 1.38 0.42 0.07 1.20 0.23 -1.14 0.47 115.26 117.89 2cpu n ASN 301 Ca 0.18 -0.81 0.13 0.00 -0.53 0.00 0.00 54.58 53.56 2cpu n ASN 301 Cb 0.59 0.16 0.48 0.00 -2.08 0.00 0.00 39.78 38.92 2cpu n ASN 301 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2cpu n GLN 302 N -0.16 0.17 -0.31 -3.83 10.64 -0.93 -3.19 117.38 119.77 2cpu n GLN 302 Ca 0.00 0.14 0.08 0.00 -1.83 0.00 0.00 57.00 55.40 2cpu n GLN 302 Cb 0.08 -1.70 0.21 0.00 -0.86 0.00 0.00 30.24 27.97 2cpu n GLN 302 CO 0.00 0.00 0.00 2.89 -1.83 0.00 0.00 177.06 178.12 2cpu n ARG 303 N -2.00 2.51 -1.00 2.61 1.85 -1.26 -4.95 116.66 114.42 2cpu n ARG 303 Ca 0.06 -2.67 -0.00 0.00 -1.00 0.00 0.00 57.85 54.24 2cpu n ARG 303 Cb 0.40 -1.68 -0.00 0.00 -1.05 0.00 0.00 32.46 30.13 2cpu n ARG 303 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2cpu n GLY 304 N -0.66 0.40 0.17 2.89 0.00 -1.19 -4.88 105.19 101.92 2cpu n GLY 304 Ca 0.18 -0.03 0.15 0.00 0.00 0.00 0.00 46.02 46.32 2cpu n GLY 304 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2cpu n HIS 305 N -2.79 0.00 -2.70 1.61 -0.00 -1.13 -4.93 115.22 105.28 2cpu n HIS 305 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2cpu n HIS 305 Cb 0.11 -0.07 0.00 0.00 -0.00 0.00 0.00 29.99 30.03 2cpu n HIS 305 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2cpu n GLY 306 N 1.15 2.58 3.61 -1.41 0.00 0.18 -4.76 105.19 106.53 2cpu n GLY 306 Ca 0.19 -0.97 -0.58 0.00 0.00 0.00 0.00 46.02 44.66 2cpu n GLY 306 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cpu n ALA 307 N -3.00 -1.86 0.00 4.61 0.00 -1.26 -2.00 120.51 117.00 2cpu n ALA 307 Ca 0.00 0.52 0.00 0.00 0.00 0.00 0.00 53.44 53.96 2cpu n ALA 307 Cb 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.49 2cpu n ALA 307 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cpu n GLY 308 N 2.68 3.17 7.00 0.00 0.00 -1.26 -4.84 105.19 111.94 2cpu n GLY 308 Ca 0.22 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 45.16 2cpu n GLY 308 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cpu n GLY 309 N 0.00 1.81 0.11 -0.02 0.00 -0.85 -3.27 105.19 102.97 2cpu n GLY 309 Ca 0.00 -0.52 0.13 0.00 0.00 0.00 0.00 46.02 45.63 2cpu n GLY 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cpu n ALA 310 N 9.81 2.10 0.17 4.61 0.00 -1.26 -3.31 120.51 132.64 2cpu n ALA 310 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 2cpu n ALA 310 Cb 0.00 -1.44 0.15 0.00 0.00 0.00 0.00 19.45 18.15 2cpu n ALA 310 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2cpu h SER 311 N 0.00 0.00 -2.29 0.00 4.64 -1.90 -3.46 113.55 110.54 2cpu h SER 311 Ca 0.00 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.72 2cpu h SER 311 Cb 0.62 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.77 2cpu h SER 311 CO 0.00 0.34 0.66 -0.38 -0.87 0.00 0.00 176.83 176.58 2cpu n ILE 312 N -3.23 0.34 -3.57 0.95 2.08 -1.21 -4.37 119.36 110.35 2cpu n ILE 312 Ca 0.02 -0.09 -0.38 0.00 0.56 0.00 0.00 62.75 62.87 2cpu n ILE 312 Cb 0.63 -1.37 -0.06 0.00 -0.75 0.00 0.00 39.64 38.09 2cpu n ILE 312 CO 0.00 0.00 0.00 -0.76 0.56 0.00 0.00 176.55 176.35 2cpu s LEU 313 N 0.58 4.46 0.34 1.39 1.43 -1.26 -5.05 118.68 120.58 2cpu s LEU 313 Ca 0.76 0.88 0.07 0.00 -1.03 0.00 0.00 54.13 54.81 2cpu s LEU 313 Cb -0.72 -2.50 -0.03 0.00 0.03 0.00 0.00 46.19 42.97 2cpu s LEU 313 CO 0.44 0.34 0.25 0.42 0.23 0.00 0.00 176.35 178.03 2cpu s THR 314 N -1.07 0.10 0.60 5.49 -4.23 -1.26 -4.29 115.64 110.97 2cpu s THR 314 Ca 0.22 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 59.04 2cpu s THR 314 Cb -0.16 -2.46 0.36 0.00 1.34 0.00 0.00 72.50 71.58 2cpu s THR 314 CO 0.12 0.00 2.16 2.19 -0.54 0.00 0.00 174.62 178.55 2cpu h PHE 315 N 2.07 0.00 0.00 3.99 -5.15 -1.96 -0.07 116.94 115.83 2cpu h PHE 315 Ca -0.27 0.00 -0.01 0.00 -0.20 0.00 0.00 57.97 57.50 2cpu h PHE 315 Cb 1.24 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.41 2cpu h PHE 315 CO 1.68 0.00 -0.03 -1.49 -2.00 0.00 0.00 178.31 176.47 2cpu h TRP 316 N 0.00 0.00 -1.79 6.09 4.06 -1.97 -1.82 115.95 120.51 2cpu h TRP 316 Ca 0.05 0.00 -0.73 0.00 2.06 0.00 0.00 58.89 60.27 2cpu h TRP 316 Cb 0.32 0.00 -0.30 0.00 -1.00 0.00 0.00 29.16 28.18 2cpu h TRP 316 CO 0.00 0.03 0.76 -0.25 -3.56 0.00 0.00 178.44 175.42 2cpu n ASP 317 N -4.22 7.12 -0.25 -3.49 8.00 -0.04 -4.92 116.55 118.75 2cpu n ASP 317 Ca -0.03 -3.82 -0.03 0.00 0.71 0.00 0.00 54.79 51.63 2cpu n ASP 317 Cb 0.12 -0.96 -0.01 0.00 -0.02 0.00 0.00 41.12 40.25 2cpu n ASP 317 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2cpu n ALA 318 N -0.58 -0.20 -0.00 2.24 0.00 -0.69 -0.70 120.51 120.58 2cpu n ALA 318 Ca 0.53 0.59 -0.12 0.00 0.00 0.00 0.00 53.44 54.45 2cpu n ALA 318 Cb 0.36 -0.21 -0.06 0.00 0.00 0.00 0.00 19.45 19.53 2cpu n ALA 318 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2cpu h ARG 319 N 0.00 0.11 -0.02 0.00 2.43 -1.89 -2.10 114.38 112.90 2cpu h ARG 319 Ca 0.17 -0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 59.18 2cpu h ARG 319 Cb 0.33 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.85 2cpu h ARG 319 CO -0.61 0.18 -0.67 -0.07 -1.51 0.00 0.00 179.97 177.29 2cpu h LEU 320 N 0.01 0.09 -0.41 3.80 3.38 -1.70 -3.12 115.31 117.36 2cpu h LEU 320 Ca 0.03 -0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2cpu h LEU 320 Cb 0.11 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 2cpu h LEU 320 CO -0.00 0.73 0.18 0.22 0.09 0.00 0.00 178.44 179.66 2cpu h TYR 321 N 0.05 0.60 -0.94 1.13 3.20 -0.78 -1.22 116.97 119.02 2cpu h TYR 321 Ca -0.01 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 61.83 2cpu h TYR 321 Cb 1.19 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 39.23 2cpu h TYR 321 CO 0.01 0.52 0.61 0.87 -1.64 0.00 0.00 178.16 178.52 2cpu h LYS 322 N 0.52 1.25 -0.46 1.82 1.57 -1.37 -0.11 116.57 119.79 2cpu h LYS 322 Ca 0.14 -0.09 -0.11 0.00 -1.87 0.00 0.00 60.65 58.72 2cpu h LYS 322 Cb 0.15 -0.28 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 2cpu h LYS 322 CO -0.01 0.84 -0.16 1.98 -0.57 0.00 0.00 179.45 181.52 2cpu h MET 323 N 1.28 0.92 -0.45 3.15 4.05 -1.44 -0.40 114.93 122.03 2cpu h MET 323 Ca 0.34 -0.37 -0.08 0.00 -0.28 0.00 0.00 59.70 59.30 2cpu h MET 323 Cb -0.12 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.62 2cpu h MET 323 CO -0.07 1.03 -0.04 0.00 0.23 0.00 0.00 176.91 178.05 2cpu h ALA 324 N 0.86 0.61 -0.49 0.39 0.00 -0.78 -1.27 119.26 118.58 2cpu h ALA 324 Ca 0.11 -0.30 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 2cpu h ALA 324 Cb 0.72 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 2cpu h ALA 324 CO 0.06 0.44 -0.09 0.28 0.00 0.00 0.00 179.25 179.94 2cpu h VAL 325 N 0.66 1.26 -0.24 0.00 2.07 -0.98 -1.34 116.25 117.69 2cpu h VAL 325 Ca 0.12 -1.19 -0.01 0.00 0.82 0.00 0.00 66.70 66.44 2cpu h VAL 325 Cb 0.56 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.30 2cpu h VAL 325 CO 0.03 0.42 0.12 1.23 0.02 0.00 0.00 177.57 179.38 2cpu h GLY 326 N 0.97 0.36 1.00 2.17 0.00 -0.88 0.23 103.07 106.92 2cpu h GLY 326 Ca 0.13 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 2cpu h GLY 326 CO 0.04 0.17 0.36 -2.75 0.00 0.00 0.00 176.54 174.35 2cpu h PHE 327 N 0.25 0.94 -0.34 5.60 3.57 -1.08 -1.06 116.94 124.82 2cpu h PHE 327 Ca 0.08 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2cpu h PHE 327 Cb 0.10 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 2cpu h PHE 327 CO -0.03 0.68 0.16 1.98 -2.23 0.00 0.00 178.31 178.87 2cpu h MET 328 N 0.93 0.50 0.00 1.11 4.05 -0.99 -1.37 114.93 119.15 2cpu h MET 328 Ca 0.24 -0.08 -0.03 0.00 -0.28 0.00 0.00 59.70 59.55 2cpu h MET 328 Cb 0.06 -0.09 -0.00 0.00 -0.80 0.00 0.00 31.60 30.77 2cpu h MET 328 CO -0.04 0.46 -0.13 -0.07 0.23 0.00 0.00 176.91 177.37 2cpu h LEU 329 N 0.41 0.00 0.00 3.39 3.38 -0.72 -3.04 115.31 118.73 2cpu h LEU 329 Ca 0.12 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.84 2cpu h LEU 329 Cb 0.14 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 2cpu h LEU 329 CO -0.01 0.13 -1.55 0.00 0.09 0.00 0.00 178.44 177.10 2cpu h ALA 330 N 1.87 0.71 -2.60 1.53 0.00 -0.99 -3.37 119.26 116.41 2cpu h ALA 330 Ca -0.00 -1.21 -0.51 0.00 0.00 0.00 0.00 54.91 53.19 2cpu h ALA 330 Cb 0.63 0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.78 2cpu h ALA 330 CO 0.02 1.32 0.37 -1.58 0.00 0.00 0.00 179.25 179.39 2cpu s HIS 331 N -2.72 3.81 0.56 0.00 5.65 -0.53 -4.95 115.29 117.10 2cpu s HIS 331 Ca -0.04 1.79 0.36 0.00 0.25 0.00 0.00 55.06 57.43 2cpu s HIS 331 Cb 0.08 -3.07 2.00 0.00 -1.18 0.00 0.00 32.58 30.41 2cpu s HIS 331 CO 0.82 0.14 2.26 -1.00 -0.65 0.00 0.00 174.74 176.31 2cpu h PRO 332 N 5.32 0.00 -6.68 2.88 0.13 -1.90 -3.45 132.00 128.29 2cpu h PRO 332 Ca -0.43 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.17 2cpu h PRO 332 Cb 1.21 0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.39 2cpu h PRO 332 CO 0.71 0.02 0.84 -0.47 -0.23 0.00 0.00 178.00 178.87 2cpu s TYR 333 N -4.27 3.01 0.22 1.56 5.04 -1.26 -4.87 117.35 116.78 2cpu s TYR 333 Ca -0.04 0.80 0.00 0.00 -2.44 0.00 0.00 57.07 55.39 2cpu s TYR 333 Cb 0.13 -3.90 0.00 0.00 0.35 0.00 0.00 41.96 38.54 2cpu s TYR 333 CO 0.49 -3.16 0.00 0.41 -1.34 0.00 0.00 175.55 171.96 2cpu n GLY 334 N 2.96 -1.48 3.66 8.97 0.00 -1.26 -4.83 105.19 113.22 2cpu n GLY 334 Ca 0.10 -1.00 -0.35 0.00 0.00 0.00 0.00 46.02 44.77 2cpu n GLY 334 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2cpu s PHE 335 N -1.55 3.32 -0.03 1.61 5.36 -0.84 -4.94 117.98 120.91 2cpu s PHE 335 Ca 0.00 0.18 -0.13 0.00 -0.96 0.00 0.00 56.93 56.02 2cpu s PHE 335 Cb 0.00 -2.18 -0.05 0.00 -0.34 0.00 0.00 43.02 40.45 2cpu s PHE 335 CO 0.00 0.14 0.35 0.95 -1.46 0.00 0.00 175.22 175.20 2cpu s THR 336 N 0.68 5.14 -0.14 0.12 -4.23 -1.26 -1.08 115.64 114.88 2cpu s THR 336 Ca 0.06 0.71 0.02 0.00 -1.18 0.00 0.00 61.69 61.30 2cpu s THR 336 Cb -0.12 -3.65 0.01 0.00 1.34 0.00 0.00 72.50 70.07 2cpu s THR 336 CO 0.01 0.57 -0.21 -0.60 -0.54 0.00 0.00 174.62 173.85 2cpu s ARG 337 N -0.93 3.06 -0.12 3.99 3.52 0.08 -2.33 118.95 126.22 2cpu s ARG 337 Ca 0.22 -0.84 -0.13 0.00 -0.13 0.00 0.00 55.73 54.85 2cpu s ARG 337 Cb -0.16 -2.46 -0.05 0.00 -1.56 0.00 0.00 34.95 30.73 2cpu s ARG 337 CO 0.11 0.01 0.30 0.08 -0.81 0.00 0.00 175.30 174.99 2cpu s VAL 338 N 0.76 5.27 0.19 7.11 1.01 -0.04 -4.45 120.40 130.24 2cpu s VAL 338 Ca -0.08 0.57 -0.17 0.00 0.00 0.00 0.00 61.98 62.29 2cpu s VAL 338 Cb -0.16 -3.62 -0.08 0.00 0.00 0.00 0.00 36.38 32.53 2cpu s VAL 338 CO -0.00 0.46 0.65 -0.32 0.00 0.00 0.00 175.10 175.89 2cpu s MET 339 N -0.09 4.14 -0.12 2.72 1.75 -1.26 -0.37 119.30 126.06 2cpu s MET 339 Ca 0.18 0.71 -0.02 0.00 -1.25 0.00 0.00 55.69 55.31 2cpu s MET 339 Cb -0.14 -2.92 0.04 0.00 2.84 0.00 0.00 34.83 34.66 2cpu s MET 339 CO 0.06 0.44 0.03 0.45 -0.65 0.00 0.00 175.02 175.35 2cpu s SER 340 N -1.65 2.04 0.19 1.11 0.15 -0.84 -4.25 113.70 110.44 2cpu s SER 340 Ca 0.40 -0.35 0.01 0.00 0.70 0.00 0.00 55.95 56.71 2cpu s SER 340 Cb -0.16 -0.44 -0.00 0.00 -1.71 0.00 0.00 66.02 63.70 2cpu s SER 340 CO 0.20 -0.25 0.03 -1.54 1.20 0.00 0.00 173.24 172.88 2cpu n SER 341 N 5.14 1.82 -4.35 5.45 3.41 -1.26 -3.05 113.62 120.78 2cpu n SER 341 Ca -0.07 -1.89 -0.25 0.00 -0.26 0.00 0.00 58.87 56.40 2cpu n SER 341 Cb 0.49 0.28 -0.12 0.00 -0.26 0.00 0.00 64.21 64.60 2cpu n SER 341 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2cpu s TYR 342 N -1.95 2.01 0.30 7.33 -0.85 -1.26 0.46 117.35 123.39 2cpu s TYR 342 Ca 0.04 -0.41 -0.18 0.00 -0.52 0.00 0.00 57.07 56.00 2cpu s TYR 342 Cb 0.00 -1.04 -0.09 0.00 0.38 0.00 0.00 41.96 41.21 2cpu s TYR 342 CO 0.03 0.34 0.77 1.03 -1.52 0.00 0.00 175.55 176.20 2cpu s ARG 343 N -2.38 4.15 0.06 -3.49 0.52 0.74 -4.80 118.95 113.75 2cpu s ARG 343 Ca 0.14 0.83 -0.00 0.00 -0.52 0.00 0.00 55.73 56.18 2cpu s ARG 343 Cb -0.08 -2.57 -0.04 0.00 0.52 0.00 0.00 34.95 32.78 2cpu s ARG 343 CO 0.07 0.22 -0.04 1.67 0.02 0.00 0.00 175.30 177.24 2cpu s TRP 344 N -1.83 0.56 -0.96 -0.53 -2.14 -1.26 -4.81 118.94 107.97 2cpu s TRP 344 Ca 0.51 -0.96 -0.24 0.00 2.66 0.00 0.00 56.10 58.07 2cpu s TRP 344 Cb -0.13 -0.39 -0.00 0.00 -3.10 0.00 0.00 33.47 29.85 2cpu s TRP 344 CO 0.18 -0.31 1.71 -1.25 -2.66 0.00 0.00 176.95 174.63 2cpu s PRO 345 N -3.56 3.05 0.33 3.25 0.04 -1.26 -4.96 135.00 131.89 2cpu s PRO 345 Ca 0.05 -0.69 -0.29 0.00 0.04 0.00 0.00 61.00 60.11 2cpu s PRO 345 Cb 0.05 -5.21 -0.11 0.00 0.04 0.00 0.00 34.50 29.28 2cpu s PRO 345 CO -0.08 -2.82 1.42 1.03 0.04 0.00 0.00 177.00 176.59 2cpu s ARG 346 N 6.04 4.23 -0.34 4.56 0.52 -1.26 -4.64 118.95 128.05 2cpu s ARG 346 Ca 0.59 2.40 0.01 0.00 -0.52 0.00 0.00 55.73 58.20 2cpu s ARG 346 Cb -0.03 -3.03 0.14 0.00 0.52 0.00 0.00 34.95 32.54 2cpu s ARG 346 CO -0.05 -0.40 0.29 -0.65 0.02 0.00 0.00 175.30 174.51 2cpu s GLN 347 N -1.56 0.51 -0.12 3.54 -1.52 -1.26 -5.01 119.66 114.25 2cpu s GLN 347 Ca 0.53 -0.86 -0.30 0.00 -1.95 0.00 0.00 55.36 52.79 2cpu s GLN 347 Cb -0.43 -0.94 -0.01 0.00 -0.22 0.00 0.00 33.01 31.41 2cpu s GLN 347 CO 0.55 -1.16 1.04 -0.06 -0.25 0.00 0.00 175.29 175.41 2cpu s PHE 348 N 1.53 3.44 -0.18 0.91 0.08 -1.26 -1.55 117.98 120.95 2cpu s PHE 348 Ca 0.15 1.52 -0.01 0.00 0.12 0.00 0.00 56.93 58.72 2cpu s PHE 348 Cb -0.18 -3.24 0.05 0.00 -0.57 0.00 0.00 43.02 39.09 2cpu s PHE 348 CO -0.10 -0.43 -0.04 -0.65 -0.10 0.00 0.00 175.22 173.90 2cpu s GLN 349 N 2.22 1.38 -1.41 0.44 -0.21 0.25 -4.74 119.66 117.59 2cpu s GLN 349 Ca 0.49 -0.59 -0.05 0.00 0.02 0.00 0.00 55.36 55.23 2cpu s GLN 349 Cb -0.19 -2.12 0.01 0.00 1.00 0.00 0.00 33.01 31.70 2cpu s GLN 349 CO 0.17 -0.48 0.63 0.09 -2.12 0.00 0.00 175.29 173.57 2cpu n ASN 350 N 4.86 -5.82 0.00 5.90 3.02 -1.26 -1.89 115.26 120.07 2cpu n ASN 350 Ca -0.12 -0.29 0.00 0.00 -0.03 0.00 0.00 54.58 54.14 2cpu n ASN 350 Cb 0.47 -4.61 0.00 0.00 -0.61 0.00 0.00 39.78 35.03 2cpu n ASN 350 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cpu n GLY 351 N -1.52 0.91 3.34 7.41 0.00 -1.26 -5.03 105.19 109.05 2cpu n GLY 351 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 2cpu n GLY 351 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cpu s ASN 352 N -2.99 3.40 -0.50 1.61 2.20 -0.79 -5.04 114.94 112.83 2cpu s ASN 352 Ca 0.00 -0.40 -0.27 0.00 -0.94 0.00 0.00 52.86 51.25 2cpu s ASN 352 Cb 0.00 -0.78 0.03 0.00 -2.00 0.00 0.00 41.25 38.50 2cpu s ASN 352 CO 0.00 0.28 1.06 -0.62 -2.94 0.00 0.00 177.10 174.88 2cpu s ASP 353 N -0.38 6.53 0.00 3.54 2.15 -1.26 0.84 116.67 128.09 2cpu s ASP 353 Ca 0.03 0.22 0.24 0.00 0.43 0.00 0.00 52.55 53.47 2cpu s ASP 353 Cb -0.12 -2.51 1.12 0.00 -0.30 0.00 0.00 42.92 41.11 2cpu s ASP 353 CO 0.02 -1.22 1.78 1.33 -0.17 0.00 0.00 175.17 176.90 2cpu n VAL 354 N 6.63 0.31 -1.24 1.11 0.24 -0.59 -3.01 118.33 121.77 2cpu n VAL 354 Ca 0.09 0.08 -0.04 0.00 -2.04 0.00 0.00 64.34 62.42 2cpu n VAL 354 Cb 0.49 -0.68 0.23 0.00 -1.47 0.00 0.00 33.84 32.41 2cpu n VAL 354 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2cpu n ASN 355 N -1.39 3.41 0.00 -1.34 3.02 -1.26 -4.62 115.26 113.09 2cpu n ASN 355 Ca 0.09 -3.47 0.12 0.00 -0.03 0.00 0.00 54.58 51.28 2cpu n ASN 355 Cb 0.23 -0.66 0.63 0.00 -0.61 0.00 0.00 39.78 39.36 2cpu n ASN 355 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2cpu n ASP 356 N -0.82 0.00 0.09 6.41 5.75 -1.16 -2.83 116.55 123.99 2cpu n ASP 356 Ca 0.36 -0.29 0.09 0.00 -0.01 0.00 0.00 54.79 54.94 2cpu n ASP 356 Cb 1.16 -0.19 -0.02 0.00 -1.03 0.00 0.00 41.12 41.05 2cpu n ASP 356 CO 0.00 0.00 0.00 -2.67 -0.11 0.00 0.00 177.20 174.42 2cpu n TRP 357 N -1.19 0.96 -1.62 2.11 4.27 -1.26 -4.94 117.44 115.77 2cpu n TRP 357 Ca 0.13 0.29 -0.53 0.00 -3.89 0.00 0.00 57.50 53.50 2cpu n TRP 357 Cb 0.15 -0.98 -0.06 0.00 -1.36 0.00 0.00 31.31 29.05 2cpu n TRP 357 CO 0.00 0.00 0.00 0.28 -2.29 0.00 0.00 177.69 175.68 2cpu n VAL 358 N -2.71 0.09 -1.43 -1.67 0.31 -1.13 -2.11 118.33 109.67 2cpu n VAL 358 Ca -0.02 -0.02 -0.13 0.00 -0.01 0.00 0.00 64.34 64.17 2cpu n VAL 358 Cb 0.61 -0.95 0.09 0.00 -0.91 0.00 0.00 33.84 32.67 2cpu n VAL 358 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2cpu n GLY 359 N 2.99 -1.23 3.70 2.92 0.00 -1.23 -4.23 105.19 108.11 2cpu n GLY 359 Ca 0.20 -1.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.20 2cpu n GLY 359 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cpu s PRO 360 N -4.23 1.72 0.20 1.61 0.04 -1.26 -4.88 135.00 128.21 2cpu s PRO 360 Ca 0.32 1.72 -0.32 0.00 0.04 0.00 0.00 61.00 62.76 2cpu s PRO 360 Cb -0.01 -1.79 -0.15 0.00 0.04 0.00 0.00 34.50 32.59 2cpu s PRO 360 CO 0.23 -2.14 1.16 -2.30 0.04 0.00 0.00 177.00 173.99 2cpu n PRO 361 N -3.25 1.31 -3.76 0.56 -0.02 -1.26 -4.86 135.00 123.72 2cpu n PRO 361 Ca 0.13 0.46 -0.09 0.00 -2.02 0.00 0.00 63.50 61.99 2cpu n PRO 361 Cb 0.51 -1.95 -0.03 0.00 -0.02 0.00 0.00 33.50 32.00 2cpu n PRO 361 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2cpu s ASN 362 N -0.08 -0.30 -0.31 2.55 2.20 -1.26 -0.92 114.94 116.82 2cpu s ASN 362 Ca 0.70 -0.49 0.03 0.00 -0.94 0.00 0.00 52.86 52.15 2cpu s ASN 362 Cb -0.80 0.66 0.09 0.00 -2.00 0.00 0.00 41.25 39.20 2cpu s ASN 362 CO 0.53 -1.19 0.01 0.20 -2.94 0.00 0.00 177.10 173.72 2cpu s ASN 363 N -2.89 4.51 -1.59 3.54 0.02 0.09 -4.71 114.94 113.92 2cpu s ASN 363 Ca 0.10 -1.83 -0.00 0.00 -1.02 0.00 0.00 52.86 50.11 2cpu s ASN 363 Cb -0.03 -1.46 0.00 0.00 0.02 0.00 0.00 41.25 39.77 2cpu s ASN 363 CO 0.01 -0.33 0.00 0.59 0.02 0.00 0.00 177.10 177.39 2cpu n ASN 364 N 4.41 -5.38 0.00 -1.22 3.02 -1.26 -1.65 115.26 113.18 2cpu n ASN 364 Ca -0.02 -0.02 0.00 0.00 -0.03 0.00 0.00 54.58 54.51 2cpu n ASN 364 Cb 0.42 -4.44 0.00 0.00 -0.61 0.00 0.00 39.78 35.16 2cpu n ASN 364 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cpu n GLY 365 N -1.02 2.19 3.60 7.41 0.00 -1.26 -5.03 105.19 111.08 2cpu n GLY 365 Ca -0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 2cpu n GLY 365 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cpu s VAL 366 N -2.49 4.68 0.22 1.61 1.01 -0.66 -5.00 120.40 119.77 2cpu s VAL 366 Ca 0.00 1.11 -0.32 0.00 0.00 0.00 0.00 61.98 62.77 2cpu s VAL 366 Cb 0.00 -4.25 -0.13 0.00 0.00 0.00 0.00 36.38 32.00 2cpu s VAL 366 CO 0.00 -0.43 1.47 -0.38 0.00 0.00 0.00 175.10 175.76 2cpu n ILE 367 N 5.80 0.65 -2.37 2.22 5.41 -1.26 -0.73 119.36 129.08 2cpu n ILE 367 Ca 0.05 -0.16 -0.34 0.00 1.00 0.00 0.00 62.75 63.30 2cpu n ILE 367 Cb 0.48 -1.50 -0.02 0.00 -0.71 0.00 0.00 39.64 37.89 2cpu n ILE 367 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 2cpu s LYS 368 N -0.00 3.61 0.53 0.38 1.02 -0.10 -4.85 119.74 120.33 2cpu s LYS 368 Ca 0.71 1.35 -0.18 0.00 0.02 0.00 0.00 55.97 57.87 2cpu s LYS 368 Cb -0.66 -2.07 -0.07 0.00 -0.52 0.00 0.00 37.83 34.52 2cpu s LYS 368 CO 0.46 -0.59 1.03 -1.83 -0.92 0.00 0.00 175.35 173.50 2cpu s GLU 369 N -3.48 3.68 -0.44 1.68 1.03 -1.26 -4.89 118.70 115.02 2cpu s GLU 369 Ca 0.67 1.20 -0.27 0.00 0.03 0.00 0.00 54.97 56.60 2cpu s GLU 369 Cb -0.17 -2.08 0.03 0.00 -0.80 0.00 0.00 34.13 31.10 2cpu s GLU 369 CO 0.25 -0.52 1.02 0.08 -1.33 0.00 0.00 175.26 174.77 2cpu s VAL 370 N -2.31 4.39 0.04 1.83 1.01 -1.26 -4.75 120.40 119.35 2cpu s VAL 370 Ca 0.64 1.08 -0.08 0.00 0.00 0.00 0.00 61.98 63.62 2cpu s VAL 370 Cb -0.14 -4.48 -0.05 0.00 0.00 0.00 0.00 36.38 31.70 2cpu s VAL 370 CO 0.28 -0.82 0.33 0.42 0.00 0.00 0.00 175.10 175.31 2cpu s THR 371 N 3.97 5.20 -0.17 3.92 -4.23 -1.26 -4.96 115.64 118.11 2cpu s THR 371 Ca 0.42 0.31 -0.04 0.00 -1.18 0.00 0.00 61.69 61.20 2cpu s THR 371 Cb -0.09 -3.60 -0.03 0.00 1.34 0.00 0.00 72.50 70.11 2cpu s THR 371 CO 0.26 0.34 -0.02 -0.63 -0.54 0.00 0.00 174.62 174.04 2cpu s ILE 372 N -1.33 3.98 0.58 2.99 -1.09 -1.26 -0.82 121.20 124.26 2cpu s ILE 372 Ca 0.30 -0.32 -0.09 0.00 -2.23 0.00 0.00 60.65 58.31 2cpu s ILE 372 Cb -0.14 -2.77 -0.03 0.00 -1.58 0.00 0.00 42.46 37.94 2cpu s ILE 372 CO 0.17 0.47 0.95 0.20 -1.23 0.00 0.00 174.94 175.50 2cpu s ASN 373 N 0.60 6.10 0.60 3.58 0.01 0.12 -4.94 114.94 121.02 2cpu s ASN 373 Ca -0.01 1.18 0.29 0.00 -0.71 0.00 0.00 52.86 53.61 2cpu s ASN 373 Cb -0.14 -2.28 1.60 0.00 0.41 0.00 0.00 41.25 40.84 2cpu s ASN 373 CO 0.02 -0.85 2.02 1.55 -1.51 0.00 0.00 177.10 178.33 2cpu h PRO 374 N -0.18 0.00 -0.22 -0.60 0.13 -1.99 0.14 132.00 129.28 2cpu h PRO 374 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2cpu h PRO 374 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2cpu h PRO 374 CO 0.62 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.99 2cpu n ASP 375 N -3.69 2.15 0.00 1.44 5.68 -1.26 -4.91 116.55 115.95 2cpu n ASP 375 Ca 0.04 -1.79 0.00 0.00 -0.50 0.00 0.00 54.79 52.54 2cpu n ASP 375 Cb 0.45 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.29 2cpu n ASP 375 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 2cpu n THR 376 N 0.64 0.00 -1.64 2.12 -2.24 0.48 -5.05 114.28 108.60 2cpu n THR 376 Ca 0.17 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.66 2cpu n THR 376 Cb 0.40 0.00 0.14 0.00 -2.10 0.00 0.00 70.33 68.77 2cpu n THR 376 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2cpu s THR 377 N -2.98 1.98 0.22 4.28 -4.23 -1.26 -4.68 115.64 108.98 2cpu s THR 377 Ca 0.00 0.00 0.06 0.00 -1.18 0.00 0.00 61.69 60.57 2cpu s THR 377 Cb 0.00 -2.82 -0.04 0.00 1.34 0.00 0.00 72.50 70.98 2cpu s THR 377 CO 0.00 0.00 0.18 0.00 -0.54 0.00 0.00 174.62 174.26 2cpu n GLY 379 N -0.91 4.17 2.41 0.00 0.00 0.00 -4.71 105.19 106.16 2cpu n GLY 379 Ca -0.08 -2.18 -0.15 0.00 0.00 0.00 0.00 46.02 43.61 2cpu n GLY 379 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2cpu n ASN 380 N -1.16 -4.76 0.00 1.61 3.02 -1.26 -2.72 115.26 109.99 2cpu n ASN 380 Ca 0.00 0.32 0.00 0.00 -0.03 0.00 0.00 54.58 54.87 2cpu n ASN 380 Cb 0.00 -3.62 0.00 0.00 -0.61 0.00 0.00 39.78 35.55 2cpu n ASN 380 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2cpu n ASP 381 N -0.47 -1.21 -4.71 6.41 10.43 -1.26 -4.68 116.55 121.06 2cpu n ASP 381 Ca -0.15 0.00 -0.42 0.00 2.57 0.00 0.00 54.79 56.79 2cpu n ASP 381 Cb 0.51 -0.20 -0.03 0.00 1.84 0.00 0.00 41.12 43.24 2cpu n ASP 381 CO 0.00 0.00 0.00 0.26 -1.07 0.00 0.00 177.20 176.39 2cpu s TRP 382 N -2.90 3.59 0.08 1.24 0.52 -1.10 -0.18 118.94 120.19 2cpu s TRP 382 Ca 0.00 1.57 -0.07 0.00 0.02 0.00 0.00 56.10 57.62 2cpu s TRP 382 Cb 0.00 -3.22 -0.25 0.00 -1.15 0.00 0.00 33.47 28.85 2cpu s TRP 382 CO 0.00 -0.44 1.16 0.28 0.02 0.00 0.00 176.95 177.97 2cpu h VAL 383 N 4.64 1.42 -6.22 4.03 2.07 -0.30 -3.41 116.25 118.47 2cpu h VAL 383 Ca -0.41 -2.79 -0.43 0.00 0.82 0.00 0.00 66.70 63.88 2cpu h VAL 383 Cb 1.22 2.80 0.07 0.00 -1.52 0.00 0.00 31.29 33.86 2cpu h VAL 383 CO 0.77 0.83 -0.93 0.00 0.02 0.00 0.00 177.57 178.26 2cpu h GLU 385 N -1.87 0.00 0.00 0.00 3.07 -1.88 -1.02 114.58 112.89 2cpu h GLU 385 Ca -0.66 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.20 2cpu h GLU 385 Cb 1.36 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.27 2cpu h GLU 385 CO 0.50 0.07 0.00 -2.39 -1.40 0.00 0.00 179.01 175.79 2cpu n HIS 386 N -4.11 0.44 1.01 4.33 1.44 -1.26 -1.67 115.22 115.41 2cpu n HIS 386 Ca -0.03 0.18 0.11 0.00 -2.01 0.00 0.00 57.72 55.97 2cpu n HIS 386 Cb 0.16 -0.79 0.03 0.00 0.12 0.00 0.00 29.99 29.50 2cpu n HIS 386 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2cpu n ARG 387 N -1.90 1.31 -2.12 -1.40 1.74 -0.39 -4.14 116.66 109.76 2cpu n ARG 387 Ca 0.02 -1.07 -0.42 0.00 -0.77 0.00 0.00 57.85 55.61 2cpu n ARG 387 Cb 0.17 -1.48 -0.03 0.00 -1.02 0.00 0.00 32.46 30.11 2cpu n ARG 387 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2cpu s TRP 388 N -2.43 3.19 0.23 -1.55 0.52 -0.67 -4.82 118.94 113.41 2cpu s TRP 388 Ca 0.20 0.94 -0.09 0.00 0.02 0.00 0.00 56.10 57.17 2cpu s TRP 388 Cb 0.18 -3.73 0.36 0.00 -1.15 0.00 0.00 33.47 29.14 2cpu s TRP 388 CO 0.54 -2.53 1.66 -0.09 0.02 0.00 0.00 176.95 176.55 2cpu h ARG 389 N 6.43 0.14 -0.48 4.98 2.43 -1.91 0.38 114.38 126.35 2cpu h ARG 389 Ca -0.43 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 58.72 2cpu h ARG 389 Cb 1.21 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.70 2cpu h ARG 389 CO 0.85 0.09 0.27 1.96 -1.51 0.00 0.00 179.97 181.63 2cpu h GLN 390 N 0.14 0.66 0.04 0.20 7.50 -1.81 0.22 115.11 122.05 2cpu h GLN 390 Ca 0.36 -0.06 -0.15 0.00 0.50 0.00 0.00 58.65 59.30 2cpu h GLN 390 Cb 0.61 -0.14 -0.01 0.00 0.05 0.00 0.00 27.48 27.99 2cpu h GLN 390 CO -0.56 0.48 -0.80 0.82 -1.50 0.00 0.00 178.83 177.28 2cpu h ILE 391 N 0.67 1.31 -0.85 2.54 2.04 -1.44 -3.12 117.51 118.66 2cpu h ILE 391 Ca 0.17 -2.32 0.07 0.00 1.00 0.00 0.00 64.86 63.78 2cpu h ILE 391 Cb 0.01 2.84 -0.06 0.00 -0.74 0.00 0.00 36.82 38.87 2cpu h ILE 391 CO -0.03 0.54 0.52 -0.09 0.00 0.00 0.00 178.15 179.10 2cpu h ARG 392 N -0.79 0.90 0.00 2.37 1.12 -0.22 -0.96 114.38 116.81 2cpu h ARG 392 Ca -0.19 -0.05 -0.07 0.00 -1.11 0.00 0.00 59.98 58.55 2cpu h ARG 392 Cb 1.33 -0.20 -0.01 0.00 -0.01 0.00 0.00 29.97 31.07 2cpu h ARG 392 CO -0.04 0.60 -0.32 -0.91 -3.11 0.00 0.00 179.97 176.19 2cpu h ASN 393 N 0.93 0.00 1.31 -3.80 2.35 -0.70 -2.50 115.58 113.17 2cpu h ASN 393 Ca 0.38 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.99 2cpu h ASN 393 Cb 0.22 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 2cpu h ASN 393 CO -0.19 0.32 -0.66 0.24 -1.65 0.00 0.00 177.43 175.49 2cpu h MET 394 N 0.00 0.00 -0.60 0.81 2.86 -1.16 -1.17 114.93 115.67 2cpu h MET 394 Ca -0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 2cpu h MET 394 Cb 0.77 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.40 2cpu h MET 394 CO 0.04 0.66 0.26 0.28 1.06 0.00 0.00 176.91 179.21 2cpu h VAL 395 N 0.00 1.22 -0.40 -2.22 2.07 -0.81 -1.65 116.25 114.46 2cpu h VAL 395 Ca -0.01 -0.66 -0.10 0.00 0.82 0.00 0.00 66.70 66.76 2cpu h VAL 395 Cb 1.49 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.79 2cpu h VAL 395 CO 0.09 0.26 -0.14 0.40 0.02 0.00 0.00 177.57 178.20 2cpu h ILE 396 N 0.82 1.28 -0.69 4.57 2.04 -1.38 -2.85 117.51 121.30 2cpu h ILE 396 Ca 0.20 -1.26 0.13 0.00 1.00 0.00 0.00 64.86 64.94 2cpu h ILE 396 Cb 0.16 1.25 -0.09 0.00 -0.74 0.00 0.00 36.82 37.40 2cpu h ILE 396 CO -0.02 0.42 0.22 0.15 0.00 0.00 0.00 178.15 178.92 2cpu h PHE 397 N 0.62 0.37 -0.52 1.37 3.04 -0.93 -0.87 116.94 120.01 2cpu h PHE 397 Ca 0.10 0.04 -0.05 0.00 3.98 0.00 0.00 57.97 62.03 2cpu h PHE 397 Cb 0.68 -0.06 -0.02 0.00 2.56 0.00 0.00 35.95 39.11 2cpu h PHE 397 CO 0.05 0.01 0.12 -0.09 -2.02 0.00 0.00 178.31 176.38 2cpu h ARG 398 N 0.35 0.79 -0.10 1.11 2.43 -1.12 -1.88 114.38 115.97 2cpu h ARG 398 Ca 0.38 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 2cpu h ARG 398 Cb 0.58 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2cpu h ARG 398 CO -0.42 0.72 0.03 -0.91 -1.51 0.00 0.00 179.97 177.89 2cpu h ASN 399 N 0.76 0.15 -0.18 -3.80 2.35 -1.00 -1.77 115.58 112.09 2cpu h ASN 399 Ca 0.17 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.67 2cpu h ASN 399 Cb 0.30 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 2cpu h ASN 399 CO -0.00 0.33 0.04 0.58 -1.65 0.00 0.00 177.43 176.73 2cpu h VAL 400 N -0.03 1.15 -0.30 2.81 2.07 -0.96 -2.83 116.25 118.15 2cpu h VAL 400 Ca 0.03 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 67.01 2cpu h VAL 400 Cb 0.23 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2cpu h VAL 400 CO -0.00 0.19 0.00 1.33 0.02 0.00 0.00 177.57 179.11 2cpu n VAL 401 N -4.36 0.41 -1.58 2.57 0.24 -0.73 -4.96 118.33 109.92 2cpu n VAL 401 Ca 0.01 -0.70 -0.56 0.00 -2.04 0.00 0.00 64.34 61.05 2cpu n VAL 401 Cb 0.18 1.07 -0.07 0.00 -1.47 0.00 0.00 33.84 33.56 2cpu n VAL 401 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 2cpu n ASP 402 N 1.38 1.21 0.00 -1.34 2.03 -0.67 -0.88 116.55 118.28 2cpu n ASP 402 Ca 0.17 1.13 0.00 0.00 0.52 0.00 0.00 54.79 56.61 2cpu n ASP 402 Cb 0.58 -1.09 0.00 0.00 -0.72 0.00 0.00 41.12 39.89 2cpu n ASP 402 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2cpu n GLY 403 N 2.47 2.56 3.76 0.27 0.00 -1.26 -5.03 105.19 107.96 2cpu n GLY 403 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 2cpu n GLY 403 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2cpu s GLN 404 N -0.44 4.66 0.79 1.61 -1.52 -0.06 -5.03 119.66 119.68 2cpu s GLN 404 Ca 0.00 1.59 -0.11 0.00 -1.95 0.00 0.00 55.36 54.89 2cpu s GLN 404 Cb 0.00 -3.10 0.07 0.00 -0.22 0.00 0.00 33.01 29.76 2cpu s GLN 404 CO 0.00 0.30 1.09 -1.25 -0.25 0.00 0.00 175.29 175.17 2cpu s PRO 405 N -1.54 2.10 -0.27 2.91 0.04 -1.26 -4.58 135.00 132.40 2cpu s PRO 405 Ca 0.45 0.96 -0.28 0.00 0.04 0.00 0.00 61.00 62.17 2cpu s PRO 405 Cb -0.27 -1.89 0.01 0.00 0.04 0.00 0.00 34.50 32.39 2cpu s PRO 405 CO 0.34 -1.69 1.00 0.12 0.04 0.00 0.00 177.00 176.80 2cpu s PHE 406 N -2.98 3.27 0.31 0.56 2.19 -1.26 -1.08 117.98 119.00 2cpu s PHE 406 Ca 0.61 1.28 -0.00 0.00 0.33 0.00 0.00 56.93 59.14 2cpu s PHE 406 Cb -0.16 -3.36 0.00 0.00 -1.31 0.00 0.00 43.02 38.19 2cpu s PHE 406 CO 0.56 -0.56 0.42 0.25 1.83 0.00 0.00 175.22 177.71 2cpu n THR 407 N 5.49 0.00 -4.14 0.12 -2.24 -0.14 -4.94 114.28 108.44 2cpu n THR 407 Ca 0.10 -1.70 -0.31 0.00 -2.27 0.00 0.00 64.05 59.88 2cpu n THR 407 Cb 0.47 1.01 -0.04 0.00 -2.10 0.00 0.00 70.33 69.67 2cpu n THR 407 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2cpu n ASN 408 N -1.69 -1.33 -4.77 3.42 3.02 -1.26 0.46 115.26 113.10 2cpu n ASN 408 Ca 0.02 -1.06 -0.40 0.00 -0.03 0.00 0.00 54.58 53.10 2cpu n ASN 408 Cb 0.53 -2.66 -0.02 0.00 -0.61 0.00 0.00 39.78 37.02 2cpu n ASN 408 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 2cpu s TRP 409 N -3.74 3.12 -0.01 3.10 -0.11 -1.26 -4.09 118.94 115.95 2cpu s TRP 409 Ca 0.32 1.47 -0.03 0.00 1.22 0.00 0.00 56.10 59.08 2cpu s TRP 409 Cb -0.18 -3.60 0.00 0.00 -1.50 0.00 0.00 33.47 28.19 2cpu s TRP 409 CO 0.93 -1.64 0.06 -0.47 -4.62 0.00 0.00 176.95 171.21 2cpu s TYR 410 N -1.17 0.00 0.02 5.86 6.14 0.17 -4.96 117.35 123.41 2cpu s TYR 410 Ca 0.49 0.01 -0.21 0.00 0.64 0.00 0.00 57.07 58.00 2cpu s TYR 410 Cb -0.38 -0.02 0.04 0.00 0.42 0.00 0.00 41.96 42.02 2cpu s TYR 410 CO 0.50 -0.11 0.47 0.16 0.64 0.00 0.00 175.55 177.22 2cpu s ASP 411 N -0.46 -0.38 -0.13 4.32 1.47 -1.26 -0.44 116.67 119.79 2cpu s ASP 411 Ca -0.05 0.19 0.14 0.00 1.18 0.00 0.00 52.55 54.00 2cpu s ASP 411 Cb -0.03 0.44 0.62 0.00 -0.34 0.00 0.00 42.92 43.61 2cpu s ASP 411 CO 0.00 -0.63 1.49 -0.46 0.68 0.00 0.00 175.17 176.25 2cpu n ASN 412 N 0.67 4.31 0.00 2.11 6.94 0.35 -4.86 115.26 124.78 2cpu n ASN 412 Ca -0.19 -2.50 0.00 0.00 -0.02 0.00 0.00 54.58 51.87 2cpu n ASN 412 Cb 0.59 -0.57 0.00 0.00 -2.36 0.00 0.00 39.78 37.44 2cpu n ASN 412 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2cpu n GLY 413 N 0.83 0.93 0.00 4.83 0.00 -1.26 -4.87 105.19 105.65 2cpu n GLY 413 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2cpu n GLY 413 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2cpu n SER 414 N -0.00 0.00 -0.31 1.61 2.88 -1.26 -4.89 113.62 111.65 2cpu n SER 414 Ca 0.00 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 2cpu n SER 414 Cb 0.00 0.00 0.13 0.00 -0.75 0.00 0.00 64.21 63.59 2cpu n SER 414 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2cpu n ASN 415 N 0.00 1.85 -4.13 -3.46 4.13 -1.26 -1.39 115.26 111.00 2cpu n ASN 415 Ca 0.00 -3.09 -0.34 0.00 1.68 0.00 0.00 54.58 52.83 2cpu n ASN 415 Cb 0.00 -0.42 -0.14 0.00 -1.54 0.00 0.00 39.78 37.68 2cpu n ASN 415 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 2cpu s GLN 416 N -2.46 2.22 0.16 3.52 -0.21 -1.26 -0.87 119.66 120.75 2cpu s GLN 416 Ca 0.29 -1.43 0.03 0.00 0.02 0.00 0.00 55.36 54.27 2cpu s GLN 416 Cb 0.27 -3.18 -0.05 0.00 1.00 0.00 0.00 33.01 31.06 2cpu s GLN 416 CO -0.01 -0.71 -0.05 0.14 -2.12 0.00 0.00 175.29 172.54 2cpu s VAL 417 N 1.16 0.93 0.06 1.09 -7.23 -0.98 -0.50 120.40 114.94 2cpu s VAL 417 Ca -0.02 -2.01 -0.23 0.00 -1.81 0.00 0.00 61.98 57.90 2cpu s VAL 417 Cb -0.20 -1.98 0.06 0.00 0.56 0.00 0.00 36.38 34.81 2cpu s VAL 417 CO -0.03 -0.62 0.54 0.00 -0.31 0.00 0.00 175.10 174.68 2cpu s ALA 418 N -3.48 -1.40 0.08 1.32 0.00 0.41 -0.31 121.76 118.37 2cpu s ALA 418 Ca 0.20 0.62 -0.26 0.00 0.00 0.00 0.00 51.96 52.51 2cpu s ALA 418 Cb 0.05 0.45 0.08 0.00 0.00 0.00 0.00 23.12 23.70 2cpu s ALA 418 CO 0.02 -0.55 0.82 -0.59 0.00 0.00 0.00 175.76 175.46 2cpu s PHE 419 N -2.63 -0.35 0.40 0.00 -0.12 -0.71 0.42 117.98 115.00 2cpu s PHE 419 Ca -0.04 0.15 0.05 0.00 -0.05 0.00 0.00 56.93 57.04 2cpu s PHE 419 Cb -0.00 0.57 -0.06 0.00 -0.63 0.00 0.00 43.02 42.89 2cpu s PHE 419 CO -0.03 -0.70 0.03 0.20 -0.05 0.00 0.00 175.22 174.67 2cpu s GLY 420 N -2.65 2.47 -0.45 1.99 0.00 0.17 -1.40 107.32 107.45 2cpu s GLY 420 Ca 0.06 -1.90 0.04 0.00 0.00 0.00 0.00 44.72 42.91 2cpu s GLY 420 CO -0.07 -2.02 0.19 0.50 0.00 0.00 0.00 173.10 171.69 2cpu s ARG 421 N -3.78 1.76 4.94 2.90 1.81 0.23 -0.97 118.95 125.83 2cpu s ARG 421 Ca 0.31 -2.33 0.00 0.00 -1.72 0.00 0.00 55.73 51.99 2cpu s ARG 421 Cb 0.08 -3.22 0.00 0.00 -0.45 0.00 0.00 34.95 31.36 2cpu s ARG 421 CO 0.15 -1.05 0.00 0.41 -0.68 0.00 0.00 175.30 174.13 2cpu n GLY 422 N 3.53 2.84 1.04 -3.53 0.00 -0.24 -1.78 105.19 107.06 2cpu n GLY 422 Ca 0.05 -0.23 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 2cpu n GLY 422 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2cpu n ASN 423 N 1.64 2.57 -0.00 1.61 6.94 -1.26 -4.49 115.26 122.27 2cpu n ASN 423 Ca 0.00 -3.67 0.05 0.00 -0.02 0.00 0.00 54.58 50.93 2cpu n ASN 423 Cb 0.00 -0.61 -0.07 0.00 -2.36 0.00 0.00 39.78 36.74 2cpu n ASN 423 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2cpu n ARG 424 N -1.07 0.96 -3.49 -3.83 5.12 -0.73 -4.56 116.66 109.06 2cpu n ARG 424 Ca 0.30 -0.07 -0.13 0.00 -1.93 0.00 0.00 57.85 56.02 2cpu n ARG 424 Cb 0.98 -1.16 -0.04 0.00 -1.16 0.00 0.00 32.46 31.08 2cpu n ARG 424 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 2cpu s GLY 425 N -2.84 -0.54 -0.10 -0.13 0.00 -1.08 -0.42 107.32 102.22 2cpu s GLY 425 Ca -0.02 1.06 -0.08 0.00 0.00 0.00 0.00 44.72 45.68 2cpu s GLY 425 CO 0.38 0.58 0.25 -0.12 0.00 0.00 0.00 173.10 174.19 2cpu s PHE 426 N -2.42 -0.30 0.00 1.90 5.36 -0.32 -0.60 117.98 121.60 2cpu s PHE 426 Ca -0.03 0.72 0.03 0.00 -0.96 0.00 0.00 56.93 56.69 2cpu s PHE 426 Cb -0.01 0.08 -0.01 0.00 -0.34 0.00 0.00 43.02 42.75 2cpu s PHE 426 CO -0.02 -0.17 -0.09 -1.50 -1.46 0.00 0.00 175.22 171.98 2cpu s ILE 427 N 0.52 0.68 -0.03 3.12 2.07 -0.49 -1.37 121.20 125.70 2cpu s ILE 427 Ca -0.03 -0.49 0.03 0.00 -1.41 0.00 0.00 60.65 58.74 2cpu s ILE 427 Cb -0.05 -0.60 0.00 0.00 0.13 0.00 0.00 42.46 41.95 2cpu s ILE 427 CO -0.03 0.11 -0.10 -0.69 -1.91 0.00 0.00 174.94 172.31 2cpu s VAL 428 N -0.38 0.90 0.02 4.00 1.01 0.18 -1.73 120.40 124.39 2cpu s VAL 428 Ca 0.02 -0.41 0.07 0.00 0.00 0.00 0.00 61.98 61.65 2cpu s VAL 428 Cb -0.04 -0.80 -0.02 0.00 0.00 0.00 0.00 36.38 35.51 2cpu s VAL 428 CO -0.00 0.28 -0.20 -0.36 0.00 0.00 0.00 175.10 174.82 2cpu s PHE 429 N 0.27 1.73 -0.31 5.22 0.40 0.58 -0.74 117.98 125.13 2cpu s PHE 429 Ca -0.05 -0.35 0.00 0.00 -0.60 0.00 0.00 56.93 55.93 2cpu s PHE 429 Cb -0.10 -1.06 0.10 0.00 0.51 0.00 0.00 43.02 42.46 2cpu s PHE 429 CO 0.01 0.04 0.08 1.21 0.70 0.00 0.00 175.22 177.26 2cpu s ASN 430 N -0.86 4.12 -0.15 1.36 2.47 0.33 -2.31 114.94 119.90 2cpu s ASN 430 Ca 0.07 -1.68 0.18 0.00 0.42 0.00 0.00 52.86 51.84 2cpu s ASN 430 Cb -0.08 -1.01 0.42 0.00 -1.45 0.00 0.00 41.25 39.12 2cpu s ASN 430 CO 0.01 -0.40 1.29 -3.20 -3.72 0.00 0.00 177.10 171.08 2cpu n ASN 431 N 4.73 3.16 -4.94 -4.21 5.15 -0.05 -4.74 115.26 114.36 2cpu n ASN 431 Ca -0.02 -3.04 -0.24 0.00 -0.60 0.00 0.00 54.58 50.68 2cpu n ASN 431 Cb 0.42 -0.49 0.04 0.00 -0.53 0.00 0.00 39.78 39.22 2cpu n ASN 431 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 2cpu s ASP 432 N -2.35 5.41 -0.17 1.20 1.01 -1.25 -4.83 116.67 115.68 2cpu s ASP 432 Ca 0.37 0.40 0.05 0.00 0.71 0.00 0.00 52.55 54.07 2cpu s ASP 432 Cb 0.31 -1.35 0.38 0.00 1.01 0.00 0.00 42.92 43.27 2cpu s ASP 432 CO 0.06 -1.11 1.28 0.47 0.21 0.00 0.00 175.17 176.07 2cpu n ASP 433 N -2.49 3.37 -3.97 0.27 8.00 -1.26 -4.73 116.55 115.75 2cpu n ASP 433 Ca 0.05 -2.62 -0.13 0.00 0.71 0.00 0.00 54.79 52.81 2cpu n ASP 433 Cb 0.59 -0.63 -0.09 0.00 -0.02 0.00 0.00 41.12 40.97 2cpu n ASP 433 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 2cpu s TRP 434 N -1.77 1.14 0.46 1.24 -2.14 -1.26 -4.95 118.94 111.66 2cpu s TRP 434 Ca 0.28 -1.33 -0.17 0.00 2.66 0.00 0.00 56.10 57.54 2cpu s TRP 434 Cb 0.22 -0.45 -0.09 0.00 -3.10 0.00 0.00 33.47 30.06 2cpu s TRP 434 CO 0.07 -0.76 0.93 -1.12 -2.66 0.00 0.00 176.95 173.41 2cpu s SER 435 N -3.18 6.71 -0.16 -2.66 0.01 -1.26 -3.98 113.70 109.18 2cpu s SER 435 Ca 0.36 1.53 -0.04 0.00 1.31 0.00 0.00 55.95 59.12 2cpu s SER 435 Cb 0.05 -2.48 -0.03 0.00 0.21 0.00 0.00 66.02 63.77 2cpu s SER 435 CO 0.15 -0.47 -0.04 0.12 0.41 0.00 0.00 173.24 173.41 2cpu s PHE 436 N -2.42 3.02 -0.29 2.43 2.19 0.80 -4.97 117.98 118.74 2cpu s PHE 436 Ca 0.58 -0.32 0.01 0.00 0.33 0.00 0.00 56.93 57.53 2cpu s PHE 436 Cb -0.10 -1.97 0.15 0.00 -1.31 0.00 0.00 43.02 39.80 2cpu s PHE 436 CO 0.25 -0.06 0.35 0.45 1.83 0.00 0.00 175.22 178.05 2cpu s SER 437 N 0.42 1.01 -0.01 6.13 0.15 -1.25 -0.67 113.70 119.48 2cpu s SER 437 Ca -0.04 -0.57 -0.25 0.00 0.70 0.00 0.00 55.95 55.79 2cpu s SER 437 Cb -0.14 0.82 0.06 0.00 -1.71 0.00 0.00 66.02 65.04 2cpu s SER 437 CO 0.03 -0.37 0.56 -0.22 1.20 0.00 0.00 173.24 174.44 2cpu s LEU 438 N 2.46 -0.21 -0.25 3.45 2.96 -0.17 -4.98 118.68 121.94 2cpu s LEU 438 Ca 0.09 0.42 -0.18 0.00 -0.22 0.00 0.00 54.13 54.24 2cpu s LEU 438 Cb -0.13 2.19 -0.03 0.00 0.50 0.00 0.00 46.19 48.72 2cpu s LEU 438 CO -0.32 -0.62 0.53 -0.89 -1.32 0.00 0.00 176.35 173.73 2cpu s THR 439 N -1.67 5.07 0.21 3.68 2.01 -1.26 -0.21 115.64 123.47 2cpu s THR 439 Ca -0.09 0.93 0.10 0.00 0.31 0.00 0.00 61.69 62.94 2cpu s THR 439 Cb -0.01 -3.85 -0.04 0.00 0.01 0.00 0.00 72.50 68.61 2cpu s THR 439 CO 0.05 0.10 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.15 2cpu s LEU 440 N 2.19 2.71 -0.21 4.42 1.02 0.11 -4.86 118.68 124.06 2cpu s LEU 440 Ca 0.22 -0.78 -0.25 0.00 0.02 0.00 0.00 54.13 53.35 2cpu s LEU 440 Cb -0.16 -1.37 -0.01 0.00 0.02 0.00 0.00 46.19 44.67 2cpu s LEU 440 CO 0.09 0.09 0.82 -1.58 0.02 0.00 0.00 176.35 175.79 2cpu s GLN 441 N -2.94 4.24 -0.02 1.70 2.00 -1.26 -0.22 119.66 123.15 2cpu s GLN 441 Ca 0.25 0.97 0.19 0.00 -2.00 0.00 0.00 55.36 54.76 2cpu s GLN 441 Cb -0.08 -3.61 -0.29 0.00 0.80 0.00 0.00 33.01 29.84 2cpu s GLN 441 CO 0.13 -0.42 0.44 0.25 -0.50 0.00 0.00 175.29 175.20 2cpu n THR 442 N 4.98 0.00 -1.04 -0.34 -2.24 -0.47 -4.93 114.28 110.24 2cpu n THR 442 Ca 0.05 -0.41 -0.01 0.00 -2.27 0.00 0.00 64.05 61.41 2cpu n THR 442 Cb 0.48 0.14 -0.01 0.00 -2.10 0.00 0.00 70.33 68.84 2cpu n THR 442 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cpu n GLY 443 N 1.43 0.46 3.90 3.38 0.00 -1.25 -4.79 105.19 108.32 2cpu n GLY 443 Ca -0.03 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 2cpu n GLY 443 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2cpu s LEU 444 N -0.34 4.28 0.51 0.99 1.43 -1.26 -4.14 118.68 120.15 2cpu s LEU 444 Ca 0.00 0.23 -0.22 0.00 -1.03 0.00 0.00 54.13 53.11 2cpu s LEU 444 Cb 0.00 -2.89 -0.06 0.00 0.03 0.00 0.00 46.19 43.27 2cpu s LEU 444 CO 0.00 0.17 1.25 -2.16 0.23 0.00 0.00 176.35 175.84 2cpu s PRO 445 N -2.50 3.42 0.50 1.29 0.04 -1.26 -4.38 135.00 132.10 2cpu s PRO 445 Ca 0.34 1.97 -0.22 0.00 0.04 0.00 0.00 61.00 63.13 2cpu s PRO 445 Cb -0.13 -2.29 -0.08 0.00 0.04 0.00 0.00 34.50 32.04 2cpu s PRO 445 CO 0.27 -0.89 0.94 0.00 0.04 0.00 0.00 177.00 177.37 2cpu n ALA 446 N -0.84 0.06 0.00 8.56 0.00 -1.26 -4.85 120.51 122.18 2cpu n ALA 446 Ca 0.09 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.66 2cpu n ALA 446 Cb 0.47 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.85 2cpu n ALA 446 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cpu n GLY 447 N 1.28 0.34 3.59 0.00 0.00 -0.71 -4.97 105.19 104.72 2cpu n GLY 447 Ca 0.11 -1.60 -0.36 0.00 0.00 0.00 0.00 46.02 44.16 2cpu n GLY 447 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2cpu s THR 448 N -1.57 4.97 0.03 2.61 2.01 -1.26 -0.81 115.64 121.62 2cpu s THR 448 Ca 0.00 0.05 0.07 0.00 0.31 0.00 0.00 61.69 62.12 2cpu s THR 448 Cb 0.00 -3.31 -0.03 0.00 0.01 0.00 0.00 72.50 69.17 2cpu s THR 448 CO 0.00 0.35 -0.20 -0.31 -0.69 0.00 0.00 174.62 173.77 2cpu s TYR 449 N 1.17 2.50 -0.01 4.92 1.51 0.47 0.90 117.35 128.82 2cpu s TYR 449 Ca 0.06 -0.29 -0.22 0.00 -1.01 0.00 0.00 57.07 55.60 2cpu s TYR 449 Cb -0.14 -1.46 -0.05 0.00 -0.11 0.00 0.00 41.96 40.20 2cpu s TYR 449 CO 0.05 0.20 0.65 0.00 -1.11 0.00 0.00 175.55 175.34 2cpu s ASP 451 N 0.05 6.85 0.00 0.00 2.15 0.24 -4.61 116.67 121.34 2cpu s ASP 451 Ca 0.34 2.03 0.29 0.00 0.43 0.00 0.00 52.55 55.64 2cpu s ASP 451 Cb -0.19 -2.55 1.28 0.00 -0.30 0.00 0.00 42.92 41.17 2cpu s ASP 451 CO 0.19 -0.76 1.88 1.33 -0.17 0.00 0.00 175.17 177.63 2cpu n VAL 452 N 4.97 0.00 -0.08 1.11 0.24 -0.02 -2.31 118.33 122.24 2cpu n VAL 452 Ca 0.14 -0.13 -0.19 0.00 -2.04 0.00 0.00 64.34 62.12 2cpu n VAL 452 Cb 0.44 0.10 -0.12 0.00 -1.47 0.00 0.00 33.84 32.79 2cpu n VAL 452 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2cpu h ILE 453 N 1.25 1.24 0.00 1.34 1.08 -1.89 -3.39 117.51 117.15 2cpu h ILE 453 Ca 0.00 -2.26 -0.16 0.00 -0.39 0.00 0.00 64.86 62.05 2cpu h ILE 453 Cb 0.34 2.69 -0.02 0.00 -3.07 0.00 0.00 36.82 36.75 2cpu h ILE 453 CO 0.00 0.46 -0.87 0.77 -0.69 0.00 0.00 178.15 177.82 2cpu h SER 454 N -0.93 0.00 0.00 1.72 4.64 -1.88 -3.40 113.55 113.71 2cpu h SER 454 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 2cpu h SER 454 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2cpu h SER 454 CO -0.11 0.71 0.00 0.61 -0.87 0.00 0.00 176.83 177.17 2cpu n GLY 455 N 1.31 4.11 3.21 -0.77 0.00 -0.98 -4.41 105.19 107.66 2cpu n GLY 455 Ca -0.01 -0.92 -0.09 0.00 0.00 0.00 0.00 46.02 44.99 2cpu n GLY 455 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2cpu s ASP 456 N 1.56 0.22 -0.37 1.61 1.01 -1.26 -4.22 116.67 115.23 2cpu s ASP 456 Ca 0.00 -0.98 -0.21 0.00 0.71 0.00 0.00 52.55 52.08 2cpu s ASP 456 Cb 0.00 0.33 0.01 0.00 1.01 0.00 0.00 42.92 44.27 2cpu s ASP 456 CO 0.00 -0.76 0.66 -0.75 0.21 0.00 0.00 175.17 174.53 2cpu s LYS 457 N -3.97 3.61 -0.26 8.23 2.20 -1.26 -0.71 119.74 127.59 2cpu s LYS 457 Ca 0.16 0.01 0.00 0.00 -0.36 0.00 0.00 55.97 55.78 2cpu s LYS 457 Cb 0.06 -3.84 0.07 0.00 -1.51 0.00 0.00 37.83 32.62 2cpu s LYS 457 CO -0.03 -0.81 0.01 0.42 -0.36 0.00 0.00 175.35 174.59 2cpu s ILE 458 N 2.80 1.26 -0.76 5.43 1.01 0.13 -4.90 121.20 126.16 2cpu s ILE 458 Ca 0.25 -1.26 -0.03 0.00 0.00 0.00 0.00 60.65 59.62 2cpu s ILE 458 Cb -0.14 -1.71 0.00 0.00 0.01 0.00 0.00 42.46 40.62 2cpu s ILE 458 CO 0.16 -0.31 0.64 -0.46 0.00 0.00 0.00 174.94 174.97 2cpu n ASN 459 N 4.74 -6.08 -0.43 3.58 6.94 -1.26 -2.99 115.26 119.77 2cpu n ASN 459 Ca -0.07 -0.55 -0.06 0.00 -0.02 0.00 0.00 54.58 53.88 2cpu n ASN 459 Cb 0.44 -3.14 -0.02 0.00 -2.36 0.00 0.00 39.78 34.69 2cpu n ASN 459 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2cpu n GLY 460 N -1.57 0.72 3.20 4.83 0.00 -1.26 -4.99 105.19 106.11 2cpu n GLY 460 Ca -0.18 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.54 2cpu n GLY 460 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2cpu s ASN 461 N -2.40 0.06 -0.08 1.61 0.01 -1.16 -5.05 114.94 107.93 2cpu s ASN 461 Ca 0.00 -0.51 -0.04 0.00 -0.71 0.00 0.00 52.86 51.60 2cpu s ASN 461 Cb 0.00 0.33 -0.04 0.00 0.41 0.00 0.00 41.25 41.95 2cpu s ASN 461 CO 0.00 -0.67 0.09 0.00 -1.51 0.00 0.00 177.10 175.01 2cpu n THR 463 N 1.83 0.23 -0.64 0.00 -2.24 0.11 -4.94 114.28 108.63 2cpu n THR 463 Ca -0.18 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 2cpu n THR 463 Cb 0.54 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 2cpu n THR 463 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cpu n GLY 464 N 1.36 5.21 3.75 3.38 0.00 -1.26 -4.79 105.19 112.85 2cpu n GLY 464 Ca 0.03 -1.59 -0.36 0.00 0.00 0.00 0.00 46.02 44.09 2cpu n GLY 464 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cpu s ILE 465 N 3.17 2.57 -0.03 -0.61 1.01 -1.26 -4.85 121.20 121.20 2cpu s ILE 465 Ca 0.00 0.37 0.07 0.00 0.00 0.00 0.00 60.65 61.09 2cpu s ILE 465 Cb 0.00 -3.16 -0.02 0.00 0.01 0.00 0.00 42.46 39.29 2cpu s ILE 465 CO 0.00 -0.06 -0.22 -0.54 0.00 0.00 0.00 174.94 174.12 2cpu s LYS 466 N -3.22 2.23 -0.03 2.79 1.02 -1.26 -0.59 119.74 120.68 2cpu s LYS 466 Ca 0.76 -0.86 0.07 0.00 0.02 0.00 0.00 55.97 55.96 2cpu s LYS 466 Cb -0.32 -2.15 -0.02 0.00 -0.52 0.00 0.00 37.83 34.83 2cpu s LYS 466 CO 0.35 0.58 -0.25 0.42 -0.92 0.00 0.00 175.35 175.53 2cpu s ILE 467 N -0.65 2.03 -0.29 2.17 -1.09 0.91 -4.93 121.20 119.36 2cpu s ILE 467 Ca 0.10 -1.08 -0.04 0.00 -2.23 0.00 0.00 60.65 57.40 2cpu s ILE 467 Cb -0.10 -1.70 0.03 0.00 -1.58 0.00 0.00 42.46 39.11 2cpu s ILE 467 CO -0.01 0.57 0.02 -0.31 -1.23 0.00 0.00 174.94 173.98 2cpu s TYR 468 N -0.45 3.16 -0.07 3.97 2.02 -1.26 -0.39 117.35 124.33 2cpu s TYR 468 Ca 0.05 -1.45 -0.16 0.00 -0.37 0.00 0.00 57.07 55.14 2cpu s TYR 468 Cb -0.11 -2.16 -0.05 0.00 -0.40 0.00 0.00 41.96 39.24 2cpu s TYR 468 CO 0.01 -0.70 0.43 0.08 -1.57 0.00 0.00 175.55 173.79 2cpu s VAL 469 N 1.37 5.13 0.67 0.71 1.01 0.01 -4.35 120.40 124.95 2cpu s VAL 469 Ca -0.01 0.86 -0.03 0.00 0.00 0.00 0.00 61.98 62.80 2cpu s VAL 469 Cb -0.18 -3.75 0.07 0.00 0.00 0.00 0.00 36.38 32.52 2cpu s VAL 469 CO -0.01 0.44 0.94 -0.94 0.00 0.00 0.00 175.10 175.54 2cpu s SER 470 N -0.11 4.80 0.45 3.32 1.04 0.24 -1.74 113.70 121.70 2cpu s SER 470 Ca 0.24 0.13 0.20 0.00 0.48 0.00 0.00 55.95 57.00 2cpu s SER 470 Cb -0.16 -0.79 1.15 0.00 0.10 0.00 0.00 66.02 66.33 2cpu s SER 470 CO 0.11 -1.54 1.89 0.44 0.98 0.00 0.00 173.24 175.12 2cpu h ASP 471 N -0.41 0.31 -0.25 7.02 3.32 -1.95 0.39 116.42 124.85 2cpu h ASP 471 Ca -0.42 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.66 2cpu h ASP 471 Cb 1.30 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.81 2cpu h ASP 471 CO 0.53 0.14 0.00 -0.90 -1.72 0.00 0.00 179.24 177.29 2cpu n ASP 472 N -4.46 1.84 0.00 6.45 3.85 -1.26 -4.78 116.55 118.20 2cpu n ASP 472 Ca 0.17 -1.83 0.00 0.00 -0.71 0.00 0.00 54.79 52.42 2cpu n ASP 472 Cb 0.67 -0.16 0.00 0.00 -1.35 0.00 0.00 41.12 40.28 2cpu n ASP 472 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 2cpu n GLY 473 N 1.13 0.98 3.83 6.12 0.00 0.14 -4.86 105.19 112.52 2cpu n GLY 473 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 2cpu n GLY 473 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cpu s LYS 474 N -0.29 4.07 -0.12 1.61 1.02 -1.26 -1.36 119.74 123.40 2cpu s LYS 474 Ca 0.00 1.03 -0.22 0.00 0.02 0.00 0.00 55.97 56.81 2cpu s LYS 474 Cb 0.00 -2.15 0.05 0.00 -0.52 0.00 0.00 37.83 35.21 2cpu s LYS 474 CO 0.00 -0.17 0.54 0.00 -0.92 0.00 0.00 175.35 174.80 2cpu s ALA 475 N -2.42 -1.37 0.00 5.17 0.00 0.69 -0.59 121.76 123.25 2cpu s ALA 475 Ca 0.60 1.24 -0.19 0.00 0.00 0.00 0.00 51.96 53.61 2cpu s ALA 475 Cb -0.10 -0.45 -0.06 0.00 0.00 0.00 0.00 23.12 22.52 2cpu s ALA 475 CO 0.23 -0.29 0.55 -1.58 0.00 0.00 0.00 175.76 174.67 2cpu s HIS 476 N -0.47 3.70 -0.06 0.00 2.46 -1.26 0.08 115.29 119.73 2cpu s HIS 476 Ca -0.06 1.16 0.03 0.00 0.47 0.00 0.00 55.06 56.66 2cpu s HIS 476 Cb -0.03 -2.54 0.01 0.00 -0.13 0.00 0.00 32.58 29.89 2cpu s HIS 476 CO 0.04 0.42 -0.14 -0.06 -2.47 0.00 0.00 174.74 172.53 2cpu s PHE 477 N -0.41 1.58 -0.17 3.88 0.40 0.71 -4.80 117.98 119.17 2cpu s PHE 477 Ca 0.29 -0.55 -0.00 0.00 -0.60 0.00 0.00 56.93 56.08 2cpu s PHE 477 Cb -0.18 -1.12 0.04 0.00 0.51 0.00 0.00 43.02 42.27 2cpu s PHE 477 CO 0.16 -0.25 -0.08 -1.12 0.70 0.00 0.00 175.22 174.64 2cpu s SER 478 N 0.43 2.91 -0.15 1.36 0.01 -1.26 -1.00 113.70 116.00 2cpu s SER 478 Ca -0.11 -0.67 -0.02 0.00 1.31 0.00 0.00 55.95 56.46 2cpu s SER 478 Cb -0.14 -1.03 0.05 0.00 0.21 0.00 0.00 66.02 65.11 2cpu s SER 478 CO 0.04 -0.15 0.01 -0.63 0.41 0.00 0.00 173.24 172.92 2cpu s ILE 479 N 1.56 0.57 0.37 1.44 1.01 0.16 -5.00 121.20 121.30 2cpu s ILE 479 Ca 0.01 -0.36 -0.15 0.00 0.00 0.00 0.00 60.65 60.15 2cpu s ILE 479 Cb -0.15 -0.92 -0.09 0.00 0.01 0.00 0.00 42.46 41.32 2cpu s ILE 479 CO -0.08 -0.01 0.79 -0.94 0.00 0.00 0.00 174.94 174.70 2cpu s SER 480 N 1.86 6.74 0.00 3.58 1.04 -1.26 -0.14 113.70 125.51 2cpu s SER 480 Ca 0.01 1.33 0.10 0.00 0.48 0.00 0.00 55.95 57.88 2cpu s SER 480 Cb -0.15 -2.40 0.53 0.00 0.10 0.00 0.00 66.02 64.10 2cpu s SER 480 CO -0.07 -0.29 1.21 -0.46 0.98 0.00 0.00 173.24 174.61 2cpu n ASN 481 N -0.68 0.00 -0.78 7.02 6.94 -1.26 -1.52 115.26 124.98 2cpu n ASN 481 Ca 0.04 0.11 0.12 0.00 -0.02 0.00 0.00 54.58 54.83 2cpu n ASN 481 Cb 0.53 -0.27 0.18 0.00 -2.36 0.00 0.00 39.78 37.87 2cpu n ASN 481 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2cpu n SER 482 N -1.27 2.51 -4.75 0.53 7.64 -1.26 -4.97 113.62 112.04 2cpu n SER 482 Ca 0.05 -1.80 -0.37 0.00 1.01 0.00 0.00 58.87 57.76 2cpu n SER 482 Cb 0.08 0.06 0.03 0.00 -1.01 0.00 0.00 64.21 63.37 2cpu n SER 482 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2cpu s ALA 483 N -2.08 2.73 0.22 -0.43 0.00 -0.58 -4.91 121.76 116.72 2cpu s ALA 483 Ca 0.29 1.13 -0.08 0.00 0.00 0.00 0.00 51.96 53.30 2cpu s ALA 483 Cb 0.20 -3.49 0.25 0.00 0.00 0.00 0.00 23.12 20.08 2cpu s ALA 483 CO 0.35 -1.17 1.85 1.49 0.00 0.00 0.00 175.76 178.29 2cpu h GLU 484 N 1.34 0.91 -4.33 0.00 4.57 -1.93 -3.35 114.58 111.79 2cpu h GLU 484 Ca -0.50 -0.05 -0.63 0.00 -1.18 0.00 0.00 59.36 56.99 2cpu h GLU 484 Cb 1.29 -0.20 -0.39 0.00 -0.16 0.00 0.00 28.75 29.28 2cpu h GLU 484 CO 0.57 0.60 -0.75 -0.51 -1.18 0.00 0.00 179.01 177.73 2cpu s ASP 485 N -5.78 4.31 0.00 1.04 1.01 -1.26 -4.87 116.67 111.11 2cpu s ASP 485 Ca -0.13 -1.70 0.00 0.00 0.71 0.00 0.00 52.55 51.43 2cpu s ASP 485 Cb 0.17 -1.31 0.00 0.00 1.01 0.00 0.00 42.92 42.79 2cpu s ASP 485 CO 0.78 -0.33 1.19 -0.81 0.21 0.00 0.00 175.17 176.21 2cpu n PRO 486 N 4.53 0.71 -3.72 8.23 -0.04 -1.26 -4.77 135.00 138.68 2cpu n PRO 486 Ca -0.03 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.29 2cpu n PRO 486 Cb 0.43 -1.15 -0.08 0.00 -0.04 0.00 0.00 33.50 32.66 2cpu n PRO 486 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2cpu s PHE 487 N 0.49 -0.25 -0.04 0.54 -0.71 -1.26 -0.51 117.98 116.24 2cpu s PHE 487 Ca 0.00 0.37 0.06 0.00 -1.04 0.00 0.00 56.93 56.32 2cpu s PHE 487 Cb 0.00 0.15 -0.01 0.00 -1.21 0.00 0.00 43.02 41.95 2cpu s PHE 487 CO 0.00 -0.43 -0.22 0.42 -1.34 0.00 0.00 175.22 173.65 2cpu s ILE 488 N -1.40 1.78 -0.03 -4.49 1.01 0.08 -4.82 121.20 113.32 2cpu s ILE 488 Ca -0.13 -0.93 0.01 0.00 0.00 0.00 0.00 60.65 59.61 2cpu s ILE 488 Cb -0.04 -1.50 0.01 0.00 0.01 0.00 0.00 42.46 40.94 2cpu s ILE 488 CO 0.05 0.50 -0.04 0.00 0.00 0.00 0.00 174.94 175.45 2cpu s ALA 489 N -0.21 0.54 0.04 9.38 0.00 -1.26 -0.65 121.76 129.60 2cpu s ALA 489 Ca 0.00 -0.07 0.03 0.00 0.00 0.00 0.00 51.96 51.92 2cpu s ALA 489 Cb -0.12 -0.30 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 2cpu s ALA 489 CO 0.02 0.02 -0.08 0.96 0.00 0.00 0.00 175.76 176.68 2cpu s ILE 490 N 0.59 0.60 0.28 0.00 -4.36 -0.47 -0.84 121.20 117.00 2cpu s ILE 490 Ca -0.07 -1.10 -0.11 0.00 -0.26 0.00 0.00 60.65 59.11 2cpu s ILE 490 Cb -0.11 -0.65 0.00 0.00 1.25 0.00 0.00 42.46 42.95 2cpu s ILE 490 CO -0.00 -0.36 0.52 -1.38 0.24 0.00 0.00 174.94 173.95 2cpu s HIS 491 N -1.36 0.48 0.33 1.37 -3.43 -1.26 -1.18 115.29 110.24 2cpu s HIS 491 Ca -0.09 -0.85 0.11 0.00 -0.80 0.00 0.00 55.06 53.43 2cpu s HIS 491 Cb -0.10 0.21 0.99 0.00 -1.43 0.00 0.00 32.58 32.25 2cpu s HIS 491 CO 0.01 -1.09 1.65 0.00 -2.00 0.00 0.00 174.74 173.30 2cpu h ALA 492 N 2.19 1.75 -0.20 -1.38 0.00 -1.05 0.19 119.26 120.76 2cpu h ALA 492 Ca -0.27 0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2cpu h ALA 492 Cb 1.25 0.23 0.00 0.00 0.00 0.00 0.00 17.79 19.27 2cpu h ALA 492 CO 0.36 -0.57 0.00 0.39 0.00 0.00 0.00 179.25 179.43 2cpu n GLU 493 N -5.13 1.80 -0.13 0.00 -0.58 -1.26 -3.29 120.64 112.05 2cpu n GLU 493 Ca 0.29 -1.21 0.07 0.00 -0.42 0.00 0.00 57.16 55.90 2cpu n GLU 493 Cb 0.91 -1.39 0.14 0.00 -0.57 0.00 0.00 31.44 30.53 2cpu n GLU 493 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2cpu n SER 494 N 0.44 2.80 -4.75 1.62 3.41 0.66 -4.98 113.62 112.81 2cpu n SER 494 Ca 0.16 -1.83 -0.41 0.00 -0.26 0.00 0.00 58.87 56.53 2cpu n SER 494 Cb 0.35 -0.17 -0.04 0.00 -0.26 0.00 0.00 64.21 64.09 2cpu n SER 494 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2cpu s LYS 495 N -1.11 4.53 0.00 4.33 2.47 -1.14 -0.46 119.74 128.37 2cpu s LYS 495 Ca 0.25 1.89 0.31 0.00 -1.56 0.00 0.00 55.97 56.86 2cpu s LYS 495 Cb 0.14 -3.20 1.70 0.00 -1.46 0.00 0.00 37.83 35.02 2cpu s LYS 495 CO 0.20 0.02 2.11 1.28 0.16 0.00 0.00 175.35 179.12