#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dwo s GLU 3 N 0.00 2.51 0.33 3.23 2.12 -1.26 -5.05 118.70 120.57 2dwo s GLU 3 Ca 0.00 -1.69 0.09 0.00 0.36 0.00 0.00 54.97 53.73 2dwo s GLU 3 Cb 0.00 -3.89 -0.05 0.00 0.26 0.00 0.00 34.13 30.46 2dwo s GLU 3 CO 0.00 -1.13 0.06 -0.51 -0.54 0.00 0.00 175.26 173.14 2dwo s LEU 4 N 1.38 3.11 0.04 2.70 1.43 -1.26 -2.44 118.68 123.63 2dwo s LEU 4 Ca 0.05 -0.87 0.04 0.00 -1.03 0.00 0.00 54.13 52.32 2dwo s LEU 4 Cb -0.25 -1.54 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 2dwo s LEU 4 CO -0.00 -0.23 -0.11 0.28 0.23 0.00 0.00 176.35 176.51 2dwo s THR 5 N -2.46 0.87 -0.21 5.49 -1.32 0.76 -4.77 115.64 114.00 2dwo s THR 5 Ca 0.35 -0.95 -0.18 0.00 -1.21 0.00 0.00 61.69 59.70 2dwo s THR 5 Cb -0.02 -0.83 -0.03 0.00 -1.51 0.00 0.00 72.50 70.11 2dwo s THR 5 CO 0.21 -0.11 0.50 -1.58 -2.21 0.00 0.00 174.62 171.43 2dwo s GLN 6 N -1.18 4.18 0.35 7.08 0.74 -1.26 -1.04 119.66 128.52 2dwo s GLN 6 Ca -0.02 0.38 -0.29 0.00 0.05 0.00 0.00 55.36 55.48 2dwo s GLN 6 Cb -0.08 -3.57 -0.11 0.00 1.10 0.00 0.00 33.01 30.35 2dwo s GLN 6 CO 0.01 -0.15 1.53 -1.54 -0.55 0.00 0.00 175.29 174.58 2dwo s SER 7 N 1.18 6.33 0.21 6.67 1.04 -0.10 -4.84 113.70 124.19 2dwo s SER 7 Ca 0.23 3.04 -0.05 0.00 0.48 0.00 0.00 55.95 59.65 2dwo s SER 7 Cb -0.15 -2.66 0.17 0.00 0.10 0.00 0.00 66.02 63.48 2dwo s SER 7 CO 0.09 -0.90 1.64 0.03 0.98 0.00 0.00 173.24 175.08 2dwo h ARG 8 N 3.55 0.84 0.00 4.02 3.08 -1.96 -0.91 114.38 123.00 2dwo h ARG 8 Ca -0.50 -0.32 0.00 0.00 0.07 0.00 0.00 59.98 59.24 2dwo h ARG 8 Cb 1.23 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.23 2dwo h ARG 8 CO 0.69 0.94 -0.03 0.28 -1.07 0.00 0.00 179.97 180.78 2dwo h VAL 9 N 0.74 0.00 0.00 2.04 2.07 -1.93 -3.39 116.25 115.78 2dwo h VAL 9 Ca 0.11 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 66.99 2dwo h VAL 9 Cb 0.68 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.45 2dwo h VAL 9 CO 0.05 0.00 0.00 1.56 0.02 0.00 0.00 177.57 179.20 2dwo h GLN 10 N -0.64 0.00 -3.42 1.57 4.20 -1.75 -0.48 115.11 114.58 2dwo h GLN 10 Ca 0.00 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 58.40 2dwo h GLN 10 Cb 0.03 0.00 0.04 0.00 0.30 0.00 0.00 27.48 27.86 2dwo h GLN 10 CO 0.00 0.00 -0.46 1.63 -0.67 0.00 0.00 178.83 179.33 2dwo n LYS 11 N -2.47 -3.60 -3.60 1.46 4.76 -0.35 -4.62 118.16 109.75 2dwo n LYS 11 Ca 0.04 0.69 -0.36 0.00 -2.87 0.00 0.00 58.31 55.81 2dwo n LYS 11 Cb 0.40 -5.09 -0.08 0.00 -1.84 0.00 0.00 35.03 28.43 2dwo n LYS 11 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2dwo s ILE 12 N -3.01 5.33 -0.15 -0.18 -1.09 -1.25 -4.72 121.20 116.14 2dwo s ILE 12 Ca 0.22 0.39 -0.29 0.00 -2.23 0.00 0.00 60.65 58.74 2dwo s ILE 12 Cb -0.10 -3.57 -0.01 0.00 -1.58 0.00 0.00 42.46 37.20 2dwo s ILE 12 CO 0.27 0.38 1.21 0.26 -1.23 0.00 0.00 174.94 175.82 2dwo s TRP 13 N 0.66 3.02 0.11 3.97 0.52 -1.26 -0.93 118.94 125.03 2dwo s TRP 13 Ca 0.13 1.14 0.06 0.00 0.02 0.00 0.00 56.10 57.45 2dwo s TRP 13 Cb -0.13 -3.44 -0.04 0.00 -1.15 0.00 0.00 33.47 28.72 2dwo s TRP 13 CO 0.03 -1.38 -0.16 0.14 0.02 0.00 0.00 176.95 175.60 2dwo s VAL 14 N 3.13 1.40 0.19 4.03 -7.23 -0.21 -4.92 120.40 116.78 2dwo s VAL 14 Ca 0.53 -1.60 -0.31 0.00 -1.81 0.00 0.00 61.98 58.80 2dwo s VAL 14 Cb -0.21 -1.45 -0.09 0.00 0.56 0.00 0.00 36.38 35.19 2dwo s VAL 14 CO 0.15 -0.29 1.39 -2.16 -0.31 0.00 0.00 175.10 173.88 2dwo s PRO 15 N -2.29 4.32 0.02 4.82 0.04 -1.26 -0.17 135.00 140.47 2dwo s PRO 15 Ca 0.06 2.16 -0.30 0.00 0.04 0.00 0.00 61.00 62.96 2dwo s PRO 15 Cb -0.07 -3.18 -0.07 0.00 0.04 0.00 0.00 34.50 31.22 2dwo s PRO 15 CO 0.03 -0.38 1.57 0.14 0.04 0.00 0.00 177.00 178.40 2dwo s VAL 16 N 0.45 3.36 -0.75 -0.36 -7.23 -1.02 -4.81 120.40 110.04 2dwo s VAL 16 Ca 0.61 0.72 -0.06 0.00 -1.81 0.00 0.00 61.98 61.44 2dwo s VAL 16 Cb -0.39 -3.46 0.19 0.00 0.56 0.00 0.00 36.38 33.28 2dwo s VAL 16 CO 0.37 -0.01 0.62 1.51 -0.31 0.00 0.00 175.10 177.27 2dwo s ASP 17 N 2.43 5.89 -1.18 4.85 3.84 -1.26 -4.95 116.67 126.28 2dwo s ASP 17 Ca 0.71 -2.98 -0.23 0.00 -0.00 0.00 0.00 52.55 50.05 2dwo s ASP 17 Cb -0.36 -1.98 -0.08 0.00 -1.38 0.00 0.00 42.92 39.11 2dwo s ASP 17 CO 0.30 -0.40 1.93 -1.00 -0.00 0.00 0.00 175.17 176.00 2dwo s HIS 18 N -0.25 1.96 0.34 2.11 3.76 -1.26 -4.89 115.29 117.07 2dwo s HIS 18 Ca 0.19 0.44 -0.26 0.00 -0.15 0.00 0.00 55.06 55.28 2dwo s HIS 18 Cb -0.15 -4.01 -0.13 0.00 1.11 0.00 0.00 32.58 29.40 2dwo s HIS 18 CO -0.06 -1.22 0.82 0.54 -0.85 0.00 0.00 174.74 173.96 2dwo n ARG 19 N 8.30 0.97 -0.99 1.40 1.74 -1.26 -4.96 116.66 121.87 2dwo n ARG 19 Ca 0.45 0.35 -0.30 0.00 -0.77 0.00 0.00 57.85 57.57 2dwo n ARG 19 Cb 0.47 -1.69 0.26 0.00 -1.02 0.00 0.00 32.46 30.47 2dwo n ARG 19 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2dwo s PRO 20 N -1.59 -1.75 0.27 5.56 0.04 -1.26 -4.87 135.00 131.40 2dwo s PRO 20 Ca 0.61 -0.16 -0.06 0.00 0.04 0.00 0.00 61.00 61.43 2dwo s PRO 20 Cb -0.67 -1.54 0.51 0.00 0.04 0.00 0.00 34.50 32.84 2dwo s PRO 20 CO 0.58 -4.04 1.58 0.66 0.04 0.00 0.00 177.00 175.83 2dwo h SER 21 N -2.81 -0.66 -3.83 6.66 4.64 -2.05 -3.09 113.55 112.41 2dwo h SER 21 Ca -0.42 0.26 -0.65 0.00 -0.47 0.00 0.00 61.79 60.51 2dwo h SER 21 Cb 1.29 0.50 -0.40 0.00 -0.31 0.00 0.00 62.40 63.48 2dwo h SER 21 CO 0.28 -0.30 -0.53 -0.76 -0.87 0.00 0.00 176.83 174.66 2dwo s LEU 22 N -11.05 4.72 0.36 5.97 1.02 -1.26 -5.10 118.68 113.34 2dwo s LEU 22 Ca -0.14 -3.35 -0.28 0.00 0.02 0.00 0.00 54.13 50.37 2dwo s LEU 22 Cb 0.26 -1.69 -0.11 0.00 0.02 0.00 0.00 46.19 44.67 2dwo s LEU 22 CO 0.77 -0.19 1.48 -2.16 0.02 0.00 0.00 176.35 176.27 2dwo s PRO 23 N -0.76 4.13 0.37 1.29 0.04 -1.17 -5.03 135.00 133.86 2dwo s PRO 23 Ca 0.21 2.54 0.07 0.00 0.04 0.00 0.00 61.00 63.86 2dwo s PRO 23 Cb -0.16 -2.98 -0.02 0.00 0.04 0.00 0.00 34.50 31.38 2dwo s PRO 23 CO -0.07 -0.52 0.40 1.03 0.04 0.00 0.00 177.00 177.88 2dwo s ARG 24 N -1.86 2.80 0.00 4.56 0.52 -1.26 -5.05 118.95 118.66 2dwo s ARG 24 Ca 0.54 -1.27 0.00 0.00 -0.52 0.00 0.00 55.73 54.48 2dwo s ARG 24 Cb -0.46 -2.58 0.00 0.00 0.52 0.00 0.00 34.95 32.42 2dwo s ARG 24 CO 0.60 -0.03 0.00 0.45 0.02 0.00 0.00 175.30 176.34 2dwo n SER 25 N -1.55 1.40 0.00 0.23 2.88 -1.26 -5.11 113.62 110.20 2dwo n SER 25 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2dwo n SER 25 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 2dwo n SER 25 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dwo n GLY 27 N 0.00 -1.93 0.00 0.00 0.00 -1.26 -5.35 105.19 96.65 2dwo n GLY 27 Ca 0.00 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.55 2dwo n GLY 27 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dwo n PRO 28 N -2.50 0.00 -2.37 1.61 -0.04 -1.26 -5.28 135.00 125.15 2dwo n PRO 28 Ca -0.00 0.13 -0.02 0.00 -0.04 0.00 0.00 63.50 63.57 2dwo n PRO 28 Cb 0.06 -0.40 0.01 0.00 -0.04 0.00 0.00 33.50 33.13 2dwo n PRO 28 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 2dwo n ASN 32 N -0.39 -4.96 -4.56 3.54 2.04 -1.26 -5.20 115.26 104.47 2dwo n ASN 32 Ca 0.00 -0.14 -0.52 0.00 -0.44 0.00 0.00 54.58 53.49 2dwo n ASN 32 Cb 0.00 -3.25 -0.05 0.00 -2.53 0.00 0.00 39.78 33.94 2dwo n ASN 32 CO 0.00 0.00 0.00 -1.20 -0.44 0.00 0.00 177.26 175.62 2dwo n SER 33 N -1.71 1.04 -4.59 0.53 7.64 -1.26 -4.93 113.62 110.33 2dwo n SER 33 Ca -0.01 1.14 -0.30 0.00 1.01 0.00 0.00 58.87 60.71 2dwo n SER 33 Cb 0.52 -1.14 0.20 0.00 -1.01 0.00 0.00 64.21 62.78 2dwo n SER 33 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2dwo s PRO 34 N -0.08 0.17 -0.03 1.43 0.04 -1.26 -4.70 135.00 130.57 2dwo s PRO 34 Ca 0.79 1.18 0.05 0.00 0.04 0.00 0.00 61.00 63.07 2dwo s PRO 34 Cb -0.96 -1.66 -0.01 0.00 0.04 0.00 0.00 34.50 31.91 2dwo s PRO 34 CO 0.52 -3.09 -0.17 0.99 0.04 0.00 0.00 177.00 175.28 2dwo s THR 35 N -2.59 1.38 -0.32 1.26 2.01 -0.05 -1.48 115.64 115.85 2dwo s THR 35 Ca 0.67 -0.72 -0.11 0.00 0.31 0.00 0.00 61.69 61.85 2dwo s THR 35 Cb -0.23 -1.17 -0.01 0.00 0.01 0.00 0.00 72.50 71.10 2dwo s THR 35 CO 0.61 0.40 0.18 -0.69 -0.69 0.00 0.00 174.62 174.42 2dwo s VAL 36 N -0.18 4.82 -0.17 3.82 1.01 -0.36 -0.97 120.40 128.36 2dwo s VAL 36 Ca 0.02 -0.36 -0.20 0.00 0.00 0.00 0.00 61.98 61.44 2dwo s VAL 36 Cb -0.09 -3.47 -0.03 0.00 0.00 0.00 0.00 36.38 32.79 2dwo s VAL 36 CO 0.01 0.04 0.59 -0.63 0.00 0.00 0.00 175.10 175.11 2dwo s ILE 37 N 1.65 5.07 -0.32 2.22 1.01 0.12 -1.90 121.20 129.04 2dwo s ILE 37 Ca 0.05 1.14 -0.08 0.00 0.00 0.00 0.00 60.65 61.75 2dwo s ILE 37 Cb -0.17 -3.92 0.01 0.00 0.01 0.00 0.00 42.46 38.40 2dwo s ILE 37 CO 0.08 0.17 0.12 -0.69 0.00 0.00 0.00 174.94 174.62 2dwo s VAL 38 N 1.53 4.19 0.37 2.92 1.01 0.93 0.05 120.40 131.40 2dwo s VAL 38 Ca 0.28 -0.74 -0.25 0.00 0.00 0.00 0.00 61.98 61.28 2dwo s VAL 38 Cb -0.16 -3.23 -0.09 0.00 0.00 0.00 0.00 36.38 32.90 2dwo s VAL 38 CO 0.11 -0.03 1.00 -0.04 0.00 0.00 0.00 175.10 176.15 2dwo s MET 39 N 1.52 4.35 -0.02 2.72 1.00 -0.73 -1.05 119.30 127.09 2dwo s MET 39 Ca 0.02 1.43 -0.01 0.00 0.00 0.00 0.00 55.69 57.12 2dwo s MET 39 Cb -0.18 -2.64 0.01 0.00 0.00 0.00 0.00 34.83 32.02 2dwo s MET 39 CO 0.04 0.05 0.05 0.08 0.00 0.00 0.00 175.02 175.24 2dwo s VAL 40 N -1.66 -0.02 0.00 -6.03 1.01 0.29 -4.40 120.40 109.60 2dwo s VAL 40 Ca 0.55 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.58 2dwo s VAL 40 Cb -0.20 -0.09 0.00 0.00 0.00 0.00 0.00 36.38 36.08 2dwo s VAL 40 CO 0.26 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.99 2dwo n GLY 41 N 3.39 3.69 3.71 4.51 0.00 -0.57 -1.78 105.19 118.13 2dwo n GLY 41 Ca -0.17 -1.44 -0.31 0.00 0.00 0.00 0.00 46.02 44.11 2dwo n GLY 41 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dwo s LEU 42 N 0.00 2.68 0.70 0.99 1.43 -1.26 -4.48 118.68 118.73 2dwo s LEU 42 Ca 0.00 1.87 -0.15 0.00 -1.03 0.00 0.00 54.13 54.83 2dwo s LEU 42 Cb 0.00 -4.35 0.02 0.00 0.03 0.00 0.00 46.19 41.89 2dwo s LEU 42 CO 0.00 -2.67 1.14 -2.16 0.23 0.00 0.00 176.35 172.89 2dwo s PRO 43 N -4.79 2.49 -0.97 1.29 0.04 -1.26 -3.42 135.00 128.37 2dwo s PRO 43 Ca 0.64 1.51 -0.02 0.00 0.04 0.00 0.00 61.00 63.17 2dwo s PRO 43 Cb -0.20 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.44 2dwo s PRO 43 CO 0.57 -1.52 0.25 0.00 0.04 0.00 0.00 177.00 176.35 2dwo n ALA 44 N -2.63 -0.51 -0.05 8.56 0.00 -1.26 -4.93 120.51 119.69 2dwo n ALA 44 Ca 0.11 0.15 0.06 0.00 0.00 0.00 0.00 53.44 53.77 2dwo n ALA 44 Cb 0.51 -2.22 0.14 0.00 0.00 0.00 0.00 19.45 17.89 2dwo n ALA 44 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2dwo n ARG 45 N -2.54 2.42 -0.69 0.00 3.00 -1.22 -4.70 116.66 112.92 2dwo n ARG 45 Ca -0.09 -1.92 0.00 0.00 -0.01 0.00 0.00 57.85 55.83 2dwo n ARG 45 Cb 0.59 -1.28 0.00 0.00 0.00 0.00 0.00 32.46 31.77 2dwo n ARG 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2dwo n GLY 46 N 0.62 0.61 0.16 -0.13 0.00 -1.26 -4.83 105.19 100.36 2dwo n GLY 46 Ca 0.11 -0.38 -0.08 0.00 0.00 0.00 0.00 46.02 45.67 2dwo n GLY 46 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dwo h LYS 47 N 0.96 0.49 -0.27 1.61 1.57 -1.93 0.50 116.57 119.49 2dwo h LYS 47 Ca 0.00 -0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.63 2dwo h LYS 47 Cb 0.00 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 2dwo h LYS 47 CO 0.00 0.34 -0.32 1.15 -0.57 0.00 0.00 179.45 180.04 2dwo h THR 48 N 0.49 1.28 -0.13 -0.16 2.02 -1.96 0.86 112.91 115.30 2dwo h THR 48 Ca 0.13 -1.44 -0.01 0.00 0.77 0.00 0.00 66.41 65.87 2dwo h THR 48 Cb -0.04 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 2dwo h THR 48 CO -0.03 0.46 0.05 0.22 0.37 0.00 0.00 175.52 176.59 2dwo h TYR 49 N 0.49 0.21 -0.51 3.16 3.20 -1.89 -0.25 116.97 121.38 2dwo h TYR 49 Ca 0.06 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.85 2dwo h TYR 49 Cb 0.80 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.99 2dwo h TYR 49 CO 0.03 0.31 0.09 0.82 -1.64 0.00 0.00 178.16 177.77 2dwo h ILE 50 N 0.05 1.25 -0.09 1.81 2.04 -0.75 -1.06 117.51 120.75 2dwo h ILE 50 Ca 0.04 -0.93 0.03 0.00 1.00 0.00 0.00 64.86 65.00 2dwo h ILE 50 Cb 0.20 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 37.11 2dwo h ILE 50 CO -0.00 0.33 -0.09 0.28 0.00 0.00 0.00 178.15 178.67 2dwo h SER 51 N 0.72 -0.28 -0.53 1.72 0.02 -0.59 0.21 113.55 114.82 2dwo h SER 51 Ca 0.16 0.06 -0.10 0.00 -0.84 0.00 0.00 61.79 61.06 2dwo h SER 51 Cb 0.39 0.14 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 2dwo h SER 51 CO 0.01 -0.13 -0.08 0.11 -1.14 0.00 0.00 176.83 175.61 2dwo h LYS 52 N -0.12 0.99 -0.15 3.45 1.57 -0.97 -2.11 116.57 119.24 2dwo h LYS 52 Ca 0.07 -0.36 -0.08 0.00 -1.87 0.00 0.00 60.65 58.41 2dwo h LYS 52 Cb 0.21 -0.07 -0.00 0.00 0.08 0.00 0.00 32.23 32.45 2dwo h LYS 52 CO -0.16 1.03 -0.24 -0.22 -0.57 0.00 0.00 179.45 179.30 2dwo h LYS 53 N 0.86 0.43 -0.92 3.15 3.64 -0.98 -0.90 116.57 121.85 2dwo h LYS 53 Ca 0.14 -0.26 0.01 0.00 -1.27 0.00 0.00 60.65 59.27 2dwo h LYS 53 Cb 0.64 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.44 2dwo h LYS 53 CO 0.04 0.85 0.61 1.25 -2.27 0.00 0.00 179.45 179.93 2dwo h LEU 54 N 0.05 1.06 -0.85 5.20 5.85 -1.00 -1.07 115.31 124.54 2dwo h LEU 54 Ca 0.01 -0.03 -0.07 0.00 0.84 0.00 0.00 57.88 58.64 2dwo h LEU 54 Cb 0.81 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.55 2dwo h LEU 54 CO 0.05 0.76 0.07 0.74 -0.34 0.00 0.00 178.44 179.73 2dwo h THR 55 N 1.25 1.25 -0.60 1.05 2.02 -1.30 -0.28 112.91 116.30 2dwo h THR 55 Ca 0.34 -0.98 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 2dwo h THR 55 Cb -0.14 0.74 -0.03 0.00 -1.74 0.00 0.00 68.15 66.98 2dwo h THR 55 CO -0.07 0.36 0.22 -0.09 0.37 0.00 0.00 175.52 176.31 2dwo h ARG 56 N 0.87 0.92 -0.09 6.66 2.43 -0.53 -2.14 114.38 122.50 2dwo h ARG 56 Ca 0.18 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2dwo h ARG 56 Cb 0.42 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.82 2dwo h ARG 56 CO 0.01 0.79 -0.02 -0.92 -1.51 0.00 0.00 179.97 178.33 2dwo h TYR 57 N 0.84 0.19 -0.31 2.20 3.20 -0.79 -2.49 116.97 119.82 2dwo h TYR 57 Ca 0.20 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 62.02 2dwo h TYR 57 Cb 0.24 -0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 2dwo h TYR 57 CO 0.01 0.49 0.18 -0.07 -1.64 0.00 0.00 178.16 177.13 2dwo h LEU 58 N -0.16 0.37 -0.70 2.82 3.38 -1.01 -1.19 115.31 118.82 2dwo h LEU 58 Ca 0.02 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2dwo h LEU 58 Cb 0.43 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 2dwo h LEU 58 CO 0.01 0.32 0.44 0.78 0.09 0.00 0.00 178.44 180.08 2dwo h ASN 59 N 0.39 0.82 -0.71 -0.43 -0.26 -1.32 0.47 115.58 114.54 2dwo h ASN 59 Ca 0.11 -0.05 -0.01 0.00 -0.56 0.00 0.00 56.30 55.79 2dwo h ASN 59 Cb 0.02 -0.21 -0.03 0.00 -1.06 0.00 0.00 38.32 37.04 2dwo h ASN 59 CO -0.02 0.62 0.40 -0.25 -1.06 0.00 0.00 177.43 177.13 2dwo h TRP 60 N 0.95 0.96 0.00 1.19 7.01 -0.99 -0.20 115.95 124.87 2dwo h TRP 60 Ca 0.25 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 61.24 2dwo h TRP 60 Cb -0.06 -0.31 0.00 0.00 -2.10 0.00 0.00 29.16 26.69 2dwo h TRP 60 CO -0.02 0.67 0.00 0.44 -2.79 0.00 0.00 178.44 176.74 2dwo n ILE 61 N -4.50 0.00 -0.08 2.65 -5.35 -0.49 -4.88 119.36 106.71 2dwo n ILE 61 Ca 0.06 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.54 2dwo n ILE 61 Cb 0.08 -0.45 0.00 0.00 -1.74 0.00 0.00 39.64 37.53 2dwo n ILE 61 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2dwo n GLY 62 N 0.70 0.95 3.23 3.28 0.00 -0.09 -5.01 105.19 108.26 2dwo n GLY 62 Ca 0.17 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 2dwo n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dwo s VAL 63 N -2.00 4.18 -0.28 1.61 1.01 0.16 -4.96 120.40 120.11 2dwo s VAL 63 Ca 0.00 -1.65 -0.36 0.00 0.00 0.00 0.00 61.98 59.97 2dwo s VAL 63 Cb 0.00 -3.68 -0.13 0.00 0.00 0.00 0.00 36.38 32.57 2dwo s VAL 63 CO 0.00 -0.67 2.01 -0.81 0.00 0.00 0.00 175.10 175.63 2dwo n PRO 64 N 4.90 1.31 -4.19 2.72 -0.04 -1.26 -3.11 135.00 135.32 2dwo n PRO 64 Ca -0.08 0.43 -0.16 0.00 -0.04 0.00 0.00 63.50 63.64 2dwo n PRO 64 Cb 0.42 -2.40 -0.13 0.00 -0.04 0.00 0.00 33.50 31.35 2dwo n PRO 64 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2dwo s THR 65 N 5.65 0.78 -0.03 0.52 2.01 -1.26 -1.50 115.64 121.81 2dwo s THR 65 Ca 1.03 -0.93 -0.02 0.00 0.31 0.00 0.00 61.69 62.08 2dwo s THR 65 Cb -0.89 -0.75 0.01 0.00 0.01 0.00 0.00 72.50 70.88 2dwo s THR 65 CO 0.54 -0.15 0.07 -0.75 -0.69 0.00 0.00 174.62 173.64 2dwo s LYS 66 N -1.20 0.08 -0.07 4.92 2.20 -0.53 -4.89 119.74 120.25 2dwo s LYS 66 Ca -0.03 0.09 -0.16 0.00 -0.36 0.00 0.00 55.97 55.51 2dwo s LYS 66 Cb -0.08 0.03 -0.05 0.00 -1.51 0.00 0.00 37.83 36.23 2dwo s LYS 66 CO 0.01 -0.01 0.44 0.08 -0.36 0.00 0.00 175.35 175.50 2dwo s VAL 67 N 0.05 5.11 -0.39 4.02 1.01 -1.26 -0.37 120.40 128.57 2dwo s VAL 67 Ca -0.00 0.89 0.03 0.00 0.00 0.00 0.00 61.98 62.89 2dwo s VAL 67 Cb -0.01 -3.76 0.11 0.00 0.00 0.00 0.00 36.38 32.72 2dwo s VAL 67 CO 0.00 0.44 0.12 -0.36 0.00 0.00 0.00 175.10 175.30 2dwo s PHE 68 N -0.14 3.63 -0.45 5.22 0.40 0.97 -4.91 117.98 122.71 2dwo s PHE 68 Ca 0.24 -2.95 -0.21 0.00 -0.60 0.00 0.00 56.93 53.41 2dwo s PHE 68 Cb -0.16 -2.96 0.03 0.00 0.51 0.00 0.00 43.02 40.44 2dwo s PHE 68 CO 0.11 -0.91 0.66 1.21 0.70 0.00 0.00 175.22 176.99 2dwo s ASN 69 N 0.81 6.32 0.52 1.36 2.47 -1.26 -0.79 114.94 124.37 2dwo s ASN 69 Ca 0.12 -0.36 0.17 0.00 0.42 0.00 0.00 52.86 53.21 2dwo s ASN 69 Cb -0.21 -2.32 1.27 0.00 -1.45 0.00 0.00 41.25 38.54 2dwo s ASN 69 CO -0.06 -0.80 2.14 0.58 -3.72 0.00 0.00 177.10 175.23 2dwo h VAL 70 N 5.89 0.99 -0.58 -5.21 2.07 -1.82 -2.00 116.25 115.58 2dwo h VAL 70 Ca -0.25 -0.06 0.12 0.00 0.82 0.00 0.00 66.70 67.32 2dwo h VAL 70 Cb 1.09 1.03 -0.09 0.00 -1.52 0.00 0.00 31.29 31.81 2dwo h VAL 70 CO 0.91 0.02 0.04 1.23 0.02 0.00 0.00 177.57 179.78 2dwo h GLY 71 N 0.06 0.65 2.00 2.17 0.00 -1.91 -0.32 103.07 105.71 2dwo h GLY 71 Ca -0.00 0.05 -0.07 0.00 0.00 0.00 0.00 47.33 47.31 2dwo h GLY 71 CO 0.00 -0.16 -0.33 0.83 0.00 0.00 0.00 176.54 176.88 2dwo h GLU 72 N 0.16 0.00 -0.46 4.80 5.08 -1.76 -1.50 114.58 120.90 2dwo h GLU 72 Ca 0.30 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.54 2dwo h GLU 72 Cb 0.47 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2dwo h GLU 72 CO -0.46 0.33 -0.18 1.88 -1.00 0.00 0.00 179.01 179.58 2dwo h TYR 73 N 0.00 1.06 -0.45 4.33 -1.99 -1.05 -1.92 116.97 116.95 2dwo h TYR 73 Ca -0.00 -0.25 -0.10 0.00 2.00 0.00 0.00 58.73 60.38 2dwo h TYR 73 Cb 0.60 -0.25 -0.01 0.00 2.00 0.00 0.00 36.73 39.06 2dwo h TYR 73 CO 0.00 1.05 -0.11 -0.09 -0.00 0.00 0.00 178.16 179.01 2dwo h ARG 74 N 0.77 0.87 0.00 4.88 1.12 -0.99 -1.42 114.38 119.61 2dwo h ARG 74 Ca 0.11 -0.33 -0.01 0.00 -1.11 0.00 0.00 59.98 58.64 2dwo h ARG 74 Cb 0.74 -0.05 -0.00 0.00 -0.01 0.00 0.00 29.97 30.65 2dwo h ARG 74 CO 0.06 0.97 -0.05 0.00 -3.11 0.00 0.00 179.97 177.84 2dwo h ARG 75 N 0.71 0.00 0.11 0.20 3.08 -1.17 -0.42 114.38 116.88 2dwo h ARG 75 Ca 0.11 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.87 2dwo h ARG 75 Cb 0.65 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 2dwo h ARG 75 CO 0.04 0.05 -1.48 1.49 -1.07 0.00 0.00 179.97 179.00 2dwo h GLU 76 N 0.00 0.23 0.00 0.04 4.57 -0.76 -2.95 114.58 115.71 2dwo h GLU 76 Ca -0.00 -0.39 -0.04 0.00 -1.18 0.00 0.00 59.36 57.74 2dwo h GLU 76 Cb 0.25 0.15 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 2dwo h GLU 76 CO 0.01 1.10 -0.69 0.00 -1.18 0.00 0.00 179.01 178.24 2dwo h ALA 77 N 0.54 0.70 -0.00 2.92 0.00 -0.72 -3.37 119.26 119.34 2dwo h ALA 77 Ca -0.22 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.48 2dwo h ALA 77 Cb 2.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.82 2dwo h ALA 77 CO 0.16 0.24 -0.28 0.28 0.00 0.00 0.00 179.25 179.66 2dwo n VAL 78 N -2.92 0.00 0.00 0.00 0.31 -0.22 -5.05 118.33 110.45 2dwo n VAL 78 Ca -0.00 -0.36 0.00 0.00 -0.01 0.00 0.00 64.34 63.97 2dwo n VAL 78 Cb 0.62 1.05 0.00 0.00 -0.91 0.00 0.00 33.84 34.60 2dwo n VAL 78 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 2dwo n LYS 79 N -0.71 0.00 -3.72 5.55 4.01 -1.11 -4.79 118.16 117.38 2dwo n LYS 79 Ca 0.03 0.00 -0.21 0.00 -0.51 0.00 0.00 58.31 57.62 2dwo n LYS 79 Cb 0.16 0.00 -0.18 0.00 -0.51 0.00 0.00 35.03 34.50 2dwo n LYS 79 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 2dwo s GLN 80 N 0.00 0.21 0.30 1.97 2.00 -1.26 -4.93 119.66 117.96 2dwo s GLN 80 Ca 0.00 0.26 -0.29 0.00 -2.00 0.00 0.00 55.36 53.33 2dwo s GLN 80 Cb 0.00 -0.69 -0.11 0.00 0.80 0.00 0.00 33.01 33.02 2dwo s GLN 80 CO 0.00 -0.31 1.44 -0.47 -0.50 0.00 0.00 175.29 175.45 2dwo s TYR 81 N 2.03 2.89 -0.06 1.67 5.04 -1.26 -4.95 117.35 122.70 2dwo s TYR 81 Ca 0.04 1.12 -0.06 0.00 -2.44 0.00 0.00 57.07 55.73 2dwo s TYR 81 Cb -0.12 -3.87 -0.04 0.00 0.35 0.00 0.00 41.96 38.29 2dwo s TYR 81 CO -0.04 -2.67 -0.13 -1.13 -1.34 0.00 0.00 175.55 170.23 2dwo n SER 82 N 1.51 1.01 -3.33 4.32 3.41 -1.26 -4.91 113.62 114.36 2dwo n SER 82 Ca 0.04 0.16 -0.08 0.00 -0.26 0.00 0.00 58.87 58.73 2dwo n SER 82 Cb 0.40 -0.38 0.01 0.00 -0.26 0.00 0.00 64.21 63.97 2dwo n SER 82 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dwo s SER 83 N -5.95 -0.11 0.26 4.04 1.04 -1.26 -5.00 113.70 106.72 2dwo s SER 83 Ca -0.13 -0.91 0.18 0.00 0.48 0.00 0.00 55.95 55.57 2dwo s SER 83 Cb 0.04 0.79 0.97 0.00 0.10 0.00 0.00 66.02 67.92 2dwo s SER 83 CO 0.17 -1.54 1.55 0.00 0.98 0.00 0.00 173.24 174.41 2dwo n TYR 84 N -0.50 0.61 0.08 5.02 0.18 -1.26 -2.03 117.16 119.26 2dwo n TYR 84 Ca -0.06 0.32 0.14 0.00 1.88 0.00 0.00 57.90 60.17 2dwo n TYR 84 Cb 0.60 -1.01 0.64 0.00 -0.38 0.00 0.00 39.34 39.19 2dwo n TYR 84 CO 0.00 0.00 0.00 -0.91 -2.08 0.00 0.00 176.86 173.87 2dwo h ASN 85 N 0.00 0.06 -0.45 9.48 2.35 -1.95 0.11 115.58 125.17 2dwo h ASN 85 Ca 0.00 0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.79 2dwo h ASN 85 Cb 0.00 -0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 2dwo h ASN 85 CO 0.00 0.04 0.30 0.15 -1.65 0.00 0.00 177.43 176.27 2dwo h PHE 86 N 0.06 0.45 -0.28 1.19 3.57 -1.84 -2.53 116.94 117.56 2dwo h PHE 86 Ca 0.16 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.67 2dwo h PHE 86 Cb 0.56 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.15 2dwo h PHE 86 CO -0.00 0.26 0.00 1.19 -2.23 0.00 0.00 178.31 177.53 2dwo n PHE 87 N -4.48 0.36 -1.82 0.41 3.01 0.36 -4.73 117.46 110.57 2dwo n PHE 87 Ca 0.05 -0.18 -0.41 0.00 1.01 0.00 0.00 57.45 57.92 2dwo n PHE 87 Cb 0.17 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.63 2dwo n PHE 87 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2dwo s ARG 88 N -1.64 4.14 0.59 -1.08 0.52 -0.95 -4.84 118.95 115.69 2dwo s ARG 88 Ca 0.34 2.54 0.39 0.00 -0.52 0.00 0.00 55.73 58.47 2dwo s ARG 88 Cb 0.19 -3.01 1.96 0.00 0.52 0.00 0.00 34.95 34.61 2dwo s ARG 88 CO 0.27 -0.55 2.18 -1.00 0.02 0.00 0.00 175.30 176.21 2dwo h PRO 89 N 4.03 0.00 -0.03 3.54 0.13 -1.92 -1.40 132.00 136.35 2dwo h PRO 89 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2dwo h PRO 89 Cb 1.23 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2dwo h PRO 89 CO 0.72 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.09 2dwo n ASP 90 N -2.99 1.33 -4.57 1.44 5.75 -1.26 -4.64 116.55 111.60 2dwo n ASP 90 Ca -0.02 -1.46 -0.43 0.00 -0.01 0.00 0.00 54.79 52.88 2dwo n ASP 90 Cb 0.15 -0.01 -0.01 0.00 -1.03 0.00 0.00 41.12 40.22 2dwo n ASP 90 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 2dwo s ASN 91 N -1.96 6.79 0.17 -1.12 3.84 -0.53 -4.85 114.94 117.28 2dwo s ASN 91 Ca 0.39 -2.29 -0.17 0.00 0.21 0.00 0.00 52.86 50.99 2dwo s ASN 91 Cb 0.21 -2.57 0.11 0.00 -0.55 0.00 0.00 41.25 38.45 2dwo s ASN 91 CO 0.33 -1.21 1.65 -0.08 -2.79 0.00 0.00 177.10 175.00 2dwo h GLU 92 N 7.96 -0.05 -0.47 0.43 4.81 -1.86 0.43 114.58 125.84 2dwo h GLU 92 Ca 0.40 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.61 2dwo h GLU 92 Cb 0.90 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.27 2dwo h GLU 92 CO 1.44 -0.03 0.24 1.49 -0.73 0.00 0.00 179.01 181.41 2dwo h GLU 93 N -0.05 0.66 -0.22 1.92 4.81 -1.99 -1.99 114.58 117.72 2dwo h GLU 93 Ca 0.21 -0.09 -0.09 0.00 -0.13 0.00 0.00 59.36 59.25 2dwo h GLU 93 Cb 0.37 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 2dwo h GLU 93 CO -0.47 0.55 -0.27 0.00 -0.73 0.00 0.00 179.01 178.10 2dwo h ALA 94 N 1.08 1.13 -0.67 2.92 0.00 -1.76 -0.86 119.26 121.10 2dwo h ALA 94 Ca 0.16 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2dwo h ALA 94 Cb 0.09 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2dwo h ALA 94 CO -0.02 0.55 0.37 0.52 0.00 0.00 0.00 179.25 180.66 2dwo h MET 95 N 0.38 0.93 -0.02 0.00 2.86 -0.58 0.12 114.93 118.61 2dwo h MET 95 Ca 0.06 -0.10 -0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2dwo h MET 95 Cb 0.67 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 32.14 2dwo h MET 95 CO 0.05 0.68 -0.01 -0.22 1.06 0.00 0.00 176.91 178.47 2dwo h LYS 96 N 0.93 0.05 -0.38 1.72 3.64 -0.69 -2.01 116.57 119.83 2dwo h LYS 96 Ca 0.24 -0.02 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 2dwo h LYS 96 Cb 0.02 -0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 2dwo h LYS 96 CO -0.04 0.46 0.15 0.28 -2.27 0.00 0.00 179.45 178.02 2dwo h VAL 97 N -0.36 0.91 -0.53 2.00 2.07 -0.75 0.42 116.25 120.00 2dwo h VAL 97 Ca 0.01 -0.11 0.05 0.00 0.82 0.00 0.00 66.70 67.47 2dwo h VAL 97 Cb 0.44 0.57 -0.05 0.00 -1.52 0.00 0.00 31.29 30.74 2dwo h VAL 97 CO 0.00 0.06 0.26 0.03 0.02 0.00 0.00 177.57 177.94 2dwo h ARG 98 N 0.31 0.49 -0.44 1.57 3.08 -0.76 0.17 114.38 118.80 2dwo h ARG 98 Ca 0.17 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.15 2dwo h ARG 98 Cb 0.13 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 2dwo h ARG 98 CO -0.16 0.33 0.12 -0.22 -1.07 0.00 0.00 179.97 178.97 2dwo h LYS 99 N 0.51 0.69 -0.46 0.04 3.64 -0.90 -0.95 116.57 119.14 2dwo h LYS 99 Ca 0.24 -0.16 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 2dwo h LYS 99 Cb 0.16 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.87 2dwo h LYS 99 CO -0.18 0.68 0.22 1.96 -2.27 0.00 0.00 179.45 179.87 2dwo h GLN 100 N 0.57 0.64 -0.25 1.90 4.20 -0.24 -0.34 115.11 121.59 2dwo h GLN 100 Ca 0.14 -0.07 -0.13 0.00 0.06 0.00 0.00 58.65 58.65 2dwo h GLN 100 Cb 0.29 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2dwo h GLN 100 CO -0.00 0.50 -0.38 0.00 -0.67 0.00 0.00 178.83 178.28 2dwo h ALA 102 N 1.10 0.11 -0.53 0.00 0.00 -0.11 -1.98 119.26 117.86 2dwo h ALA 102 Ca 0.05 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 2dwo h ALA 102 Cb 0.88 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.61 2dwo h ALA 102 CO 0.08 -0.27 0.18 -0.07 0.00 0.00 0.00 179.25 179.17 2dwo h LEU 103 N -0.08 0.71 -0.75 0.00 3.38 -1.01 -0.48 115.31 117.09 2dwo h LEU 103 Ca 0.03 -0.10 -0.12 0.00 0.09 0.00 0.00 57.88 57.78 2dwo h LEU 103 Cb 0.25 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 2dwo h LEU 103 CO 0.00 0.67 -0.30 0.00 0.09 0.00 0.00 178.44 178.90 2dwo h ALA 104 N 1.43 0.92 -0.44 1.53 0.00 -1.18 -0.89 119.26 120.63 2dwo h ALA 104 Ca 0.18 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 2dwo h ALA 104 Cb 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 2dwo h ALA 104 CO -0.01 0.62 -0.22 0.00 0.00 0.00 0.00 179.25 179.63 2dwo h ALA 105 N 1.14 0.62 -0.34 0.00 0.00 -0.71 -2.00 119.26 117.98 2dwo h ALA 105 Ca 0.07 -0.39 -0.06 0.00 0.00 0.00 0.00 54.91 54.53 2dwo h ALA 105 Cb 0.78 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2dwo h ALA 105 CO 0.06 0.61 -0.05 -0.07 0.00 0.00 0.00 179.25 179.80 2dwo h LEU 106 N 0.77 0.52 -0.14 0.00 3.38 -0.93 0.81 115.31 119.71 2dwo h LEU 106 Ca 0.10 -0.12 0.02 0.00 0.09 0.00 0.00 57.88 57.97 2dwo h LEU 106 Cb 0.79 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 2dwo h LEU 106 CO 0.07 0.63 0.02 -0.09 0.09 0.00 0.00 178.44 179.15 2dwo h ARG 107 N 0.51 0.07 -0.12 1.13 2.43 -0.82 0.98 114.38 118.57 2dwo h ARG 107 Ca 0.10 -0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.18 2dwo h ARG 107 Cb 0.41 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 2dwo h ARG 107 CO 0.02 0.05 -0.34 -0.44 -1.51 0.00 0.00 179.97 177.75 2dwo h ASP 108 N 0.07 0.24 -0.11 -3.80 3.45 -0.88 -1.87 116.42 113.52 2dwo h ASP 108 Ca 0.06 -0.08 -0.00 0.00 0.43 0.00 0.00 57.03 57.44 2dwo h ASP 108 Cb 0.06 -0.06 -0.01 0.00 -0.56 0.00 0.00 39.33 38.76 2dwo h ASP 108 CO -0.10 0.57 0.06 0.58 -1.57 0.00 0.00 179.24 178.78 2dwo h VAL 109 N 0.20 1.10 -0.73 -1.35 2.07 -0.02 0.72 116.25 118.24 2dwo h VAL 109 Ca 0.03 -0.27 0.04 0.00 0.82 0.00 0.00 66.70 67.32 2dwo h VAL 109 Cb 0.70 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 31.50 2dwo h VAL 109 CO 0.05 0.09 0.45 0.50 0.02 0.00 0.00 177.57 178.68 2dwo h LYS 110 N 0.07 0.83 -0.06 1.57 3.64 -0.57 -0.14 116.57 121.91 2dwo h LYS 110 Ca 0.04 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.26 2dwo h LYS 110 Cb 0.09 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 2dwo h LYS 110 CO -0.01 0.55 -0.48 1.03 -2.27 0.00 0.00 179.45 178.27 2dwo h SER 111 N 0.85 0.15 -0.00 4.20 0.87 -1.07 -0.70 113.55 117.85 2dwo h SER 111 Ca 0.31 -0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.80 2dwo h SER 111 Cb 0.09 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 2dwo h SER 111 CO -0.14 0.61 -0.01 0.22 -0.53 0.00 0.00 176.83 176.98 2dwo h TYR 112 N 0.11 0.01 0.00 2.24 3.20 0.07 -1.95 116.97 120.66 2dwo h TYR 112 Ca 0.00 -0.01 -0.17 0.00 3.14 0.00 0.00 58.73 61.70 2dwo h TYR 112 Cb 0.89 -0.00 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 2dwo h TYR 112 CO 0.01 0.61 -0.82 -0.07 -1.64 0.00 0.00 178.16 176.25 2dwo h LEU 113 N -0.58 0.01 0.00 2.82 3.38 -1.07 -1.86 115.31 118.01 2dwo h LEU 113 Ca -0.00 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2dwo h LEU 113 Cb 0.61 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.35 2dwo h LEU 113 CO 0.00 0.83 -1.54 0.00 0.09 0.00 0.00 178.44 177.81 2dwo n ALA 114 N -2.39 3.62 0.00 1.53 0.00 -0.27 -4.52 120.51 118.48 2dwo n ALA 114 Ca -0.01 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 52.89 2dwo n ALA 114 Cb 0.78 -0.77 0.00 0.00 0.00 0.00 0.00 19.45 19.46 2dwo n ALA 114 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2dwo n LYS 115 N -1.95 3.27 -0.14 0.00 5.02 -0.77 -4.86 118.16 118.73 2dwo n LYS 115 Ca -0.00 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.35 2dwo n LYS 115 Cb 0.47 -0.59 0.14 0.00 -0.02 0.00 0.00 35.03 35.03 2dwo n LYS 115 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2dwo n GLU 116 N -0.61 2.23 -0.72 1.97 1.02 -0.95 -4.98 120.64 118.61 2dwo n GLU 116 Ca 0.00 -1.87 0.00 0.00 -0.02 0.00 0.00 57.16 55.27 2dwo n GLU 116 Cb 0.00 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.13 2dwo n GLU 116 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dwo n GLY 117 N 0.68 0.78 3.76 0.62 0.00 -1.21 -5.01 105.19 104.82 2dwo n GLY 117 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 2dwo n GLY 117 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dwo s GLY 118 N -1.82 2.24 0.00 -0.02 0.00 -0.72 -4.85 107.32 102.15 2dwo s GLY 118 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 44.72 45.35 2dwo s GLY 118 CO 0.00 0.99 0.00 -0.18 0.00 0.00 0.00 173.10 173.91 2dwo n GLN 119 N -2.33 2.80 -4.21 2.90 -0.06 -0.56 -4.48 117.38 111.44 2dwo n GLN 119 Ca 0.11 0.00 -0.24 0.00 -2.00 0.00 0.00 57.00 54.87 2dwo n GLN 119 Cb 0.52 -0.96 -0.17 0.00 -4.06 0.00 0.00 30.24 25.57 2dwo n GLN 119 CO 0.00 0.00 0.00 0.42 -0.20 0.00 0.00 177.06 177.28 2dwo s ILE 120 N -1.93 0.91 -0.16 1.69 -1.09 -0.88 -0.87 121.20 118.88 2dwo s ILE 120 Ca 0.00 -0.29 -0.00 0.00 -2.23 0.00 0.00 60.65 58.12 2dwo s ILE 120 Cb 0.00 -0.90 -0.00 0.00 -1.58 0.00 0.00 42.46 39.97 2dwo s ILE 120 CO 0.00 0.32 -0.14 0.00 -1.23 0.00 0.00 174.94 173.89 2dwo s ALA 121 N 1.16 2.54 -0.42 9.38 0.00 -0.15 -1.45 121.76 132.82 2dwo s ALA 121 Ca -0.06 -1.03 -0.14 0.00 0.00 0.00 0.00 51.96 50.73 2dwo s ALA 121 Cb -0.14 -1.26 0.04 0.00 0.00 0.00 0.00 23.12 21.76 2dwo s ALA 121 CO -0.02 -0.02 0.30 0.08 0.00 0.00 0.00 175.76 176.11 2dwo s VAL 122 N 0.79 4.99 -0.80 0.00 1.01 0.51 0.11 120.40 127.01 2dwo s VAL 122 Ca -0.05 -0.91 -0.24 0.00 0.00 0.00 0.00 61.98 60.78 2dwo s VAL 122 Cb -0.15 -3.87 0.06 0.00 0.00 0.00 0.00 36.38 32.42 2dwo s VAL 122 CO 0.00 -0.40 1.20 0.12 0.00 0.00 0.00 175.10 176.03 2dwo s PHE 123 N 1.61 2.55 -0.59 5.22 5.36 0.11 -0.02 117.98 132.22 2dwo s PHE 123 Ca 0.04 -0.52 -0.20 0.00 -0.96 0.00 0.00 56.93 55.29 2dwo s PHE 123 Cb -0.21 -4.50 0.09 0.00 -0.34 0.00 0.00 43.02 38.05 2dwo s PHE 123 CO 0.07 -1.85 0.75 0.34 -1.46 0.00 0.00 175.22 173.07 2dwo s ASP 124 N 3.97 6.19 0.36 6.13 2.15 0.03 -1.77 116.67 133.73 2dwo s ASP 124 Ca 0.33 -1.23 -0.16 0.00 0.43 0.00 0.00 52.55 51.92 2dwo s ASP 124 Cb -0.09 -2.33 0.06 0.00 -0.30 0.00 0.00 42.92 40.27 2dwo s ASP 124 CO 0.05 -1.15 0.84 0.00 -0.17 0.00 0.00 175.17 174.74 2dwo s ALA 125 N 2.99 -0.86 0.05 3.66 0.00 -1.26 -2.29 121.76 124.05 2dwo s ALA 125 Ca 0.15 -0.71 -0.20 0.00 0.00 0.00 0.00 51.96 51.20 2dwo s ALA 125 Cb -0.22 0.68 -0.12 0.00 0.00 0.00 0.00 23.12 23.46 2dwo s ALA 125 CO 0.08 -1.00 1.41 1.79 0.00 0.00 0.00 175.76 178.04 2dwo h THR 126 N 2.00 1.31 -7.09 0.00 1.35 -1.82 -3.36 112.91 105.30 2dwo h THR 126 Ca -0.32 -1.15 -0.62 0.00 -0.55 0.00 0.00 66.41 63.77 2dwo h THR 126 Cb 1.24 1.69 -0.26 0.00 -1.73 0.00 0.00 68.15 69.10 2dwo h THR 126 CO 0.41 0.34 -0.94 0.59 -0.25 0.00 0.00 175.52 175.67 2dwo n ASN 127 N -4.59 0.21 -0.03 5.36 3.02 -1.26 -1.52 115.26 116.45 2dwo n ASN 127 Ca -0.05 -1.26 0.14 0.00 -0.03 0.00 0.00 54.58 53.38 2dwo n ASN 127 Cb 0.32 -1.57 0.67 0.00 -0.61 0.00 0.00 39.78 38.58 2dwo n ASN 127 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2dwo n THR 128 N -4.41 0.00 -4.26 3.41 -2.24 -1.26 -4.62 114.28 100.90 2dwo n THR 128 Ca -0.21 -0.01 -0.29 0.00 -2.27 0.00 0.00 64.05 61.27 2dwo n THR 128 Cb 0.63 -0.36 -0.10 0.00 -2.10 0.00 0.00 70.33 68.40 2dwo n THR 128 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2dwo s THR 129 N -2.66 3.20 0.34 4.28 -4.23 -1.26 -0.62 115.64 114.69 2dwo s THR 129 Ca 0.25 -1.43 0.03 0.00 -1.18 0.00 0.00 61.69 59.36 2dwo s THR 129 Cb 0.20 -2.52 0.19 0.00 1.34 0.00 0.00 72.50 71.71 2dwo s THR 129 CO 0.49 0.05 1.91 0.03 -0.54 0.00 0.00 174.62 176.56 2dwo h ARG 130 N 3.44 0.64 -0.42 3.99 3.08 -1.89 -2.03 114.38 121.19 2dwo h ARG 130 Ca -0.49 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.46 2dwo h ARG 130 Cb 1.18 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 31.10 2dwo h ARG 130 CO 0.51 0.57 0.27 1.49 -1.07 0.00 0.00 179.97 181.74 2dwo h GLU 131 N 0.63 0.55 -0.35 0.04 4.22 -1.98 0.41 114.58 118.10 2dwo h GLU 131 Ca 0.15 -0.04 -0.09 0.00 0.08 0.00 0.00 59.36 59.46 2dwo h GLU 131 Cb 0.20 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2dwo h GLU 131 CO -0.01 0.38 -0.11 -0.09 -2.18 0.00 0.00 179.01 177.00 2dwo h ARG 132 N 0.56 0.70 -0.62 1.92 9.65 -1.84 -2.49 114.38 122.26 2dwo h ARG 132 Ca 0.15 -0.28 -0.07 0.00 -1.10 0.00 0.00 59.98 58.68 2dwo h ARG 132 Cb -0.04 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.48 2dwo h ARG 132 CO -0.03 0.87 0.10 0.00 2.80 0.00 0.00 179.97 183.71 2dwo h ARG 133 N 0.49 1.00 -0.97 0.20 3.08 -1.14 -2.15 114.38 114.89 2dwo h ARG 133 Ca 0.09 -0.25 0.03 0.00 0.07 0.00 0.00 59.98 59.91 2dwo h ARG 133 Cb 0.63 -0.13 -0.05 0.00 0.08 0.00 0.00 29.97 30.50 2dwo h ARG 133 CO 0.04 0.92 0.64 1.25 -1.07 0.00 0.00 179.97 181.75 2dwo h HIS 134 N 0.95 1.20 -0.76 3.04 2.76 -0.07 0.27 115.15 122.54 2dwo h HIS 134 Ca 0.19 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.36 2dwo h HIS 134 Cb 0.41 -0.40 -0.03 0.00 1.55 0.00 0.00 27.41 28.93 2dwo h HIS 134 CO 0.03 0.71 0.34 1.98 -1.30 0.00 0.00 177.93 179.68 2dwo h MET 135 N 1.25 1.11 -0.45 5.26 1.85 -0.94 -0.87 114.93 122.14 2dwo h MET 135 Ca 0.38 -0.18 -0.14 0.00 -0.61 0.00 0.00 59.70 59.14 2dwo h MET 135 Cb -0.04 -0.19 -0.01 0.00 0.43 0.00 0.00 31.60 31.79 2dwo h MET 135 CO -0.11 0.88 -0.28 0.82 -0.40 0.00 0.00 176.91 177.83 2dwo h ILE 136 N 1.08 1.27 -0.93 1.77 2.04 -0.87 -1.09 117.51 120.77 2dwo h ILE 136 Ca 0.26 -1.45 0.00 0.00 1.00 0.00 0.00 64.86 64.67 2dwo h ILE 136 Cb 0.16 1.21 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 2dwo h ILE 136 CO -0.03 0.49 0.58 0.25 0.00 0.00 0.00 178.15 179.45 2dwo h LEU 137 N 0.83 1.10 -0.27 1.44 5.85 -0.76 0.11 115.31 123.61 2dwo h LEU 137 Ca 0.09 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 2dwo h LEU 137 Cb 0.86 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 2dwo h LEU 137 CO 0.08 0.83 0.10 -0.74 -0.34 0.00 0.00 178.44 178.36 2dwo h HIS 138 N 1.27 0.42 -0.79 1.25 2.76 -0.79 0.41 115.15 119.68 2dwo h HIS 138 Ca 0.34 -0.04 0.07 0.00 -2.20 0.00 0.00 60.37 58.54 2dwo h HIS 138 Cb -0.09 -0.12 -0.06 0.00 1.55 0.00 0.00 27.41 28.69 2dwo h HIS 138 CO 0.00 0.44 0.47 0.35 -1.30 0.00 0.00 177.93 177.89 2dwo h PHE 139 N 0.27 0.86 -0.04 5.26 3.57 -0.58 -1.10 116.94 125.18 2dwo h PHE 139 Ca 0.09 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 2dwo h PHE 139 Cb 0.21 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 38.68 2dwo h PHE 139 CO -0.00 0.42 0.01 0.00 -2.23 0.00 0.00 178.31 176.50 2dwo h ALA 140 N 1.39 0.06 -0.24 2.41 0.00 -0.34 -2.70 119.26 119.84 2dwo h ALA 140 Ca 0.35 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 55.18 2dwo h ALA 140 Cb 0.21 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2dwo h ALA 140 CO -0.19 -0.31 -0.11 -0.22 0.00 0.00 0.00 179.25 178.43 2dwo h LYS 141 N -0.18 -0.08 0.00 0.00 1.63 -0.54 -0.39 116.57 117.01 2dwo h LYS 141 Ca 0.01 0.01 -0.02 0.00 -0.85 0.00 0.00 60.65 59.80 2dwo h LYS 141 Cb 0.27 0.02 -0.00 0.00 -0.60 0.00 0.00 32.23 31.92 2dwo h LYS 141 CO 0.00 -0.05 -0.08 1.05 -3.45 0.00 0.00 179.45 176.92 2dwo h GLU 142 N -0.08 0.00 -0.06 1.90 4.11 -1.21 -2.66 114.58 116.59 2dwo h GLU 142 Ca 0.13 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.56 2dwo h GLU 142 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 2dwo h GLU 142 CO -0.29 0.08 0.00 0.09 0.07 0.00 0.00 179.01 178.96 2dwo n ASN 143 N -3.37 2.88 -2.48 3.06 3.02 -0.83 -4.97 115.26 112.57 2dwo n ASN 143 Ca -0.01 -1.92 -0.15 0.00 -0.03 0.00 0.00 54.58 52.47 2dwo n ASN 143 Cb 0.25 -0.02 0.05 0.00 -0.61 0.00 0.00 39.78 39.45 2dwo n ASN 143 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2dwo n ASP 144 N 1.25 -4.52 -4.66 6.41 9.92 -0.40 -5.03 116.55 119.52 2dwo n ASP 144 Ca 0.13 -0.35 -0.32 0.00 -0.53 0.00 0.00 54.79 53.72 2dwo n ASP 144 Cb 0.55 -3.39 -0.09 0.00 -0.64 0.00 0.00 41.12 37.55 2dwo n ASP 144 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 2dwo s PHE 145 N -3.21 3.02 0.59 1.24 2.99 -0.29 -4.57 117.98 117.75 2dwo s PHE 145 Ca 0.34 0.03 -0.08 0.00 0.00 0.00 0.00 56.93 57.22 2dwo s PHE 145 Cb -0.15 -1.63 -0.02 0.00 0.00 0.00 0.00 43.02 41.23 2dwo s PHE 145 CO 0.46 0.45 0.95 0.15 -0.00 0.00 0.00 175.22 177.23 2dwo s LYS 146 N -1.69 3.26 -0.04 0.44 1.02 -0.55 -4.34 119.74 117.85 2dwo s LYS 146 Ca 0.20 0.36 0.02 0.00 0.02 0.00 0.00 55.97 56.56 2dwo s LYS 146 Cb -0.11 -2.19 0.02 0.00 -0.52 0.00 0.00 37.83 35.02 2dwo s LYS 146 CO 0.11 -0.60 -0.06 0.00 -0.92 0.00 0.00 175.35 173.88 2dwo s ALA 147 N -3.06 0.76 -0.06 5.17 0.00 -1.26 -1.23 121.76 122.09 2dwo s ALA 147 Ca 0.53 -0.15 0.02 0.00 0.00 0.00 0.00 51.96 52.36 2dwo s ALA 147 Cb -0.11 -0.40 0.02 0.00 0.00 0.00 0.00 23.12 22.63 2dwo s ALA 147 CO 0.49 0.04 -0.10 0.12 0.00 0.00 0.00 175.76 176.32 2dwo s PHE 148 N 0.69 1.19 -0.11 0.00 5.36 -0.80 -4.38 117.98 119.94 2dwo s PHE 148 Ca -0.10 -0.41 -0.03 0.00 -0.96 0.00 0.00 56.93 55.43 2dwo s PHE 148 Cb -0.13 -0.91 -0.03 0.00 -0.34 0.00 0.00 43.02 41.61 2dwo s PHE 148 CO 0.01 -0.23 0.01 -0.06 -1.46 0.00 0.00 175.22 173.48 2dwo s PHE 149 N 0.70 3.17 -0.22 10.12 0.40 -0.25 -0.05 117.98 131.86 2dwo s PHE 149 Ca -0.13 0.11 0.02 0.00 -0.60 0.00 0.00 56.93 56.33 2dwo s PHE 149 Cb -0.15 -1.87 0.04 0.00 0.51 0.00 0.00 43.02 41.56 2dwo s PHE 149 CO 0.02 0.35 -0.14 0.42 0.70 0.00 0.00 175.22 176.58 2dwo s ILE 150 N -0.50 2.01 -0.15 0.64 1.01 -0.22 -1.17 121.20 122.83 2dwo s ILE 150 Ca 0.09 -1.26 -0.00 0.00 0.00 0.00 0.00 60.65 59.47 2dwo s ILE 150 Cb -0.12 -2.01 -0.01 0.00 0.01 0.00 0.00 42.46 40.33 2dwo s ILE 150 CO 0.02 0.20 -0.13 -0.70 0.00 0.00 0.00 174.94 174.34 2dwo s GLU 151 N 1.23 3.33 -0.26 2.79 2.12 -0.44 -0.55 118.70 126.92 2dwo s GLU 151 Ca -0.03 -0.70 -0.09 0.00 0.36 0.00 0.00 54.97 54.51 2dwo s GLU 151 Cb -0.17 -2.68 -0.04 0.00 0.26 0.00 0.00 34.13 31.51 2dwo s GLU 151 CO -0.08 0.10 0.13 0.45 -0.54 0.00 0.00 175.26 175.32 2dwo s SER 152 N 0.63 5.61 -0.17 -1.70 0.15 -0.73 -0.02 113.70 117.47 2dwo s SER 152 Ca -0.07 -0.10 -0.02 0.00 0.70 0.00 0.00 55.95 56.46 2dwo s SER 152 Cb -0.15 -2.03 -0.01 0.00 -1.71 0.00 0.00 66.02 62.12 2dwo s SER 152 CO 0.03 -0.04 -0.09 -0.69 1.20 0.00 0.00 173.24 173.65 2dwo s VAL 153 N 1.66 3.17 -0.20 4.45 1.01 0.00 -4.58 120.40 125.91 2dwo s VAL 153 Ca 0.07 -0.59 -0.04 0.00 0.00 0.00 0.00 61.98 61.42 2dwo s VAL 153 Cb -0.15 -2.38 0.10 0.00 0.00 0.00 0.00 36.38 33.94 2dwo s VAL 153 CO 0.07 0.48 0.31 0.00 0.00 0.00 0.00 175.10 175.97 2dwo n ASP 155 N 5.35 4.25 -4.26 0.00 10.43 -1.26 -4.91 116.55 126.15 2dwo n ASP 155 Ca -0.05 -3.78 -0.39 0.00 2.57 0.00 0.00 54.79 53.14 2dwo n ASP 155 Cb 0.50 -0.62 -0.11 0.00 1.84 0.00 0.00 41.12 42.73 2dwo n ASP 155 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2dwo s ASP 156 N -2.69 5.51 0.47 -2.24 -1.08 -1.26 -4.97 116.67 110.41 2dwo s ASP 156 Ca 0.51 -1.40 0.22 0.00 -0.52 0.00 0.00 52.55 51.35 2dwo s ASP 156 Cb 0.43 -1.94 1.22 0.00 -1.46 0.00 0.00 42.92 41.18 2dwo s ASP 156 CO 0.01 -0.46 1.91 1.55 0.52 0.00 0.00 175.17 178.69 2dwo h PRO 157 N 8.32 0.23 -0.65 4.34 0.13 -1.99 0.59 132.00 142.97 2dwo h PRO 157 Ca -0.22 -0.01 -0.06 0.00 -0.87 0.00 0.00 66.00 64.83 2dwo h PRO 157 Cb 1.08 -0.05 -0.03 0.00 0.13 0.00 0.00 31.00 32.13 2dwo h PRO 157 CO 0.70 0.15 0.16 1.15 -0.23 0.00 0.00 178.00 179.94 2dwo h THR 158 N 0.24 1.25 -0.01 1.56 2.02 -1.99 0.13 112.91 116.11 2dwo h THR 158 Ca 0.39 -0.91 -0.00 0.00 0.77 0.00 0.00 66.41 66.66 2dwo h THR 158 Cb 1.18 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 68.17 2dwo h THR 158 CO -0.09 0.35 -0.01 0.58 0.37 0.00 0.00 175.52 176.72 2dwo h VAL 159 N 0.98 1.36 -0.47 3.16 2.07 -1.33 -1.77 116.25 120.25 2dwo h VAL 159 Ca 0.21 -1.08 0.02 0.00 0.82 0.00 0.00 66.70 66.67 2dwo h VAL 159 Cb 0.34 2.07 -0.03 0.00 -1.52 0.00 0.00 31.29 32.15 2dwo h VAL 159 CO -0.00 0.28 0.27 0.58 0.02 0.00 0.00 177.57 178.73 2dwo h VAL 160 N -0.42 1.03 -0.31 2.57 2.07 -1.27 0.82 116.25 120.75 2dwo h VAL 160 Ca 0.00 -0.19 0.03 0.00 0.82 0.00 0.00 66.70 67.37 2dwo h VAL 160 Cb 0.47 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.65 2dwo h VAL 160 CO 0.00 0.10 0.11 0.00 0.02 0.00 0.00 177.57 177.80 2dwo h ALA 161 N 1.22 0.35 -0.56 1.67 0.00 -0.76 -0.45 119.26 120.73 2dwo h ALA 161 Ca 0.19 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2dwo h ALA 161 Cb 0.03 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 2dwo h ALA 161 CO -0.10 -0.29 0.32 1.03 0.00 0.00 0.00 179.25 180.22 2dwo h SER 162 N 0.25 0.68 -0.57 0.00 0.87 -0.80 -1.76 113.55 112.22 2dwo h SER 162 Ca 0.13 -0.08 0.03 0.00 -1.23 0.00 0.00 61.79 60.65 2dwo h SER 162 Cb 0.10 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 61.85 2dwo h SER 162 CO -0.13 0.56 0.35 0.78 -0.53 0.00 0.00 176.83 177.85 2dwo h ASN 163 N 0.75 0.56 -0.47 6.23 -0.26 -0.40 -0.06 115.58 121.92 2dwo h ASN 163 Ca 0.20 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 55.93 2dwo h ASN 163 Cb 0.02 -0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 37.14 2dwo h ASN 163 CO -0.03 0.39 0.24 0.40 -1.06 0.00 0.00 177.43 177.36 2dwo h ILE 164 N 0.68 1.18 -0.22 2.81 2.04 -0.70 -1.80 117.51 121.50 2dwo h ILE 164 Ca 0.23 -0.49 -0.08 0.00 1.00 0.00 0.00 64.86 65.52 2dwo h ILE 164 Cb 0.03 0.64 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 2dwo h ILE 164 CO -0.10 0.19 -0.20 0.24 0.00 0.00 0.00 178.15 178.28 2dwo h MET 165 N 0.61 0.39 0.05 2.37 2.86 -0.92 -1.20 114.93 119.10 2dwo h MET 165 Ca 0.16 -0.13 -0.23 0.00 -2.06 0.00 0.00 59.70 57.44 2dwo h MET 165 Cb 0.09 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 2dwo h MET 165 CO -0.02 0.58 -1.06 1.49 1.06 0.00 0.00 176.91 178.96 2dwo h GLU 166 N 0.36 0.20 0.00 1.72 4.81 -0.70 -3.42 114.58 117.55 2dwo h GLU 166 Ca 0.06 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 2dwo h GLU 166 Cb 0.56 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.04 2dwo h GLU 166 CO 0.04 1.08 -0.28 1.33 -0.73 0.00 0.00 179.01 180.45 2dwo n VAL 167 N -3.55 0.00 -0.08 0.32 0.24 -0.70 -4.75 118.33 109.80 2dwo n VAL 167 Ca -0.05 -0.02 -0.16 0.00 -2.04 0.00 0.00 64.34 62.07 2dwo n VAL 167 Cb 0.92 0.27 -0.11 0.00 -1.47 0.00 0.00 33.84 33.46 2dwo n VAL 167 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2dwo h LYS 168 N 0.00 0.00 -0.03 7.34 1.79 -1.33 -3.25 116.57 121.09 2dwo h LYS 168 Ca 0.00 0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.48 2dwo h LYS 168 Cb 0.00 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2dwo h LYS 168 CO 0.00 0.88 0.04 -0.84 -1.08 0.00 0.00 179.45 178.45 2dwo h ILE 169 N -1.00 0.36 -0.47 1.86 3.07 -1.67 0.13 117.51 119.79 2dwo h ILE 169 Ca -0.14 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.27 2dwo h ILE 169 Cb 1.03 0.96 0.00 0.00 -0.27 0.00 0.00 36.82 38.55 2dwo h ILE 169 CO -0.09 0.00 0.00 -1.54 -1.05 0.00 0.00 178.15 175.47 2dwo n SER 170 N -3.61 3.57 -4.74 2.16 3.41 -1.26 -4.74 113.62 108.41 2dwo n SER 170 Ca -0.02 -1.99 -0.32 0.00 -0.26 0.00 0.00 58.87 56.27 2dwo n SER 170 Cb 0.12 -0.31 0.09 0.00 -0.26 0.00 0.00 64.21 63.86 2dwo n SER 170 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2dwo s SER 171 N -1.38 4.34 0.55 4.04 0.15 0.44 -4.91 113.70 116.94 2dwo s SER 171 Ca 0.41 2.05 0.34 0.00 0.70 0.00 0.00 55.95 59.45 2dwo s SER 171 Cb 0.23 -2.55 1.49 0.00 -1.71 0.00 0.00 66.02 63.49 2dwo s SER 171 CO 0.32 -2.15 2.04 1.55 1.20 0.00 0.00 173.24 176.20 2dwo h PRO 172 N -0.74 0.00 0.00 5.44 0.13 -1.92 -2.42 132.00 132.48 2dwo h PRO 172 Ca -0.45 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.64 2dwo h PRO 172 Cb 1.26 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 2dwo h PRO 172 CO 0.50 0.04 -0.17 -0.44 -0.23 0.00 0.00 178.00 177.70 2dwo h ASP 173 N 0.00 0.00 -0.49 1.44 3.32 -1.91 -2.58 116.42 116.21 2dwo h ASP 173 Ca -0.00 0.00 -0.18 0.00 0.02 0.00 0.00 57.03 56.87 2dwo h ASP 173 Cb 0.44 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.89 2dwo h ASP 173 CO 0.00 0.17 0.11 -1.22 -1.72 0.00 0.00 179.24 176.58 2dwo n TYR 174 N -4.14 1.58 0.29 4.55 4.02 -0.91 -4.60 117.16 117.94 2dwo n TYR 174 Ca -0.02 -1.34 0.17 0.00 -0.01 0.00 0.00 57.90 56.70 2dwo n TYR 174 Cb 0.24 -0.54 0.88 0.00 -0.02 0.00 0.00 39.34 39.91 2dwo n TYR 174 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 176.86 177.42 2dwo h LYS 175 N 1.60 0.00 -0.46 -0.72 2.10 -1.47 -1.35 116.57 116.26 2dwo h LYS 175 Ca 0.22 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.54 2dwo h LYS 175 Cb 1.89 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 32.99 2dwo h LYS 175 CO 0.50 0.00 -0.53 -0.25 -2.00 0.00 0.00 179.45 177.17 2dwo n ASP 176 N -2.75 3.66 -4.13 7.07 8.00 -1.26 -5.01 116.55 122.13 2dwo n ASP 176 Ca -0.02 -3.81 -0.12 0.00 0.71 0.00 0.00 54.79 51.55 2dwo n ASP 176 Cb 0.19 -0.47 -0.11 0.00 -0.02 0.00 0.00 41.12 40.71 2dwo n ASP 176 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dwo s ASN 178 N -2.48 5.71 0.19 0.00 2.20 -1.26 -4.88 114.94 114.42 2dwo s ASN 178 Ca 0.04 -0.22 -0.20 0.00 -0.94 0.00 0.00 52.86 51.54 2dwo s ASN 178 Cb -0.01 -0.95 0.15 0.00 -2.00 0.00 0.00 41.25 38.45 2dwo s ASN 178 CO -0.03 -0.71 1.59 0.28 -2.94 0.00 0.00 177.10 175.29 2dwo h SER 179 N 0.61 -1.13 -0.56 3.54 0.02 -1.97 -1.82 113.55 112.24 2dwo h SER 179 Ca -0.43 0.23 0.11 0.00 -0.84 0.00 0.00 61.79 60.86 2dwo h SER 179 Cb 1.27 0.58 -0.08 0.00 0.14 0.00 0.00 62.40 64.31 2dwo h SER 179 CO 0.50 -0.30 0.09 0.00 -1.14 0.00 0.00 176.83 175.99 2dwo h ALA 180 N 1.11 0.63 0.08 3.77 0.00 -1.99 -0.72 119.26 122.14 2dwo h ALA 180 Ca 0.25 0.13 -0.26 0.00 0.00 0.00 0.00 54.91 55.04 2dwo h ALA 180 Cb 0.55 0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.54 2dwo h ALA 180 CO -0.71 -0.32 -1.13 1.05 0.00 0.00 0.00 179.25 178.13 2dwo h GLU 181 N 0.22 0.37 -0.03 0.00 4.11 -1.87 -2.13 114.58 115.25 2dwo h GLU 181 Ca 0.29 -0.51 -0.00 0.00 0.07 0.00 0.00 59.36 59.21 2dwo h GLU 181 Cb 0.43 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 2dwo h GLU 181 CO -0.40 1.20 0.02 0.00 0.07 0.00 0.00 179.01 179.90 2dwo h ALA 182 N 0.60 0.04 -0.28 1.06 0.00 -1.12 0.51 119.26 120.08 2dwo h ALA 182 Ca -0.12 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.81 2dwo h ALA 182 Cb 1.81 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.55 2dwo h ALA 182 CO 0.19 -0.44 0.03 1.98 0.00 0.00 0.00 179.25 181.01 2dwo h MET 183 N 0.02 0.12 -0.64 0.00 1.85 -1.18 0.17 114.93 115.27 2dwo h MET 183 Ca 0.01 -0.01 -0.02 0.00 -0.61 0.00 0.00 59.70 59.07 2dwo h MET 183 Cb 0.03 -0.03 -0.03 0.00 0.43 0.00 0.00 31.60 32.00 2dwo h MET 183 CO -0.00 0.08 0.31 0.22 -0.40 0.00 0.00 176.91 177.11 2dwo h ASP 184 N 0.12 0.84 -0.67 1.39 1.82 -1.03 -1.57 116.42 117.31 2dwo h ASP 184 Ca 0.13 -0.13 -0.06 0.00 -0.39 0.00 0.00 57.03 56.57 2dwo h ASP 184 Cb 0.15 -0.22 -0.03 0.00 0.68 0.00 0.00 39.33 39.92 2dwo h ASP 184 CO -0.19 0.74 0.17 -0.78 -1.61 0.00 0.00 179.24 177.56 2dwo h ASP 185 N 0.89 1.02 -0.14 2.28 1.82 0.62 -2.70 116.42 120.20 2dwo h ASP 185 Ca 0.22 -0.23 -0.11 0.00 -0.39 0.00 0.00 57.03 56.52 2dwo h ASP 185 Cb 0.12 -0.27 -0.01 0.00 0.68 0.00 0.00 39.33 39.85 2dwo h ASP 185 CO -0.03 0.98 -0.27 0.15 -1.61 0.00 0.00 179.24 178.47 2dwo h PHE 186 N 1.00 0.69 -0.64 0.28 3.57 -0.34 -1.65 116.94 119.85 2dwo h PHE 186 Ca 0.21 -0.16 -0.06 0.00 3.53 0.00 0.00 57.97 61.49 2dwo h PHE 186 Cb 0.36 -0.16 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 2dwo h PHE 186 CO 0.03 0.82 0.15 0.52 -2.23 0.00 0.00 178.31 177.59 2dwo h MET 187 N 0.53 1.01 -0.41 1.11 2.86 -1.13 -0.43 114.93 118.48 2dwo h MET 187 Ca 0.07 -0.23 -0.12 0.00 -2.06 0.00 0.00 59.70 57.36 2dwo h MET 187 Cb 0.74 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.24 2dwo h MET 187 CO 0.06 0.90 -0.23 0.87 1.06 0.00 0.00 176.91 179.57 2dwo h LYS 188 N 0.96 0.82 -0.04 1.72 1.57 -1.29 -2.17 116.57 118.13 2dwo h LYS 188 Ca 0.20 -0.34 0.01 0.00 -1.87 0.00 0.00 60.65 58.66 2dwo h LYS 188 Cb 0.35 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 2dwo h LYS 188 CO 0.00 0.96 -0.02 -0.09 -0.57 0.00 0.00 179.45 179.74 2dwo h ARG 189 N 0.71 -0.02 -0.48 3.15 2.43 -0.80 -2.37 114.38 117.01 2dwo h ARG 189 Ca 0.10 0.00 0.07 0.00 -0.81 0.00 0.00 59.98 59.34 2dwo h ARG 189 Cb 0.75 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.25 2dwo h ARG 189 CO 0.06 -0.01 0.15 0.82 -1.51 0.00 0.00 179.97 179.48 2dwo h ILE 190 N -0.02 0.81 -0.25 1.20 2.04 -0.88 -1.43 117.51 118.98 2dwo h ILE 190 Ca 0.03 -0.11 0.07 0.00 1.00 0.00 0.00 64.86 65.85 2dwo h ILE 190 Cb 0.05 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 2dwo h ILE 190 CO -0.06 0.06 0.24 0.77 0.00 0.00 0.00 178.15 179.17 2dwo h SER 191 N 0.31 0.00 -0.51 1.72 4.64 -0.90 -1.00 113.55 117.80 2dwo h SER 191 Ca 0.23 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.54 2dwo h SER 191 Cb 0.26 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.32 2dwo h SER 191 CO -0.25 0.00 0.29 0.00 -0.87 0.00 0.00 176.83 176.00 2dwo h TYR 193 N 0.74 0.00 -0.68 0.00 -1.99 -1.27 -3.40 116.97 110.37 2dwo h TYR 193 Ca 0.19 0.00 0.09 0.00 2.00 0.00 0.00 58.73 61.01 2dwo h TYR 193 Cb 0.02 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.71 2dwo h TYR 193 CO 0.00 0.03 0.45 0.93 -0.00 0.00 0.00 178.16 179.57 2dwo h GLU 194 N 0.00 0.55 -0.24 4.88 5.08 -1.43 -2.42 114.58 121.00 2dwo h GLU 194 Ca -0.00 -0.03 -0.12 0.00 -1.00 0.00 0.00 59.36 58.21 2dwo h GLU 194 Cb 1.02 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 30.15 2dwo h GLU 194 CO 0.00 0.36 -0.30 0.00 -1.00 0.00 0.00 179.01 178.07 2dwo h ALA 195 N 1.65 0.37 -0.08 3.43 0.00 -1.77 -3.27 119.26 119.60 2dwo h ALA 195 Ca 0.31 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2dwo h ALA 195 Cb 0.48 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2dwo h ALA 195 CO -0.10 0.39 0.00 -1.13 0.00 0.00 0.00 179.25 178.41 2dwo n SER 196 N -4.29 1.82 -4.63 0.00 3.41 -1.15 -4.93 113.62 103.85 2dwo n SER 196 Ca -0.05 -1.64 -0.43 0.00 -0.26 0.00 0.00 58.87 56.50 2dwo n SER 196 Cb 0.48 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.36 2dwo n SER 196 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2dwo s TYR 197 N -1.92 1.79 -0.50 7.33 5.04 -0.92 -4.57 117.35 123.60 2dwo s TYR 197 Ca 0.35 0.31 -0.01 0.00 -2.44 0.00 0.00 57.07 55.29 2dwo s TYR 197 Cb 0.20 -4.01 0.13 0.00 0.35 0.00 0.00 41.96 38.63 2dwo s TYR 197 CO 0.31 -3.72 0.29 -0.65 -1.34 0.00 0.00 175.55 170.43 2dwo s GLN 198 N 4.81 2.15 0.95 4.97 -0.21 0.21 -5.04 119.66 127.51 2dwo s GLN 198 Ca 0.79 -2.24 -0.10 0.00 0.02 0.00 0.00 55.36 53.83 2dwo s GLN 198 Cb -0.31 -3.55 0.16 0.00 1.00 0.00 0.00 33.01 30.32 2dwo s GLN 198 CO 0.32 -1.10 1.12 -0.35 -2.12 0.00 0.00 175.29 173.16 2dwo n PRO 199 N 3.87 -0.70 -1.96 2.91 -0.04 -1.26 -4.65 135.00 133.18 2dwo n PRO 199 Ca 0.04 -0.14 -0.41 0.00 -0.04 0.00 0.00 63.50 62.95 2dwo n PRO 199 Cb 0.38 -2.35 -0.01 0.00 -0.04 0.00 0.00 33.50 31.49 2dwo n PRO 199 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2dwo s LEU 200 N -6.60 4.34 -0.63 1.53 1.43 -1.26 -4.97 118.68 112.51 2dwo s LEU 200 Ca 0.67 2.84 0.05 0.00 -1.03 0.00 0.00 54.13 56.66 2dwo s LEU 200 Cb -0.23 -3.71 0.18 0.00 0.03 0.00 0.00 46.19 42.46 2dwo s LEU 200 CO 0.59 -0.75 0.49 -0.67 0.23 0.00 0.00 176.35 176.24 2dwo n ASP 201 N 0.52 2.30 0.24 2.29 4.64 -1.26 -4.96 116.55 120.32 2dwo n ASP 201 Ca 0.01 -3.05 0.12 0.00 -1.38 0.00 0.00 54.79 50.49 2dwo n ASP 201 Cb 0.41 -0.70 0.74 0.00 -1.04 0.00 0.00 41.12 40.53 2dwo n ASP 201 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 2dwo h PRO 202 N 5.26 0.00 -0.00 -0.67 0.13 -1.94 0.57 132.00 135.35 2dwo h PRO 202 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 2dwo h PRO 202 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 2dwo h PRO 202 CO 0.65 0.00 -0.05 -0.25 -0.23 0.00 0.00 178.00 178.12 2dwo n ASP 203 N -4.26 0.39 0.00 1.44 8.00 -1.26 -3.06 116.55 117.79 2dwo n ASP 203 Ca -0.01 -0.70 0.00 0.00 0.71 0.00 0.00 54.79 54.78 2dwo n ASP 203 Cb 0.16 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 2dwo n ASP 203 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2dwo n LYS 204 N -0.90 0.00 -0.19 -1.24 5.02 -0.80 -4.91 118.16 115.15 2dwo n LYS 204 Ca 0.17 0.00 0.19 0.00 -2.02 0.00 0.00 58.31 56.65 2dwo n LYS 204 Cb 0.24 0.00 0.55 0.00 -0.02 0.00 0.00 35.03 35.79 2dwo n LYS 204 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2dwo n ASP 206 N -4.46 2.43 -0.26 0.00 9.92 0.19 -4.76 116.55 119.61 2dwo n ASP 206 Ca 0.17 -3.74 0.19 0.00 -0.53 0.00 0.00 54.79 50.87 2dwo n ASP 206 Cb 0.65 -0.61 0.50 0.00 -0.64 0.00 0.00 41.12 41.02 2dwo n ASP 206 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2dwo h ARG 207 N 1.02 0.42 -0.09 -1.24 3.08 -1.37 -1.60 114.38 114.60 2dwo h ARG 207 Ca 0.17 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2dwo h ARG 207 Cb 1.54 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.50 2dwo h ARG 207 CO 0.32 0.28 0.00 -0.25 -1.07 0.00 0.00 179.97 179.24 2dwo n ASP 208 N -4.53 2.20 -4.83 7.04 10.43 -1.26 -4.90 116.55 120.69 2dwo n ASP 208 Ca 0.20 -1.74 -0.35 0.00 2.57 0.00 0.00 54.79 55.46 2dwo n ASP 208 Cb 0.71 -0.05 -0.06 0.00 1.84 0.00 0.00 41.12 43.56 2dwo n ASP 208 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 2dwo s LEU 209 N -1.86 4.33 -0.23 0.64 1.43 -0.60 -5.03 118.68 117.36 2dwo s LEU 209 Ca 0.34 1.19 -0.24 0.00 -1.03 0.00 0.00 54.13 54.39 2dwo s LEU 209 Cb 0.20 -3.41 -0.01 0.00 0.03 0.00 0.00 46.19 43.01 2dwo s LEU 209 CO 0.31 0.07 0.81 -0.44 0.23 0.00 0.00 176.35 177.33 2dwo s SER 210 N -1.72 6.84 0.21 2.29 0.01 -1.26 -4.55 113.70 115.52 2dwo s SER 210 Ca 0.40 1.04 -0.22 0.00 1.31 0.00 0.00 55.95 58.49 2dwo s SER 210 Cb -0.15 -2.43 0.05 0.00 0.21 0.00 0.00 66.02 63.69 2dwo s SER 210 CO 0.20 -0.47 0.64 -1.48 0.41 0.00 0.00 173.24 172.53 2dwo s LEU 211 N 2.63 -0.36 -0.04 2.44 0.05 -0.20 -1.09 118.68 122.11 2dwo s LEU 211 Ca 0.35 -0.30 0.01 0.00 0.05 0.00 0.00 54.13 54.24 2dwo s LEU 211 Cb -0.16 2.59 0.02 0.00 -2.05 0.00 0.00 46.19 46.60 2dwo s LEU 211 CO 0.09 -1.13 -0.03 -0.51 -0.55 0.00 0.00 176.35 174.22 2dwo s ILE 212 N -3.83 0.41 -0.28 1.48 2.07 -0.31 -0.14 121.20 120.58 2dwo s ILE 212 Ca 0.06 -0.05 -0.05 0.00 -1.41 0.00 0.00 60.65 59.20 2dwo s ILE 212 Cb -0.03 -0.46 0.01 0.00 0.13 0.00 0.00 42.46 42.12 2dwo s ILE 212 CO -0.04 0.20 0.04 -0.75 -1.91 0.00 0.00 174.94 172.48 2dwo s LYS 213 N 0.96 3.02 -0.30 3.50 2.20 0.84 -1.33 119.74 128.63 2dwo s LYS 213 Ca -0.11 -0.89 -0.19 0.00 -0.36 0.00 0.00 55.97 54.43 2dwo s LYS 213 Cb -0.14 -3.27 -0.02 0.00 -1.51 0.00 0.00 37.83 32.89 2dwo s LYS 213 CO -0.01 -0.43 0.56 0.08 -0.36 0.00 0.00 175.35 175.20 2dwo s VAL 214 N 1.45 5.00 -0.06 4.02 1.01 0.98 -1.95 120.40 130.86 2dwo s VAL 214 Ca 0.02 0.77 0.04 0.00 0.00 0.00 0.00 61.98 62.81 2dwo s VAL 214 Cb -0.17 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.26 2dwo s VAL 214 CO 0.01 -0.06 -0.16 -0.63 0.00 0.00 0.00 175.10 174.25 2dwo s ILE 215 N 2.45 2.87 -1.23 2.22 1.01 -0.44 -0.82 121.20 127.26 2dwo s ILE 215 Ca 0.22 -0.79 -0.10 0.00 0.00 0.00 0.00 60.65 59.99 2dwo s ILE 215 Cb -0.15 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.19 2dwo s ILE 215 CO 0.11 0.58 0.70 0.47 0.00 0.00 0.00 174.94 176.80 2dwo n ASP 216 N 2.52 -3.22 -3.91 3.58 8.00 -1.00 -0.68 116.55 121.84 2dwo n ASP 216 Ca -0.17 -0.94 -0.26 0.00 0.71 0.00 0.00 54.79 54.13 2dwo n ASP 216 Cb 0.52 -3.64 -0.00 0.00 -0.02 0.00 0.00 41.12 37.97 2dwo n ASP 216 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2dwo n VAL 217 N -4.18 -3.16 -0.80 2.53 0.31 -1.26 -2.33 118.33 109.44 2dwo n VAL 217 Ca -0.19 -0.41 0.00 0.00 -0.01 0.00 0.00 64.34 63.73 2dwo n VAL 217 Cb 0.64 -2.89 0.00 0.00 -0.91 0.00 0.00 33.84 30.68 2dwo n VAL 217 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2dwo n GLY 218 N -1.79 0.51 0.09 2.92 0.00 -0.98 -4.85 105.19 101.09 2dwo n GLY 218 Ca -0.24 -0.84 -0.17 0.00 0.00 0.00 0.00 46.02 44.78 2dwo n GLY 218 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2dwo h ARG 219 N 0.08 0.16 -5.66 1.61 9.65 -0.49 -3.47 114.38 116.25 2dwo h ARG 219 Ca 0.00 -0.24 -0.46 0.00 -1.10 0.00 0.00 59.98 58.17 2dwo h ARG 219 Cb 0.00 0.09 -0.18 0.00 -1.39 0.00 0.00 29.97 28.48 2dwo h ARG 219 CO 0.00 1.09 -0.77 0.50 2.80 0.00 0.00 179.97 183.58 2dwo s ARG 220 N -2.47 1.12 0.01 0.20 3.52 -0.94 -5.02 118.95 115.36 2dwo s ARG 220 Ca -0.16 -1.29 0.00 0.00 -0.13 0.00 0.00 55.73 54.15 2dwo s ARG 220 Cb -0.01 -1.09 -0.01 0.00 -1.56 0.00 0.00 34.95 32.28 2dwo s ARG 220 CO 0.76 0.22 -0.01 -0.06 -0.81 0.00 0.00 175.30 175.39 2dwo s PHE 221 N -2.01 0.13 -0.16 5.12 0.40 -1.26 -1.33 117.98 118.86 2dwo s PHE 221 Ca 0.11 -0.26 0.00 0.00 -0.60 0.00 0.00 56.93 56.19 2dwo s PHE 221 Cb -0.06 -0.09 0.03 0.00 0.51 0.00 0.00 43.02 43.41 2dwo s PHE 221 CO 0.04 -0.09 -0.12 -1.17 0.70 0.00 0.00 175.22 174.58 2dwo s LEU 222 N -0.71 1.79 -0.10 -0.37 0.20 -0.82 -4.97 118.68 113.70 2dwo s LEU 222 Ca -0.08 -0.58 0.04 0.00 0.69 0.00 0.00 54.13 54.20 2dwo s LEU 222 Cb -0.05 -1.15 -0.00 0.00 -0.43 0.00 0.00 46.19 44.56 2dwo s LEU 222 CO -0.00 -0.09 -0.23 -0.69 -0.29 0.00 0.00 176.35 175.05 2dwo s VAL 223 N 1.49 2.19 -0.10 1.68 1.01 -1.26 -0.11 120.40 125.30 2dwo s VAL 223 Ca 0.03 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.05 2dwo s VAL 223 Cb -0.14 -1.84 0.02 0.00 0.00 0.00 0.00 36.38 34.42 2dwo s VAL 223 CO -0.10 0.56 -0.12 0.21 0.00 0.00 0.00 175.10 175.64 2dwo s ASN 224 N 0.30 2.16 -0.34 3.32 3.84 0.80 -4.97 114.94 120.04 2dwo s ASN 224 Ca -0.17 -0.36 -0.20 0.00 0.21 0.00 0.00 52.86 52.35 2dwo s ASN 224 Cb -0.17 -0.95 0.03 0.00 -0.55 0.00 0.00 41.25 39.61 2dwo s ASN 224 CO 0.08 -0.01 0.42 -2.11 -2.79 0.00 0.00 177.10 172.69 2dwo n ARG 225 N 4.24 -1.18 -2.11 0.43 1.85 -1.26 -1.03 116.66 117.59 2dwo n ARG 225 Ca -0.19 0.82 -0.42 0.00 -1.00 0.00 0.00 57.85 57.06 2dwo n ARG 225 Cb 0.51 -1.31 -0.03 0.00 -1.05 0.00 0.00 32.46 30.59 2dwo n ARG 225 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2dwo s VAL 226 N -1.30 2.98 -0.12 8.89 1.01 -1.26 -4.45 120.40 126.15 2dwo s VAL 226 Ca 0.20 0.79 -0.00 0.00 0.00 0.00 0.00 61.98 62.96 2dwo s VAL 226 Cb -0.02 -3.50 -0.24 0.00 0.00 0.00 0.00 36.38 32.61 2dwo s VAL 226 CO 0.57 0.11 0.36 0.00 0.00 0.00 0.00 175.10 176.14 2dwo n GLN 227 N 2.84 0.72 -1.94 2.72 6.02 -1.26 -5.02 117.38 121.46 2dwo n GLN 227 Ca 0.08 0.25 -0.01 0.00 -0.01 0.00 0.00 57.00 57.30 2dwo n GLN 227 Cb 0.41 -1.70 -0.00 0.00 1.02 0.00 0.00 30.24 29.97 2dwo n GLN 227 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 2dwo n ASP 228 N -3.33 -0.08 -0.11 1.08 5.68 -1.26 -5.06 116.55 113.48 2dwo n ASP 228 Ca -0.30 -1.15 -0.10 0.00 -0.50 0.00 0.00 54.79 52.74 2dwo n ASP 228 Cb 1.05 0.15 -0.02 0.00 -1.14 0.00 0.00 41.12 41.16 2dwo n ASP 228 CO 0.00 0.00 0.00 1.12 -1.33 0.00 0.00 177.20 176.99 2dwo h HIS 229 N 1.08 0.57 -0.59 2.11 2.07 -1.99 -2.30 115.15 116.10 2dwo h HIS 229 Ca -0.02 -0.07 0.01 0.00 -2.85 0.00 0.00 60.37 57.44 2dwo h HIS 229 Cb 0.09 -0.16 -0.03 0.00 2.57 0.00 0.00 27.41 29.87 2dwo h HIS 229 CO 0.00 0.59 0.38 0.97 -3.07 0.00 0.00 177.93 176.80 2dwo h ILE 230 N 0.38 1.12 -0.67 6.12 6.09 -1.99 0.02 117.51 128.58 2dwo h ILE 230 Ca 0.10 -0.26 -0.03 0.00 -1.37 0.00 0.00 64.86 63.30 2dwo h ILE 230 Cb 0.32 0.29 -0.03 0.00 0.47 0.00 0.00 36.82 37.87 2dwo h ILE 230 CO 0.00 0.14 0.30 1.56 -3.07 0.00 0.00 178.15 177.08 2dwo h GLN 231 N 0.76 0.96 -0.54 2.19 4.20 -1.96 -0.88 115.11 119.83 2dwo h GLN 231 Ca 0.22 -0.14 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 2dwo h GLN 231 Cb -0.04 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.53 2dwo h GLN 231 CO -0.07 0.76 0.33 1.03 -0.67 0.00 0.00 178.83 180.21 2dwo h SER 232 N 0.95 0.64 -0.18 1.46 0.87 -0.64 -0.12 113.55 116.54 2dwo h SER 232 Ca 0.23 -0.05 -0.11 0.00 -1.23 0.00 0.00 61.79 60.63 2dwo h SER 232 Cb 0.13 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 2dwo h SER 232 CO -0.03 0.50 -0.24 0.03 -0.53 0.00 0.00 176.83 176.56 2dwo h ARG 233 N 0.73 0.64 -0.31 2.24 2.47 -0.57 -2.11 114.38 117.46 2dwo h ARG 233 Ca 0.19 -0.25 -0.04 0.00 -1.26 0.00 0.00 59.98 58.62 2dwo h ARG 233 Cb -0.03 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 28.25 2dwo h ARG 233 CO -0.04 0.83 0.04 0.82 0.56 0.00 0.00 179.97 182.17 2dwo h ILE 234 N 0.56 1.24 -0.17 2.04 2.04 -0.75 -1.10 117.51 121.37 2dwo h ILE 234 Ca 0.08 -0.85 -0.00 0.00 1.00 0.00 0.00 64.86 65.09 2dwo h ILE 234 Cb 0.72 1.19 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 2dwo h ILE 234 CO 0.05 0.28 0.10 0.58 0.00 0.00 0.00 178.15 179.17 2dwo h VAL 235 N 0.34 1.07 -0.25 1.67 2.07 -0.93 -0.57 116.25 119.65 2dwo h VAL 235 Ca 0.09 -0.16 0.04 0.00 0.82 0.00 0.00 66.70 67.50 2dwo h VAL 235 Cb 0.37 0.87 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 2dwo h VAL 235 CO 0.01 0.06 -0.02 0.22 0.02 0.00 0.00 177.57 177.86 2dwo h TYR 236 N 0.20 -0.05 0.32 1.57 3.20 -1.26 -1.42 116.97 119.53 2dwo h TYR 236 Ca 0.06 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2dwo h TYR 236 Cb 0.01 0.06 -0.01 0.00 1.54 0.00 0.00 36.73 38.33 2dwo h TYR 236 CO -0.06 -0.06 -0.23 -0.92 -1.64 0.00 0.00 178.16 175.25 2dwo h TYR 237 N 0.05 -0.62 -0.37 -3.82 3.20 -0.94 -2.70 116.97 111.79 2dwo h TYR 237 Ca 0.12 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.07 2dwo h TYR 237 Cb 0.16 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 2dwo h TYR 237 CO -0.21 -0.35 0.26 -0.07 -1.64 0.00 0.00 178.16 176.14 2dwo h LEU 238 N -0.55 0.12 -0.20 2.82 3.38 -0.91 -1.25 115.31 118.72 2dwo h LEU 238 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2dwo h LEU 238 Cb 0.48 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2dwo h LEU 238 CO -0.00 0.08 -0.05 0.23 0.09 0.00 0.00 178.44 178.79 2dwo n MET 239 N -4.46 0.82 0.00 1.13 2.81 -0.55 -3.88 117.12 112.99 2dwo n MET 239 Ca 0.05 -0.20 0.01 0.00 -1.81 0.00 0.00 57.70 55.76 2dwo n MET 239 Cb 0.35 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.37 2dwo n MET 239 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2dwo n ASN 240 N -0.92 0.99 -4.92 7.83 3.02 -0.49 -5.02 115.26 115.75 2dwo n ASN 240 Ca 0.17 -0.99 -0.26 0.00 -0.03 0.00 0.00 54.58 53.47 2dwo n ASN 240 Cb 0.23 0.17 -0.02 0.00 -0.61 0.00 0.00 39.78 39.55 2dwo n ASN 240 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2dwo s ILE 241 N -0.35 5.10 0.30 2.41 -4.36 -1.13 -3.37 121.20 119.81 2dwo s ILE 241 Ca 0.02 -0.25 -0.05 0.00 -0.26 0.00 0.00 60.65 60.11 2dwo s ILE 241 Cb 0.02 -3.78 -0.00 0.00 1.25 0.00 0.00 42.46 39.94 2dwo s ILE 241 CO 0.03 -0.37 0.43 -1.38 0.24 0.00 0.00 174.94 173.90 2dwo s HIS 242 N -2.11 0.91 -0.08 1.37 -3.43 -1.26 -4.94 115.29 105.76 2dwo s HIS 242 Ca 0.41 -1.17 0.07 0.00 -0.80 0.00 0.00 55.06 53.57 2dwo s HIS 242 Cb -0.10 -0.08 0.12 0.00 -1.43 0.00 0.00 32.58 31.08 2dwo s HIS 242 CO 0.32 -1.04 1.07 1.33 -2.00 0.00 0.00 174.74 174.41 2dwo n VAL 243 N -0.49 1.32 -1.98 -5.38 0.24 -1.26 -5.04 118.33 105.74 2dwo n VAL 243 Ca 0.01 -1.44 -0.40 0.00 -2.04 0.00 0.00 64.34 60.46 2dwo n VAL 243 Cb 0.62 0.24 -0.01 0.00 -1.47 0.00 0.00 33.84 33.22 2dwo n VAL 243 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2dwo s GLN 244 N -1.66 4.11 0.38 7.34 1.11 -1.26 -4.94 119.66 124.74 2dwo s GLN 244 Ca 0.12 2.32 -0.26 0.00 0.01 0.00 0.00 55.36 57.55 2dwo s GLN 244 Cb 0.10 -2.91 -0.09 0.00 -1.01 0.00 0.00 33.01 29.11 2dwo s GLN 244 CO 0.02 -0.44 1.13 -1.25 0.01 0.00 0.00 175.29 174.77 2dwo s PRO 245 N -2.07 4.17 0.18 2.91 0.04 -1.26 -5.00 135.00 133.98 2dwo s PRO 245 Ca 0.53 1.77 -0.20 0.00 0.04 0.00 0.00 61.00 63.15 2dwo s PRO 245 Cb -0.42 -2.73 0.07 0.00 0.04 0.00 0.00 34.50 31.46 2dwo s PRO 245 CO 0.55 -0.20 0.95 2.89 0.04 0.00 0.00 177.00 181.23 2dwo n ARG 246 N 0.22 0.63 -4.15 4.56 -4.01 -1.26 -4.92 116.66 107.73 2dwo n ARG 246 Ca 0.04 -1.41 -0.16 0.00 -1.04 0.00 0.00 57.85 55.28 2dwo n ARG 246 Cb 0.47 1.90 -0.14 0.00 -3.04 0.00 0.00 32.46 31.65 2dwo n ARG 246 CO 0.00 0.00 0.00 0.99 -3.04 0.00 0.00 177.63 175.58 2dwo s THR 247 N -2.10 0.40 -0.16 8.89 2.01 -1.26 -4.38 115.64 119.05 2dwo s THR 247 Ca 0.21 -0.22 -0.01 0.00 0.31 0.00 0.00 61.69 61.98 2dwo s THR 247 Cb -0.03 -0.34 -0.01 0.00 0.01 0.00 0.00 72.50 72.13 2dwo s THR 247 CO 0.05 0.11 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.35 2dwo s ILE 248 N -0.13 3.05 -0.10 1.82 1.01 -0.43 -2.37 121.20 124.05 2dwo s ILE 248 Ca 0.02 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.04 2dwo s ILE 248 Cb -0.02 -2.31 -0.02 0.00 0.01 0.00 0.00 42.46 40.12 2dwo s ILE 248 CO -0.00 0.50 -0.13 -0.31 0.00 0.00 0.00 174.94 175.00 2dwo s TYR 249 N 0.71 2.78 -0.02 3.97 1.51 0.06 -0.15 117.35 126.21 2dwo s TYR 249 Ca -0.05 -0.42 0.05 0.00 -1.01 0.00 0.00 57.07 55.63 2dwo s TYR 249 Cb -0.15 -1.76 -0.01 0.00 -0.11 0.00 0.00 41.96 39.93 2dwo s TYR 249 CO 0.02 -0.03 -0.17 -0.51 -1.11 0.00 0.00 175.55 173.75 2dwo s LEU 250 N -0.10 1.99 0.14 -1.29 1.43 -0.68 -0.09 118.68 120.07 2dwo s LEU 250 Ca -0.01 -0.32 -0.24 0.00 -1.03 0.00 0.00 54.13 52.53 2dwo s LEU 250 Cb -0.14 -0.90 0.07 0.00 0.03 0.00 0.00 46.19 45.26 2dwo s LEU 250 CO 0.04 0.19 0.67 0.00 0.23 0.00 0.00 176.35 177.47 2dwo s ARG 252 N -3.65 2.52 0.81 0.00 0.52 -1.26 -0.89 118.95 116.99 2dwo s ARG 252 Ca 0.03 -0.55 -0.13 0.00 -0.52 0.00 0.00 55.73 54.56 2dwo s ARG 252 Cb -0.01 -2.39 0.08 0.00 0.52 0.00 0.00 34.95 33.15 2dwo s ARG 252 CO -0.10 -0.82 1.20 -3.38 0.02 0.00 0.00 175.30 172.22 2dwo s HIS 253 N -2.90 1.83 0.87 -0.53 -3.43 -0.50 -4.69 115.29 105.94 2dwo s HIS 253 Ca 0.57 1.67 -0.11 0.00 -0.80 0.00 0.00 55.06 56.39 2dwo s HIS 253 Cb -0.10 -3.47 0.12 0.00 -1.43 0.00 0.00 32.58 27.70 2dwo s HIS 253 CO 0.41 -2.81 1.15 0.20 -2.00 0.00 0.00 174.74 171.68 2dwo s GLY 254 N -2.20 1.77 0.22 -1.38 0.00 -1.26 -4.65 107.32 99.83 2dwo s GLY 254 Ca 0.73 0.59 -0.30 0.00 0.00 0.00 0.00 44.72 45.74 2dwo s GLY 254 CO 0.51 1.00 0.98 -2.21 0.00 0.00 0.00 173.10 173.37 2dwo n GLU 255 N -3.97 1.00 -4.66 2.90 2.13 -1.26 -4.81 120.64 111.97 2dwo n GLU 255 Ca 0.12 0.35 -0.29 0.00 0.66 0.00 0.00 57.16 58.00 2dwo n GLU 255 Cb 0.52 -1.70 -0.10 0.00 0.27 0.00 0.00 31.44 30.43 2dwo n GLU 255 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2dwo s ASN 256 N -0.43 3.91 0.35 4.31 2.20 -1.26 -1.20 114.94 122.82 2dwo s ASN 256 Ca 0.66 -1.46 0.03 0.00 -0.94 0.00 0.00 52.86 51.15 2dwo s ASN 256 Cb -0.81 -0.12 0.66 0.00 -2.00 0.00 0.00 41.25 38.98 2dwo s ASN 256 CO 0.56 -0.57 1.99 -0.33 -2.94 0.00 0.00 177.10 175.81 2dwo h GLU 257 N 1.66 0.81 -0.20 3.55 4.39 -1.69 -0.58 114.58 122.52 2dwo h GLU 257 Ca -0.44 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.12 2dwo h GLU 257 Cb 1.26 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.72 2dwo h GLU 257 CO 0.79 0.54 -0.28 0.45 -1.16 0.00 0.00 179.01 179.35 2dwo h HIS 258 N 0.84 0.42 -0.26 4.33 3.86 -1.88 -2.40 115.15 120.06 2dwo h HIS 258 Ca 0.27 -0.09 -0.01 0.00 -1.16 0.00 0.00 60.37 59.38 2dwo h HIS 258 Cb 0.03 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 28.39 2dwo h HIS 258 CO -0.00 0.62 0.14 -0.91 0.86 0.00 0.00 177.93 178.64 2dwo h ASN 259 N 0.33 0.33 -0.93 2.45 2.35 -1.34 0.13 115.58 118.90 2dwo h ASN 259 Ca 0.05 -0.09 0.11 0.00 -0.55 0.00 0.00 56.30 55.81 2dwo h ASN 259 Cb 0.66 -0.08 -0.07 0.00 0.05 0.00 0.00 38.32 38.88 2dwo h ASN 259 CO 0.05 0.33 0.60 -0.07 -1.65 0.00 0.00 177.43 176.68 2dwo h LEU 260 N 0.30 0.83 -0.56 1.61 3.38 -1.04 -0.58 115.31 119.25 2dwo h LEU 260 Ca 0.09 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2dwo h LEU 260 Cb 0.07 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.69 2dwo h LEU 260 CO -0.01 0.47 -0.03 0.00 0.09 0.00 0.00 178.44 178.95 2dwo n GLN 261 N -4.56 1.28 -2.29 1.13 6.02 -0.93 -4.92 117.38 113.11 2dwo n GLN 261 Ca 0.17 -0.56 -0.13 0.00 -0.01 0.00 0.00 57.00 56.46 2dwo n GLN 261 Cb 0.34 -1.49 -0.00 0.00 1.02 0.00 0.00 30.24 30.10 2dwo n GLN 261 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dwo n GLY 262 N 1.15 -0.17 3.87 1.08 0.00 -0.23 -4.91 105.19 105.99 2dwo n GLY 262 Ca 0.19 -0.32 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 2dwo n GLY 262 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2dwo s ARG 263 N -4.71 3.38 0.22 1.61 0.52 0.28 -3.90 118.95 116.34 2dwo s ARG 263 Ca 0.02 -0.24 -0.02 0.00 -0.52 0.00 0.00 55.73 54.97 2dwo s ARG 263 Cb -0.01 -3.11 -0.04 0.00 0.52 0.00 0.00 34.95 32.31 2dwo s ARG 263 CO 0.02 0.73 0.43 0.96 0.02 0.00 0.00 175.30 177.46 2dwo s ILE 264 N -1.13 5.16 0.00 1.52 -4.36 0.36 -4.43 121.20 118.32 2dwo s ILE 264 Ca 0.20 -0.26 0.00 0.00 -0.26 0.00 0.00 60.65 60.32 2dwo s ILE 264 Cb -0.12 -3.73 0.00 0.00 1.25 0.00 0.00 42.46 39.86 2dwo s ILE 264 CO 0.10 -0.21 0.00 0.61 0.24 0.00 0.00 174.94 175.68 2dwo n GLY 265 N -0.72 1.32 2.04 6.27 0.00 -1.26 -0.65 105.19 112.19 2dwo n GLY 265 Ca -0.04 -0.68 0.05 0.00 0.00 0.00 0.00 46.02 45.35 2dwo n GLY 265 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dwo n GLY 266 N 0.00 -2.04 2.49 -0.02 0.00 -1.26 -4.74 105.19 99.62 2dwo n GLY 266 Ca 0.00 -1.38 -0.12 0.00 0.00 0.00 0.00 46.02 44.52 2dwo n GLY 266 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2dwo n ASP 267 N -1.71 1.18 -4.87 1.61 2.03 -1.26 -5.02 116.55 108.51 2dwo n ASP 267 Ca 0.00 -2.82 -0.31 0.00 0.52 0.00 0.00 54.79 52.19 2dwo n ASP 267 Cb 0.17 -0.54 0.03 0.00 -0.72 0.00 0.00 41.12 40.06 2dwo n ASP 267 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2dwo s SER 268 N -2.85 5.89 0.66 1.67 1.04 -1.26 -4.69 113.70 114.16 2dwo s SER 268 Ca 0.32 1.31 -0.02 0.00 0.48 0.00 0.00 55.95 58.03 2dwo s SER 268 Cb 0.42 -2.25 0.08 0.00 0.10 0.00 0.00 66.02 64.37 2dwo s SER 268 CO -0.00 -1.08 0.93 -0.83 0.98 0.00 0.00 173.24 173.24 2dwo s GLY 269 N -4.25 1.77 0.36 7.32 0.00 -1.26 -3.58 107.32 107.68 2dwo s GLY 269 Ca 0.56 -1.34 -0.28 0.00 0.00 0.00 0.00 44.72 43.66 2dwo s GLY 269 CO 0.53 -0.92 1.34 1.08 0.00 0.00 0.00 173.10 175.13 2dwo s LEU 270 N -5.05 4.36 1.00 0.66 1.43 -1.26 -1.97 118.68 117.85 2dwo s LEU 270 Ca 0.62 2.75 -0.17 0.00 -1.03 0.00 0.00 54.13 56.30 2dwo s LEU 270 Cb -0.09 -3.71 0.23 0.00 0.03 0.00 0.00 46.19 42.65 2dwo s LEU 270 CO 0.42 -0.67 1.34 -0.94 0.23 0.00 0.00 176.35 176.73 2dwo s SER 271 N -0.48 2.75 0.32 2.29 1.04 -0.34 -4.75 113.70 114.53 2dwo s SER 271 Ca 0.51 0.19 0.03 0.00 0.48 0.00 0.00 55.95 57.16 2dwo s SER 271 Cb -0.41 -0.15 0.55 0.00 0.10 0.00 0.00 66.02 66.11 2dwo s SER 271 CO 0.54 -2.96 1.87 0.77 0.98 0.00 0.00 173.24 174.44 2dwo h SER 272 N -1.80 0.59 -0.17 7.02 4.64 -1.96 -1.69 113.55 120.17 2dwo h SER 272 Ca -0.44 -0.10 -0.11 0.00 -0.47 0.00 0.00 61.79 60.67 2dwo h SER 272 Cb 1.22 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 2dwo h SER 272 CO 0.33 0.62 -0.31 0.03 -0.87 0.00 0.00 176.83 176.62 2dwo h ARG 273 N 0.62 0.52 -0.94 4.77 3.08 -1.89 -2.54 114.38 117.99 2dwo h ARG 273 Ca 0.14 -0.33 0.14 0.00 0.07 0.00 0.00 59.98 60.00 2dwo h ARG 273 Cb 0.29 0.04 -0.09 0.00 0.08 0.00 0.00 29.97 30.28 2dwo h ARG 273 CO 0.00 0.93 0.56 0.78 -1.07 0.00 0.00 179.97 181.17 2dwo h GLY 274 N 0.17 1.55 1.55 0.04 0.00 -1.54 0.16 103.07 104.99 2dwo h GLY 274 Ca 0.01 -0.35 -0.08 0.00 0.00 0.00 0.00 47.33 46.91 2dwo h GLY 274 CO 0.07 0.06 -0.14 0.50 0.00 0.00 0.00 176.54 177.04 2dwo h LYS 275 N 0.83 0.54 -0.57 4.80 1.57 -1.22 -0.57 116.57 121.96 2dwo h LYS 275 Ca 0.49 -0.16 -0.10 0.00 -1.87 0.00 0.00 60.65 59.00 2dwo h LYS 275 Cb 0.59 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.83 2dwo h LYS 275 CO -0.31 0.67 -0.06 0.87 -0.57 0.00 0.00 179.45 180.05 2dwo h LYS 276 N 0.49 1.03 -0.80 3.15 1.57 -0.41 -2.27 116.57 119.33 2dwo h LYS 276 Ca 0.09 -0.35 -0.00 0.00 -1.87 0.00 0.00 60.65 58.52 2dwo h LYS 276 Cb 0.53 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.72 2dwo h LYS 276 CO 0.03 1.04 0.50 0.35 -0.57 0.00 0.00 179.45 180.80 2dwo h PHE 277 N 0.93 1.05 -0.53 -1.35 3.57 -0.13 -0.71 116.94 119.78 2dwo h PHE 277 Ca 0.15 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.70 2dwo h PHE 277 Cb 0.61 -0.35 -0.04 0.00 2.79 0.00 0.00 35.95 38.96 2dwo h PHE 277 CO 0.04 0.69 0.29 0.00 -2.23 0.00 0.00 178.31 177.10 2dwo h ALA 278 N 1.27 0.68 -0.54 2.41 0.00 -0.71 0.51 119.26 122.87 2dwo h ALA 278 Ca 0.29 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 2dwo h ALA 278 Cb -0.06 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2dwo h ALA 278 CO -0.06 -0.03 0.18 0.77 0.00 0.00 0.00 179.25 180.11 2dwo h SER 279 N 0.56 0.77 -0.35 0.00 0.02 -0.99 -1.65 113.55 111.91 2dwo h SER 279 Ca 0.22 -0.20 -0.06 0.00 -0.84 0.00 0.00 61.79 60.91 2dwo h SER 279 Cb 0.09 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 2dwo h SER 279 CO -0.13 0.76 0.01 0.00 -1.14 0.00 0.00 176.83 176.33 2dwo h ALA 280 N 1.04 1.19 -0.83 3.77 0.00 -0.35 -1.97 119.26 122.11 2dwo h ALA 280 Ca 0.18 -0.24 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2dwo h ALA 280 Cb 0.26 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 2dwo h ALA 280 CO -0.01 0.53 0.37 1.25 0.00 0.00 0.00 179.25 181.40 2dwo h LEU 281 N 0.67 1.11 -0.80 0.00 5.85 0.38 0.44 115.31 122.96 2dwo h LEU 281 Ca 0.14 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.68 2dwo h LEU 281 Cb 0.40 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 2dwo h LEU 281 CO 0.01 0.95 0.39 -1.28 -0.34 0.00 0.00 178.44 178.17 2dwo h SER 282 N 1.19 1.04 -0.25 1.25 0.87 -0.66 -0.27 113.55 116.72 2dwo h SER 282 Ca 0.28 -0.13 -0.03 0.00 -1.23 0.00 0.00 61.79 60.68 2dwo h SER 282 Cb 0.15 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 2dwo h SER 282 CO -0.03 0.88 0.03 0.50 -0.53 0.00 0.00 176.83 177.68 2dwo h LYS 283 N 1.13 0.42 -0.56 2.24 3.64 -0.72 -1.83 116.57 120.89 2dwo h LYS 283 Ca 0.28 -0.12 0.03 0.00 -1.27 0.00 0.00 60.65 59.57 2dwo h LYS 283 Cb 0.11 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 31.84 2dwo h LYS 283 CO -0.04 0.56 0.32 0.35 -2.27 0.00 0.00 179.45 178.38 2dwo h PHE 284 N 0.23 0.60 -0.47 1.91 3.57 -0.58 -0.85 116.94 121.35 2dwo h PHE 284 Ca 0.08 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.59 2dwo h PHE 284 Cb 0.35 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.88 2dwo h PHE 284 CO 0.02 0.33 0.25 0.28 -2.23 0.00 0.00 178.31 176.96 2dwo h VAL 285 N 0.63 1.17 -0.53 1.41 2.07 -0.92 -1.92 116.25 118.15 2dwo h VAL 285 Ca 0.24 -0.44 0.06 0.00 0.82 0.00 0.00 66.70 67.38 2dwo h VAL 285 Cb 0.07 0.60 -0.05 0.00 -1.52 0.00 0.00 31.29 30.39 2dwo h VAL 285 CO -0.12 0.18 0.24 -0.08 0.02 0.00 0.00 177.57 177.81 2dwo h GLU 286 N 0.62 0.45 0.00 1.57 4.81 -0.97 -1.93 114.58 119.13 2dwo h GLU 286 Ca 0.16 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2dwo h GLU 286 Cb 0.06 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.34 2dwo h GLU 286 CO -0.03 0.30 0.00 1.05 -0.73 0.00 0.00 179.01 179.60 2dwo h GLU 287 N 0.46 0.00 0.00 1.92 4.11 -0.73 -2.57 114.58 117.77 2dwo h GLU 287 Ca 0.25 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.68 2dwo h GLU 287 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2dwo h GLU 287 CO -0.21 0.00 0.00 1.96 0.07 0.00 0.00 179.01 180.83 2dwo h GLN 288 N 0.00 0.00 -5.85 1.06 1.08 -0.57 -3.47 115.11 107.36 2dwo h GLN 288 Ca 0.00 0.00 -0.35 0.00 -1.45 0.00 0.00 58.65 56.85 2dwo h GLN 288 Cb 0.57 0.00 0.13 0.00 -0.05 0.00 0.00 27.48 28.13 2dwo h GLN 288 CO 0.00 0.00 -0.88 -1.71 -0.95 0.00 0.00 178.83 175.29 2dwo n ASN 289 N -3.08 -5.12 -4.72 1.46 2.85 -0.97 -4.96 115.26 100.73 2dwo n ASN 289 Ca 0.01 -0.84 -0.37 0.00 -0.11 0.00 0.00 54.58 53.27 2dwo n ASN 289 Cb 0.33 -4.34 -0.07 0.00 1.24 0.00 0.00 39.78 36.94 2dwo n ASN 289 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 2dwo s LEU 290 N -6.04 4.23 0.10 1.20 1.43 -1.26 -4.99 118.68 113.36 2dwo s LEU 290 Ca 0.38 0.57 -0.31 0.00 -1.03 0.00 0.00 54.13 53.74 2dwo s LEU 290 Cb -0.09 -2.47 -0.12 0.00 0.03 0.00 0.00 46.19 43.54 2dwo s LEU 290 CO 0.80 0.05 1.50 0.50 0.23 0.00 0.00 176.35 179.42 2dwo h LYS 291 N 6.82 -0.54 -5.51 1.70 1.63 -2.01 -3.42 116.57 115.24 2dwo h LYS 291 Ca -0.40 0.04 -0.44 0.00 -0.85 0.00 0.00 60.65 59.00 2dwo h LYS 291 Cb 1.17 0.12 -0.19 0.00 -0.60 0.00 0.00 32.23 32.73 2dwo h LYS 291 CO 0.75 -0.36 -0.77 -0.51 -3.45 0.00 0.00 179.45 175.11 2dwo s ASP 292 N -4.59 2.05 -0.23 4.20 1.01 -1.26 -5.15 116.67 112.69 2dwo s ASP 292 Ca -0.14 -0.77 -0.10 0.00 0.71 0.00 0.00 52.55 52.25 2dwo s ASP 292 Cb 0.06 -0.08 0.09 0.00 1.01 0.00 0.00 42.92 44.00 2dwo s ASP 292 CO 0.55 -0.11 0.53 -0.22 0.21 0.00 0.00 175.17 176.13 2dwo s LEU 293 N -2.31 -0.68 0.05 1.23 2.96 -1.26 -4.61 118.68 114.06 2dwo s LEU 293 Ca 0.07 1.21 -0.14 0.00 -0.22 0.00 0.00 54.13 55.05 2dwo s LEU 293 Cb -0.06 1.78 -0.06 0.00 0.50 0.00 0.00 46.19 48.35 2dwo s LEU 293 CO 0.03 -0.22 0.44 -0.13 -1.32 0.00 0.00 176.35 175.16 2dwo s ARG 294 N 2.16 3.92 -0.12 1.98 1.81 -0.48 -4.96 118.95 123.28 2dwo s ARG 294 Ca -0.06 0.41 0.03 0.00 -1.72 0.00 0.00 55.73 54.38 2dwo s ARG 294 Cb -0.10 -3.13 0.01 0.00 -0.45 0.00 0.00 34.95 31.28 2dwo s ARG 294 CO -0.16 0.63 -0.21 0.08 -0.68 0.00 0.00 175.30 174.97 2dwo s VAL 295 N -1.20 1.89 0.01 3.52 1.01 -1.26 -0.30 120.40 124.06 2dwo s VAL 295 Ca 0.28 -0.89 0.08 0.00 0.00 0.00 0.00 61.98 61.45 2dwo s VAL 295 Cb -0.16 -1.67 -0.02 0.00 0.00 0.00 0.00 36.38 34.53 2dwo s VAL 295 CO 0.16 0.52 -0.25 0.26 0.00 0.00 0.00 175.10 175.78 2dwo s TRP 296 N 0.70 2.24 0.32 5.22 0.51 -0.10 -0.24 118.94 127.59 2dwo s TRP 296 Ca -0.11 -0.42 0.03 0.00 -2.12 0.00 0.00 56.10 53.49 2dwo s TRP 296 Cb -0.16 -1.40 -0.04 0.00 -0.81 0.00 0.00 33.47 31.06 2dwo s TRP 296 CO 0.02 0.03 0.13 0.95 -0.51 0.00 0.00 176.95 177.57 2dwo s THR 297 N -0.68 0.54 0.00 2.01 -4.23 -0.09 -0.28 115.64 112.91 2dwo s THR 297 Ca 0.10 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.61 2dwo s THR 297 Cb -0.10 -2.54 0.00 0.00 1.34 0.00 0.00 72.50 71.20 2dwo s THR 297 CO 0.00 0.00 0.00 -1.54 -0.54 0.00 0.00 174.62 172.54 2dwo n SER 298 N -0.90 0.00 -1.24 3.99 3.41 -1.23 -0.57 113.62 117.08 2dwo n SER 298 Ca -0.01 -0.68 0.11 0.00 -0.26 0.00 0.00 58.87 58.03 2dwo n SER 298 Cb 0.65 0.00 0.30 0.00 -0.26 0.00 0.00 64.21 64.90 2dwo n SER 298 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dwo n GLN 299 N -0.68 2.78 -3.22 4.33 6.02 -1.22 -4.18 117.38 121.20 2dwo n GLN 299 Ca 0.00 -2.57 -0.38 0.00 -0.01 0.00 0.00 57.00 54.04 2dwo n GLN 299 Cb 0.00 -1.53 -0.06 0.00 1.02 0.00 0.00 30.24 29.67 2dwo n GLN 299 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2dwo s LEU 300 N -1.02 4.50 0.25 1.08 1.43 -1.26 -4.99 118.68 118.67 2dwo s LEU 300 Ca 0.45 1.32 -0.10 0.00 -1.03 0.00 0.00 54.13 54.76 2dwo s LEU 300 Cb 0.23 -3.06 0.37 0.00 0.03 0.00 0.00 46.19 43.77 2dwo s LEU 300 CO 0.30 0.23 1.59 0.50 0.23 0.00 0.00 176.35 179.20 2dwo h LYS 301 N 4.30 0.00 -0.78 1.70 3.64 -1.84 -2.72 116.57 120.86 2dwo h LYS 301 Ca -0.49 -0.00 0.07 0.00 -1.27 0.00 0.00 60.65 58.96 2dwo h LYS 301 Cb 1.21 -0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.97 2dwo h LYS 301 CO 0.64 0.00 0.46 0.66 -2.27 0.00 0.00 179.45 178.95 2dwo h SER 302 N 0.00 0.71 0.32 4.20 4.64 -1.88 0.11 113.55 121.64 2dwo h SER 302 Ca 0.41 0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.62 2dwo h SER 302 Cb 0.63 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.59 2dwo h SER 302 CO -0.86 0.44 -0.54 0.71 -0.87 0.00 0.00 176.83 175.72 2dwo h THR 303 N 0.84 1.36 -0.22 2.95 1.35 -1.82 -2.53 112.91 114.84 2dwo h THR 303 Ca 0.35 -1.83 -0.13 0.00 -0.55 0.00 0.00 66.41 64.25 2dwo h THR 303 Cb 0.21 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.53 2dwo h THR 303 CO -0.19 0.54 -0.39 0.40 -0.25 0.00 0.00 175.52 175.64 2dwo h ILE 304 N 0.19 1.32 -0.83 6.82 2.04 -1.22 -1.63 117.51 124.21 2dwo h ILE 304 Ca 0.00 -1.60 -0.01 0.00 1.00 0.00 0.00 64.86 64.25 2dwo h ILE 304 Cb 1.01 1.80 -0.04 0.00 -0.74 0.00 0.00 36.82 38.85 2dwo h ILE 304 CO 0.08 0.50 0.48 1.56 0.00 0.00 0.00 178.15 180.78 2dwo h GLN 305 N 0.35 1.13 -0.10 2.37 4.20 -0.80 -0.08 115.11 122.18 2dwo h GLN 305 Ca 0.01 -0.11 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 2dwo h GLN 305 Cb 0.98 -0.23 -0.00 0.00 0.30 0.00 0.00 27.48 28.52 2dwo h GLN 305 CO 0.09 0.80 0.06 1.15 -0.67 0.00 0.00 178.83 180.25 2dwo h THR 306 N 1.14 1.07 -0.06 -0.54 2.02 -1.28 -2.57 112.91 112.69 2dwo h THR 306 Ca 0.30 -0.18 -0.05 0.00 0.77 0.00 0.00 66.41 67.25 2dwo h THR 306 Cb -0.03 1.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 2dwo h THR 306 CO -0.05 0.06 -0.21 0.00 0.37 0.00 0.00 175.52 175.69 2dwo h ALA 307 N 0.98 1.54 -0.64 6.16 0.00 -0.89 -2.61 119.26 123.81 2dwo h ALA 307 Ca 0.03 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.76 2dwo h ALA 307 Cb 0.05 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 2dwo h ALA 307 CO -0.01 0.33 0.43 0.93 0.00 0.00 0.00 179.25 180.93 2dwo h GLU 308 N 0.09 0.70 0.00 0.00 4.39 -0.60 -1.10 114.58 118.06 2dwo h GLU 308 Ca 0.02 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2dwo h GLU 308 Cb 0.43 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 2dwo h GLU 308 CO 0.03 0.47 0.00 0.00 -1.16 0.00 0.00 179.01 178.34 2dwo h ALA 309 N 1.63 1.00 0.00 3.43 0.00 -1.39 -2.62 119.26 121.31 2dwo h ALA 309 Ca 0.26 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 2dwo h ALA 309 Cb 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2dwo h ALA 309 CO -0.08 0.00 -0.33 -0.07 0.00 0.00 0.00 179.25 178.77 2dwo h LEU 310 N 0.00 0.00 -0.94 0.00 3.38 -1.32 -3.44 115.31 113.00 2dwo h LEU 310 Ca 0.00 0.00 -0.40 0.00 0.09 0.00 0.00 57.88 57.57 2dwo h LEU 310 Cb 0.20 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.08 2dwo h LEU 310 CO 0.00 0.33 -0.69 0.54 0.09 0.00 0.00 178.44 178.71 2dwo n ARG 311 N -3.24 -7.74 -4.17 1.13 1.74 -0.99 -5.00 116.66 98.38 2dwo n ARG 311 Ca 0.02 0.82 -0.17 0.00 -0.77 0.00 0.00 57.85 57.75 2dwo n ARG 311 Cb 0.62 -5.87 -0.12 0.00 -1.02 0.00 0.00 32.46 26.07 2dwo n ARG 311 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2dwo s LEU 312 N -7.22 2.24 0.36 0.55 1.43 -1.26 -5.12 118.68 109.66 2dwo s LEU 312 Ca 0.53 -0.55 -0.28 0.00 -1.03 0.00 0.00 54.13 52.81 2dwo s LEU 312 Cb -0.24 -0.43 -0.10 0.00 0.03 0.00 0.00 46.19 45.46 2dwo s LEU 312 CO 0.74 -0.09 1.35 -2.16 0.23 0.00 0.00 176.35 176.42 2dwo s PRO 313 N -1.53 4.20 0.11 1.29 0.04 -1.26 -4.94 135.00 132.90 2dwo s PRO 313 Ca -0.03 2.29 0.01 0.00 0.04 0.00 0.00 61.00 63.31 2dwo s PRO 313 Cb -0.09 -2.97 -0.04 0.00 0.04 0.00 0.00 34.50 31.44 2dwo s PRO 313 CO 0.01 -0.35 -0.05 1.52 0.04 0.00 0.00 177.00 178.18 2dwo s TYR 314 N -1.16 0.89 -0.09 0.56 -0.85 -1.26 -4.11 117.35 111.33 2dwo s TYR 314 Ca 0.52 -0.96 0.03 0.00 -0.52 0.00 0.00 57.07 56.14 2dwo s TYR 314 Cb -0.41 -0.53 0.01 0.00 0.38 0.00 0.00 41.96 41.41 2dwo s TYR 314 CO 0.54 -0.20 -0.18 -2.00 -1.52 0.00 0.00 175.55 172.19 2dwo s GLU 315 N -3.87 2.44 -0.07 -3.49 2.12 0.67 -4.99 118.70 111.51 2dwo s GLU 315 Ca 0.14 -0.66 -0.22 0.00 0.36 0.00 0.00 54.97 54.58 2dwo s GLU 315 Cb 0.06 -1.91 -0.04 0.00 0.26 0.00 0.00 34.13 32.50 2dwo s GLU 315 CO -0.04 0.09 0.65 -0.65 -0.54 0.00 0.00 175.26 174.77 2dwo s GLN 316 N 0.55 4.41 -0.18 4.30 -0.21 -1.26 -0.91 119.66 126.36 2dwo s GLN 316 Ca -0.16 0.79 0.01 0.00 0.02 0.00 0.00 55.36 56.02 2dwo s GLN 316 Cb -0.17 -3.44 0.02 0.00 1.00 0.00 0.00 33.01 30.42 2dwo s GLN 316 CO 0.06 0.10 -0.19 -1.58 -2.12 0.00 0.00 175.29 171.55 2dwo s TRP 317 N 0.70 2.78 0.43 0.91 0.52 0.27 -4.93 118.94 119.62 2dwo s TRP 317 Ca 0.35 -1.56 0.18 0.00 0.02 0.00 0.00 56.10 55.09 2dwo s TRP 317 Cb -0.17 -1.92 1.09 0.00 -1.15 0.00 0.00 33.47 31.32 2dwo s TRP 317 CO 0.17 -0.76 1.99 -0.22 0.02 0.00 0.00 176.95 178.14 2dwo h LYS 318 N 7.86 0.00 0.00 4.98 3.64 -1.90 -1.28 116.57 129.87 2dwo h LYS 318 Ca -0.44 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 2dwo h LYS 318 Cb 1.15 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 2dwo h LYS 318 CO 0.63 0.19 0.00 0.00 -2.27 0.00 0.00 179.45 178.00 2dwo h ALA 319 N 1.81 1.00 -0.02 5.00 0.00 -1.94 -1.79 119.26 123.32 2dwo h ALA 319 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2dwo h ALA 319 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.16 2dwo h ALA 319 CO 0.02 0.00 -0.02 1.28 0.00 0.00 0.00 179.25 180.53 2dwo n LEU 320 N -2.59 1.60 -4.76 0.00 4.77 -0.49 -4.68 117.00 110.85 2dwo n LEU 320 Ca -0.00 -0.53 -0.39 0.00 -0.03 0.00 0.00 56.01 55.06 2dwo n LEU 320 Cb 0.16 -0.01 0.02 0.00 -2.33 0.00 0.00 43.42 41.26 2dwo n LEU 320 CO 0.18 0.27 1.02 0.20 -1.33 0.00 0.00 177.39 177.74 2dwo s ASN 321 N -2.04 5.80 0.85 -1.43 0.02 -0.68 -4.51 114.94 112.96 2dwo s ASN 321 Ca 0.36 2.82 -0.13 0.00 -1.02 0.00 0.00 52.86 54.90 2dwo s ASN 321 Cb 0.21 -2.65 0.09 0.00 0.02 0.00 0.00 41.25 38.92 2dwo s ASN 321 CO 0.35 -1.22 1.02 1.21 0.02 0.00 0.00 177.10 178.48 2dwo n GLU 322 N -0.36 -0.06 -1.59 -0.60 4.07 -1.26 -4.86 120.64 115.97 2dwo n GLU 322 Ca 0.06 0.05 -0.46 0.00 -0.06 0.00 0.00 57.16 56.76 2dwo n GLU 322 Cb 0.43 -2.29 -0.02 0.00 -0.06 0.00 0.00 31.44 29.50 2dwo n GLU 322 CO 0.00 0.00 0.00 1.51 -0.06 0.00 0.00 177.13 178.58 2dwo n ILE 323 N -3.54 1.52 -2.88 6.31 3.06 -1.26 -4.88 119.36 117.69 2dwo n ILE 323 Ca 0.12 -0.38 -0.42 0.00 -2.50 0.00 0.00 62.75 59.56 2dwo n ILE 323 Cb 0.51 -0.98 -0.04 0.00 0.54 0.00 0.00 39.64 39.67 2dwo n ILE 323 CO 0.00 0.00 0.00 -0.62 -2.50 0.00 0.00 176.55 173.43 2dwo s ASP 324 N -0.30 6.59 -0.00 9.51 -1.08 -1.26 -4.86 116.67 125.27 2dwo s ASP 324 Ca 0.64 0.40 0.01 0.00 -0.52 0.00 0.00 52.55 53.08 2dwo s ASP 324 Cb -0.75 -2.43 0.04 0.00 -1.46 0.00 0.00 42.92 38.32 2dwo s ASP 324 CO 0.56 -0.83 0.92 0.00 0.52 0.00 0.00 175.17 176.34 2dwo n ALA 325 N 6.68 2.51 -0.75 3.66 0.00 -1.26 0.17 120.51 131.53 2dwo n ALA 325 Ca 0.05 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2dwo n ALA 325 Cb 0.48 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.93 2dwo n ALA 325 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dwo n GLY 326 N 0.44 3.74 0.00 0.00 0.00 -1.26 -1.10 105.19 107.01 2dwo n GLY 326 Ca 0.01 0.15 0.12 0.00 0.00 0.00 0.00 46.02 46.31 2dwo n GLY 326 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2dwo n VAL 327 N 0.00 0.13 0.97 1.61 0.24 -0.55 -2.84 118.33 117.88 2dwo n VAL 327 Ca 0.00 0.03 0.12 0.00 -2.04 0.00 0.00 64.34 62.45 2dwo n VAL 327 Cb 0.00 -0.64 0.10 0.00 -1.47 0.00 0.00 33.84 31.83 2dwo n VAL 327 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2dwo n GLU 329 N 1.32 2.51 -0.43 0.00 -0.58 -1.13 -2.05 120.64 120.28 2dwo n GLU 329 Ca 0.14 0.88 0.00 0.00 -0.42 0.00 0.00 57.16 57.76 2dwo n GLU 329 Cb 0.59 -2.64 0.00 0.00 -0.57 0.00 0.00 31.44 28.81 2dwo n GLU 329 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2dwo n GLU 330 N 0.23 0.00 -3.22 3.49 -0.58 0.17 -4.94 120.64 115.79 2dwo n GLU 330 Ca 0.03 0.00 -0.29 0.00 -0.42 0.00 0.00 57.16 56.47 2dwo n GLU 330 Cb 0.40 -1.90 -0.03 0.00 -0.57 0.00 0.00 31.44 29.34 2dwo n GLU 330 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2dwo s LEU 331 N 0.00 4.01 0.47 -4.62 1.02 -0.87 -4.64 118.68 114.04 2dwo s LEU 331 Ca 0.00 0.84 -0.04 0.00 0.02 0.00 0.00 54.13 54.95 2dwo s LEU 331 Cb 0.00 -3.67 -0.03 0.00 0.02 0.00 0.00 46.19 42.51 2dwo s LEU 331 CO 0.00 -0.24 0.75 0.42 0.02 0.00 0.00 176.35 177.31 2dwo s THR 332 N -2.13 4.86 0.45 5.49 -4.23 -1.26 -0.49 115.64 118.33 2dwo s THR 332 Ca 0.46 0.08 0.16 0.00 -1.18 0.00 0.00 61.69 61.21 2dwo s THR 332 Cb -0.11 -3.84 0.20 0.00 1.34 0.00 0.00 72.50 70.10 2dwo s THR 332 CO 0.29 -0.78 2.01 1.88 -0.54 0.00 0.00 174.62 177.49 2dwo h TYR 333 N 0.29 0.00 -0.29 3.99 -1.99 -1.96 -1.65 116.97 115.36 2dwo h TYR 333 Ca -0.47 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.25 2dwo h TYR 333 Cb 1.21 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 39.93 2dwo h TYR 333 CO 0.56 0.16 0.15 1.49 -0.00 0.00 0.00 178.16 180.53 2dwo h GLU 334 N 0.00 0.41 0.00 4.88 4.22 -1.92 -0.17 114.58 122.00 2dwo h GLU 334 Ca -0.00 -0.05 -0.07 0.00 0.08 0.00 0.00 59.36 59.31 2dwo h GLU 334 Cb 0.30 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 2dwo h GLU 334 CO 0.02 0.38 -0.33 0.93 -2.18 0.00 0.00 179.01 177.83 2dwo h GLU 335 N 0.34 0.00 -0.07 1.92 5.08 -1.74 -1.27 114.58 118.83 2dwo h GLU 335 Ca 0.10 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.42 2dwo h GLU 335 Cb 0.09 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 2dwo h GLU 335 CO -0.01 0.33 -0.09 0.82 -1.00 0.00 0.00 179.01 179.05 2dwo h ILE 336 N 0.00 1.38 -0.90 3.13 2.04 -0.85 0.12 117.51 122.44 2dwo h ILE 336 Ca -0.00 -1.29 0.01 0.00 1.00 0.00 0.00 64.86 64.57 2dwo h ILE 336 Cb 0.60 2.07 -0.04 0.00 -0.74 0.00 0.00 36.82 38.70 2dwo h ILE 336 CO 0.04 0.36 0.58 -0.09 0.00 0.00 0.00 178.15 179.04 2dwo h ARG 337 N -0.25 1.19 0.09 2.37 2.43 -0.82 0.72 114.38 120.11 2dwo h ARG 337 Ca 0.01 -0.08 -0.23 0.00 -0.81 0.00 0.00 59.98 58.87 2dwo h ARG 337 Cb 0.62 -0.26 0.02 0.00 -0.42 0.00 0.00 29.97 29.93 2dwo h ARG 337 CO 0.02 0.80 -0.97 -0.44 -1.51 0.00 0.00 179.97 177.87 2dwo h ASP 338 N 1.22 0.69 0.36 -3.80 3.32 -1.19 -2.78 116.42 114.24 2dwo h ASP 338 Ca 0.33 -0.84 -0.32 0.00 0.02 0.00 0.00 57.03 56.22 2dwo h ASP 338 Cb -0.12 -0.22 0.02 0.00 0.22 0.00 0.00 39.33 39.23 2dwo h ASP 338 CO -0.07 1.46 -1.51 0.74 -1.72 0.00 0.00 179.24 178.14 2dwo h THR 339 N 0.02 1.22 -2.07 0.35 2.02 -0.63 -3.39 112.91 110.43 2dwo h THR 339 Ca -0.15 -2.75 -0.56 0.00 0.77 0.00 0.00 66.41 63.72 2dwo h THR 339 Cb 1.69 2.90 -0.42 0.00 -1.74 0.00 0.00 68.15 70.59 2dwo h THR 339 CO 0.19 0.84 -0.77 -1.22 0.37 0.00 0.00 175.52 174.93 2dwo n TYR 340 N -3.59 3.21 -0.29 3.16 4.02 0.25 -4.94 117.16 118.98 2dwo n TYR 340 Ca -0.17 -3.79 0.09 0.00 -0.01 0.00 0.00 57.90 54.03 2dwo n TYR 340 Cb 1.07 -0.41 0.22 0.00 -0.02 0.00 0.00 39.34 40.20 2dwo n TYR 340 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 2dwo h PRO 341 N 2.92 0.13 -0.40 -0.72 0.13 -1.55 0.23 132.00 132.74 2dwo h PRO 341 Ca 0.14 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.23 2dwo h PRO 341 Cb 0.67 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.75 2dwo h PRO 341 CO 0.76 0.08 0.13 1.49 -0.23 0.00 0.00 178.00 180.23 2dwo h GLU 342 N 0.13 0.62 -0.54 0.86 4.81 -1.91 -1.56 114.58 116.99 2dwo h GLU 342 Ca 0.49 -0.13 -0.03 0.00 -0.13 0.00 0.00 59.36 59.56 2dwo h GLU 342 Cb 0.94 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 2dwo h GLU 342 CO -0.70 0.62 0.21 0.93 -0.73 0.00 0.00 179.01 179.33 2dwo h GLU 343 N 0.50 0.81 0.05 1.92 4.39 -1.55 -0.52 114.58 120.19 2dwo h GLU 343 Ca 0.13 -0.15 0.02 0.00 0.34 0.00 0.00 59.36 59.70 2dwo h GLU 343 Cb 0.25 -0.13 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 2dwo h GLU 343 CO -0.00 0.72 -0.19 -0.92 -1.16 0.00 0.00 179.01 177.45 2dwo h TYR 344 N 0.73 -0.49 -0.61 4.33 3.20 -0.85 -0.86 116.97 122.42 2dwo h TYR 344 Ca 0.18 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.03 2dwo h TYR 344 Cb 0.21 0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.67 2dwo h TYR 344 CO 0.01 -0.27 0.28 0.00 -1.64 0.00 0.00 178.16 176.53 2dwo h ALA 345 N 0.53 0.79 -0.77 1.82 0.00 -1.14 -2.30 119.26 118.19 2dwo h ALA 345 Ca 0.04 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2dwo h ALA 345 Cb 0.38 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 2dwo h ALA 345 CO -0.14 0.37 0.51 -0.07 0.00 0.00 0.00 179.25 179.92 2dwo h LEU 346 N 0.84 0.87 -1.03 0.00 3.38 -0.78 -2.10 115.31 116.50 2dwo h LEU 346 Ca 0.21 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.08 2dwo h LEU 346 Cb 0.15 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2dwo h LEU 346 CO -0.02 0.62 -0.15 -0.09 0.09 0.00 0.00 178.44 178.89 2dwo h ARG 347 N 1.03 0.52 0.00 1.13 2.43 -0.96 -2.32 114.38 116.21 2dwo h ARG 347 Ca 0.29 -0.16 -0.07 0.00 -0.81 0.00 0.00 59.98 59.23 2dwo h ARG 347 Cb -0.09 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 2dwo h ARG 347 CO -0.07 0.66 -0.32 0.93 -1.51 0.00 0.00 179.97 179.66 2dwo h GLU 348 N 0.48 0.00 0.00 0.20 5.08 -0.83 -0.54 114.58 118.97 2dwo h GLU 348 Ca 0.08 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 2dwo h GLU 348 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 2dwo h GLU 348 CO 0.03 0.32 -0.84 -0.56 -1.00 0.00 0.00 179.01 176.96 2dwo h GLN 349 N 0.00 0.00 -1.17 2.33 3.07 -1.02 -3.41 115.11 114.92 2dwo h GLN 349 Ca -0.00 0.00 -0.38 0.00 0.09 0.00 0.00 58.65 58.35 2dwo h GLN 349 Cb 0.66 0.00 -0.29 0.00 0.08 0.00 0.00 27.48 27.92 2dwo h GLN 349 CO 0.04 0.08 -0.88 -3.47 0.09 0.00 0.00 178.83 174.69 2dwo n ASP 350 N -2.83 -0.58 0.12 0.06 4.64 -0.91 -5.00 116.55 112.06 2dwo n ASP 350 Ca -0.01 -3.26 0.15 0.00 -1.38 0.00 0.00 54.79 50.30 2dwo n ASP 350 Cb 0.60 0.44 0.69 0.00 -1.04 0.00 0.00 41.12 41.81 2dwo n ASP 350 CO 0.00 0.00 0.00 0.50 -0.82 0.00 0.00 177.20 176.88 2dwo h LYS 351 N 3.13 0.00 -0.00 -0.67 3.64 -1.32 0.10 116.57 121.45 2dwo h LYS 351 Ca 0.01 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.29 2dwo h LYS 351 Cb 1.01 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.84 2dwo h LYS 351 CO 0.35 0.00 -0.40 -0.92 -2.27 0.00 0.00 179.45 176.22 2dwo h TYR 352 N 0.00 0.40 0.00 1.91 3.20 -1.86 -3.37 116.97 117.26 2dwo h TYR 352 Ca 0.14 -0.22 -0.09 0.00 3.14 0.00 0.00 58.73 61.69 2dwo h TYR 352 Cb 0.56 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.77 2dwo h TYR 352 CO 0.00 1.03 -0.84 1.88 -1.64 0.00 0.00 178.16 178.59 2dwo h TYR 353 N -0.34 0.00 -2.39 -3.82 -1.99 -1.85 -2.76 116.97 103.82 2dwo h TYR 353 Ca -0.05 0.00 -0.58 0.00 2.00 0.00 0.00 58.73 60.10 2dwo h TYR 353 Cb 1.14 0.00 0.06 0.00 2.00 0.00 0.00 36.73 39.93 2dwo h TYR 353 CO 0.17 0.38 0.79 0.98 -0.00 0.00 0.00 178.16 180.47 2dwo n TYR 354 N -3.00 2.31 -4.82 4.88 9.36 0.32 -4.30 117.16 121.91 2dwo n TYR 354 Ca -0.02 0.27 -0.33 0.00 3.32 0.00 0.00 57.90 61.15 2dwo n TYR 354 Cb 0.71 -2.54 -0.14 0.00 -0.63 0.00 0.00 39.34 36.73 2dwo n TYR 354 CO 0.00 0.00 0.00 0.50 0.22 0.00 0.00 176.86 177.58 2dwo s ARG 355 N 0.70 3.29 0.56 2.98 3.52 -0.19 -3.90 118.95 125.91 2dwo s ARG 355 Ca 0.77 -0.70 -0.20 0.00 -0.13 0.00 0.00 55.73 55.46 2dwo s ARG 355 Cb -0.66 -2.59 -0.04 0.00 -1.56 0.00 0.00 34.95 30.10 2dwo s ARG 355 CO 0.39 0.24 1.25 0.71 -0.81 0.00 0.00 175.30 177.08 2dwo s TYR 356 N 0.26 2.42 -0.10 5.12 1.51 -0.92 -4.80 117.35 120.85 2dwo s TYR 356 Ca -0.10 1.48 -0.29 0.00 -1.01 0.00 0.00 57.07 57.15 2dwo s TYR 356 Cb -0.16 -3.56 -0.06 0.00 -0.11 0.00 0.00 41.96 38.07 2dwo s TYR 356 CO 0.06 -2.32 2.00 -2.14 -1.11 0.00 0.00 175.55 172.03 2dwo s PRO 357 N -3.11 3.72 -1.02 -1.71 0.02 -1.26 0.15 135.00 131.78 2dwo s PRO 357 Ca 0.74 2.24 0.00 0.00 0.02 0.00 0.00 61.00 64.00 2dwo s PRO 357 Cb -0.33 -4.21 0.00 0.00 0.02 0.00 0.00 34.50 29.97 2dwo s PRO 357 CO 0.37 -1.43 0.00 0.25 -0.33 0.00 0.00 177.00 175.87 2dwo n THR 358 N 6.48 0.00 -2.00 0.99 -2.24 -1.26 -1.48 114.28 114.77 2dwo n THR 358 Ca 0.23 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.01 2dwo n THR 358 Cb 0.43 -1.19 0.00 0.00 -2.10 0.00 0.00 70.33 67.47 2dwo n THR 358 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dwo n GLY 359 N -1.46 5.15 3.60 3.38 0.00 0.12 -4.33 105.19 111.66 2dwo n GLY 359 Ca -0.10 -1.64 -0.27 0.00 0.00 0.00 0.00 46.02 44.01 2dwo n GLY 359 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dwo s GLU 360 N 2.00 1.95 0.39 1.61 2.02 0.13 -4.50 118.70 122.29 2dwo s GLU 360 Ca 0.00 -2.16 0.05 0.00 0.02 0.00 0.00 54.97 52.88 2dwo s GLU 360 Cb 0.00 -1.26 -0.06 0.00 0.10 0.00 0.00 34.13 32.91 2dwo s GLU 360 CO 0.00 -0.24 0.04 -1.54 0.02 0.00 0.00 175.26 173.54 2dwo s SER 361 N -3.69 3.21 0.35 -0.19 1.04 -1.25 -2.16 113.70 111.02 2dwo s SER 361 Ca 0.25 -1.44 0.10 0.00 0.48 0.00 0.00 55.95 55.34 2dwo s SER 361 Cb 0.06 -0.08 0.66 0.00 0.10 0.00 0.00 66.02 66.76 2dwo s SER 361 CO 0.13 -0.61 1.82 1.88 0.98 0.00 0.00 173.24 177.44 2dwo h TYR 362 N 1.86 0.16 -0.73 5.02 -1.99 -1.69 -1.84 116.97 117.76 2dwo h TYR 362 Ca -0.42 -0.03 0.01 0.00 2.00 0.00 0.00 58.73 60.29 2dwo h TYR 362 Cb 1.25 -0.04 -0.04 0.00 2.00 0.00 0.00 36.73 39.90 2dwo h TYR 362 CO 0.84 0.45 0.48 0.37 -0.00 0.00 0.00 178.16 180.29 2dwo h GLN 363 N 0.13 0.94 -0.33 4.88 4.15 -1.86 -0.89 115.11 122.13 2dwo h GLN 363 Ca 0.02 -0.06 -0.11 0.00 0.77 0.00 0.00 58.65 59.27 2dwo h GLN 363 Cb 0.62 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.08 2dwo h GLN 363 CO 0.04 0.62 -0.26 -0.44 -1.93 0.00 0.00 178.83 176.87 2dwo h ASP 364 N 0.97 0.68 -0.17 -0.69 3.32 -1.76 -2.90 116.42 115.87 2dwo h ASP 364 Ca 0.27 -0.25 0.03 0.00 0.02 0.00 0.00 57.03 57.11 2dwo h ASP 364 Cb -0.08 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.25 2dwo h ASP 364 CO -0.07 0.91 -0.04 -0.07 -1.72 0.00 0.00 179.24 178.26 2dwo h LEU 365 N 0.58 -0.14 -0.55 1.55 3.38 -0.51 -0.43 115.31 119.19 2dwo h LEU 365 Ca 0.08 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.17 2dwo h LEU 365 Cb 0.74 0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.53 2dwo h LEU 365 CO 0.06 -0.05 0.22 0.58 0.09 0.00 0.00 178.44 179.34 2dwo h VAL 366 N 0.01 0.83 -0.79 1.22 2.07 -1.08 0.21 116.25 118.72 2dwo h VAL 366 Ca 0.08 -0.14 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 2dwo h VAL 366 Cb 0.12 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.24 2dwo h VAL 366 CO -0.17 0.08 0.35 1.56 0.02 0.00 0.00 177.57 179.41 2dwo h GLN 367 N 0.42 1.15 -0.32 1.57 1.08 -1.26 -1.93 115.11 115.82 2dwo h GLN 367 Ca 0.27 -0.19 -0.05 0.00 -1.45 0.00 0.00 58.65 57.23 2dwo h GLN 367 Cb 0.28 -0.20 -0.02 0.00 -0.05 0.00 0.00 27.48 27.50 2dwo h GLN 367 CO -0.25 0.91 -0.02 0.00 -0.95 0.00 0.00 178.83 178.52 2dwo h ARG 368 N 1.13 0.51 0.00 1.46 3.08 0.07 -3.08 114.38 117.55 2dwo h ARG 368 Ca 0.27 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.20 2dwo h ARG 368 Cb 0.16 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.14 2dwo h ARG 368 CO -0.03 0.55 -0.26 1.28 -1.07 0.00 0.00 179.97 180.44 2dwo n LEU 369 N -4.27 0.32 -0.23 3.04 4.77 0.61 -4.31 117.00 116.93 2dwo n LEU 369 Ca 0.01 0.28 0.01 0.00 -0.03 0.00 0.00 56.01 56.28 2dwo n LEU 369 Cb 0.26 -0.36 0.09 0.00 -2.33 0.00 0.00 43.42 41.08 2dwo n LEU 369 CO 0.39 0.03 0.76 -0.33 -1.33 0.00 0.00 177.39 176.91 2dwo h GLU 370 N 0.00 0.03 -0.02 3.23 5.08 -1.29 0.13 114.58 121.74 2dwo h GLU 370 Ca 0.00 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2dwo h GLU 370 Cb 0.54 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 2dwo h GLU 370 CO 0.00 0.02 -0.10 -1.35 -1.00 0.00 0.00 179.01 176.58 2dwo h PRO 371 N 0.03 0.02 -0.18 2.33 0.11 -1.82 -0.42 132.00 132.07 2dwo h PRO 371 Ca 0.34 -0.00 -0.07 0.00 0.11 0.00 0.00 66.00 66.38 2dwo h PRO 371 Cb 0.54 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.65 2dwo h PRO 371 CO -0.67 0.12 -0.17 0.28 -0.21 0.00 0.00 178.00 177.35 2dwo h VAL 372 N 0.02 1.33 -0.44 3.15 2.07 -1.07 -1.33 116.25 119.99 2dwo h VAL 372 Ca 0.00 -1.32 0.01 0.00 0.82 0.00 0.00 66.70 66.22 2dwo h VAL 372 Cb 0.19 1.79 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 2dwo h VAL 372 CO 0.01 0.40 0.28 0.40 0.02 0.00 0.00 177.57 178.68 2dwo h ILE 373 N 0.09 1.08 -0.64 4.57 1.08 -0.65 0.90 117.51 123.94 2dwo h ILE 373 Ca 0.03 -0.19 -0.02 0.00 -0.39 0.00 0.00 64.86 64.28 2dwo h ILE 373 Cb 0.70 0.47 -0.03 0.00 -3.07 0.00 0.00 36.82 34.89 2dwo h ILE 373 CO 0.04 0.10 0.31 -0.03 -0.69 0.00 0.00 178.15 177.89 2dwo h MET 374 N 0.56 0.92 -0.11 2.37 4.05 -1.01 -0.54 114.93 121.17 2dwo h MET 374 Ca 0.17 -0.13 -0.13 0.00 -0.28 0.00 0.00 59.70 59.32 2dwo h MET 374 Cb -0.03 -0.17 -0.01 0.00 -0.80 0.00 0.00 31.60 30.59 2dwo h MET 374 CO -0.06 0.73 -0.50 1.49 0.23 0.00 0.00 176.91 178.81 2dwo h GLU 375 N 0.88 0.30 -0.46 0.39 4.57 -0.92 -2.60 114.58 116.74 2dwo h GLU 375 Ca 0.22 -0.17 -0.06 0.00 -1.18 0.00 0.00 59.36 58.17 2dwo h GLU 375 Cb 0.12 0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 28.70 2dwo h GLU 375 CO -0.03 0.73 0.04 -0.07 -1.18 0.00 0.00 179.01 178.51 2dwo h LEU 376 N 0.24 0.68 -0.72 1.64 3.38 -0.18 -1.33 115.31 119.02 2dwo h LEU 376 Ca 0.01 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 2dwo h LEU 376 Cb 0.97 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 2dwo h LEU 376 CO 0.08 0.73 0.21 -0.33 0.09 0.00 0.00 178.44 179.21 2dwo h GLU 377 N 0.69 1.13 -0.25 1.13 4.39 -0.82 -3.07 114.58 117.78 2dwo h GLU 377 Ca 0.14 -0.26 -0.13 0.00 0.34 0.00 0.00 59.36 59.46 2dwo h GLU 377 Cb 0.37 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 2dwo h GLU 377 CO 0.01 0.98 -0.39 0.00 -1.16 0.00 0.00 179.01 178.45 2dwo h ARG 378 N 1.08 0.58 0.00 2.33 3.08 -1.04 -3.39 114.38 117.02 2dwo h ARG 378 Ca 0.23 -0.29 -0.34 0.00 0.07 0.00 0.00 59.98 59.64 2dwo h ARG 378 Cb 0.33 0.00 0.17 0.00 0.08 0.00 0.00 29.97 30.55 2dwo h ARG 378 CO -0.00 0.88 0.13 1.04 -1.07 0.00 0.00 179.97 180.94 2dwo n GLN 379 N -4.04 -2.69 0.00 0.04 1.13 -0.56 -4.98 117.38 106.29 2dwo n GLN 379 Ca -0.02 -1.53 0.00 0.00 -1.94 0.00 0.00 57.00 53.51 2dwo n GLN 379 Cb 0.51 -1.39 0.00 0.00 0.11 0.00 0.00 30.24 29.47 2dwo n GLN 379 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 2dwo n GLU 380 N -4.29 0.00 -2.67 -1.09 1.02 -1.26 -5.02 120.64 107.33 2dwo n GLU 380 Ca 0.13 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.85 2dwo n GLU 380 Cb 0.51 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.90 2dwo n GLU 380 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2dwo s ASN 381 N 0.27 7.28 -0.06 1.62 0.01 -1.26 -4.25 114.94 118.54 2dwo s ASN 381 Ca 0.00 1.63 -0.06 0.00 -0.71 0.00 0.00 52.86 53.72 2dwo s ASN 381 Cb 0.00 -2.56 0.02 0.00 0.41 0.00 0.00 41.25 39.11 2dwo s ASN 381 CO 0.00 -0.37 0.18 -0.69 -1.51 0.00 0.00 177.10 174.70 2dwo s VAL 382 N 1.53 0.01 -0.15 1.60 1.01 -1.00 -1.38 120.40 122.02 2dwo s VAL 382 Ca 0.51 -0.07 0.01 0.00 0.00 0.00 0.00 61.98 62.44 2dwo s VAL 382 Cb -0.20 -0.28 0.01 0.00 0.00 0.00 0.00 36.38 35.90 2dwo s VAL 382 CO 0.23 -0.04 -0.19 -0.22 0.00 0.00 0.00 175.10 174.89 2dwo s LEU 383 N -0.05 2.26 -0.26 3.92 2.96 0.59 -0.76 118.68 127.34 2dwo s LEU 383 Ca -0.01 -0.56 -0.05 0.00 -0.22 0.00 0.00 54.13 53.29 2dwo s LEU 383 Cb -0.02 -1.50 0.00 0.00 0.50 0.00 0.00 46.19 45.18 2dwo s LEU 383 CO 0.00 0.07 0.00 -0.69 -1.32 0.00 0.00 176.35 174.42 2dwo s VAL 384 N 0.90 3.53 -0.40 1.68 1.01 0.87 -0.92 120.40 127.06 2dwo s VAL 384 Ca -0.04 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.15 2dwo s VAL 384 Cb -0.15 -2.73 0.04 0.00 0.00 0.00 0.00 36.38 33.54 2dwo s VAL 384 CO -0.03 0.24 0.25 -0.63 0.00 0.00 0.00 175.10 174.93 2dwo s ILE 385 N 1.46 4.67 0.00 2.22 1.01 0.61 -1.90 121.20 129.27 2dwo s ILE 385 Ca 0.03 -0.97 0.00 0.00 0.00 0.00 0.00 60.65 59.71 2dwo s ILE 385 Cb -0.16 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.63 2dwo s ILE 385 CO -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 174.94 174.59 2dwo s HIS 387 N 3.03 1.56 0.08 0.00 3.76 -1.26 -1.41 115.29 121.05 2dwo s HIS 387 Ca 0.00 -1.05 -0.23 0.00 -0.15 0.00 0.00 55.06 53.64 2dwo s HIS 387 Cb 0.00 -0.93 -0.09 0.00 1.11 0.00 0.00 32.58 32.68 2dwo s HIS 387 CO 0.00 -0.18 1.37 0.37 -0.85 0.00 0.00 174.74 175.45 2dwo h GLN 388 N 2.42 -0.36 -0.35 1.40 4.15 -1.97 0.19 115.11 120.59 2dwo h GLN 388 Ca -0.38 0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.07 2dwo h GLN 388 Cb 1.23 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.98 2dwo h GLN 388 CO 0.63 -0.24 0.21 0.00 -1.93 0.00 0.00 178.83 177.51 2dwo h ALA 389 N -0.63 0.44 -0.44 3.38 0.00 -1.98 -1.03 119.26 119.00 2dwo h ALA 389 Ca 0.03 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2dwo h ALA 389 Cb 0.45 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 2dwo h ALA 389 CO -0.32 -0.13 0.21 0.28 0.00 0.00 0.00 179.25 179.29 2dwo h VAL 390 N 0.44 0.95 -0.68 0.00 2.07 -1.86 -1.75 116.25 115.42 2dwo h VAL 390 Ca 0.14 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 2dwo h VAL 390 Cb -0.01 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 2dwo h VAL 390 CO -0.05 0.08 0.29 0.25 0.02 0.00 0.00 177.57 178.15 2dwo h LEU 391 N 0.42 0.92 -0.66 2.57 5.85 -0.35 -1.37 115.31 122.69 2dwo h LEU 391 Ca 0.19 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.82 2dwo h LEU 391 Cb 0.12 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 40.85 2dwo h LEU 391 CO -0.15 0.83 0.36 0.03 -0.34 0.00 0.00 178.44 179.17 2dwo h ARG 392 N 0.95 0.64 -0.43 1.25 3.08 -0.67 0.13 114.38 119.33 2dwo h ARG 392 Ca 0.23 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.20 2dwo h ARG 392 Cb 0.18 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 2dwo h ARG 392 CO -0.02 0.42 0.11 0.00 -1.07 0.00 0.00 179.97 179.41 2dwo h LEU 394 N 0.56 0.24 -1.08 0.00 3.38 -0.87 -2.56 115.31 114.98 2dwo h LEU 394 Ca 0.14 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2dwo h LEU 394 Cb 0.31 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 40.96 2dwo h LEU 394 CO 0.00 0.29 0.51 0.25 0.09 0.00 0.00 178.44 179.57 2dwo h LEU 395 N 0.18 1.00 -1.59 1.67 5.85 -0.61 -1.62 115.31 120.19 2dwo h LEU 395 Ca 0.06 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.74 2dwo h LEU 395 Cb 0.10 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 2dwo h LEU 395 CO -0.01 0.77 0.29 0.00 -0.34 0.00 0.00 178.44 179.15 2dwo h ALA 396 N 1.40 1.73 0.11 1.25 0.00 -0.69 0.10 119.26 123.15 2dwo h ALA 396 Ca 0.30 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 2dwo h ALA 396 Cb -0.05 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.57 2dwo h ALA 396 CO -0.06 0.24 -0.05 -0.92 0.00 0.00 0.00 179.25 178.47 2dwo h TYR 397 N 0.56 -0.13 -0.45 0.00 3.20 -0.92 0.18 116.97 119.41 2dwo h TYR 397 Ca 0.16 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.97 2dwo h TYR 397 Cb -0.02 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.28 2dwo h TYR 397 CO -0.00 0.32 0.03 0.74 -1.64 0.00 0.00 178.16 177.61 2dwo h PHE 398 N -0.64 0.76 -0.75 -3.82 -1.00 -1.00 -3.00 116.94 107.48 2dwo h PHE 398 Ca -0.01 -0.09 0.00 0.00 2.81 0.00 0.00 57.97 60.68 2dwo h PHE 398 Cb 0.51 -0.21 0.00 0.00 3.61 0.00 0.00 35.95 39.85 2dwo h PHE 398 CO 0.08 0.69 0.00 1.28 -1.61 0.00 0.00 178.31 178.75 2dwo n LEU 399 N -4.25 4.00 -3.80 1.54 4.32 0.32 -4.41 117.00 114.72 2dwo n LEU 399 Ca 0.03 -2.00 -0.25 0.00 -0.02 0.00 0.00 56.01 53.77 2dwo n LEU 399 Cb 0.27 -0.50 0.01 0.00 -1.62 0.00 0.00 43.42 41.58 2dwo n LEU 399 CO 0.40 0.99 -0.14 -0.67 -1.22 0.00 0.00 177.39 176.75 2dwo n ASP 400 N 1.67 -1.67 -4.88 -1.43 2.03 -0.53 -4.97 116.55 106.77 2dwo n ASP 400 Ca 0.25 -0.94 -0.33 0.00 0.52 0.00 0.00 54.79 54.29 2dwo n ASP 400 Cb 0.63 -3.50 -0.05 0.00 -0.72 0.00 0.00 41.12 37.48 2dwo n ASP 400 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2dwo s LYS 401 N -6.20 3.70 0.84 -0.67 -0.14 -0.06 -5.04 119.74 112.16 2dwo s LYS 401 Ca 0.10 0.07 -0.12 0.00 -1.36 0.00 0.00 55.97 54.66 2dwo s LYS 401 Cb -0.03 -2.91 0.09 0.00 -1.68 0.00 0.00 37.83 33.30 2dwo s LYS 401 CO 0.85 0.50 1.11 -1.54 -0.76 0.00 0.00 175.35 175.52 2dwo s SER 402 N -2.09 4.16 0.31 2.83 1.04 -1.26 -4.77 113.70 113.92 2dwo s SER 402 Ca 0.37 1.18 0.01 0.00 0.48 0.00 0.00 55.95 57.99 2dwo s SER 402 Cb -0.13 -1.85 0.50 0.00 0.10 0.00 0.00 66.02 64.64 2dwo s SER 402 CO 0.21 -2.16 1.90 0.00 0.98 0.00 0.00 173.24 174.16 2dwo h ALA 403 N -1.23 1.35 -0.74 5.32 0.00 -1.98 0.10 119.26 122.09 2dwo h ALA 403 Ca -0.48 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.23 2dwo h ALA 403 Cb 1.29 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 2dwo h ALA 403 CO 0.60 0.49 0.27 1.49 0.00 0.00 0.00 179.25 182.10 2dwo h GLU 404 N 0.79 1.12 0.00 0.00 4.81 -2.01 -3.10 114.58 116.19 2dwo h GLU 404 Ca 0.19 -0.21 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 2dwo h GLU 404 Cb 0.15 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.35 2dwo h GLU 404 CO -0.02 0.92 -0.98 1.05 -0.73 0.00 0.00 179.01 179.25 2dwo h GLU 405 N 1.09 0.00 -0.56 1.92 4.11 -1.82 -3.40 114.58 115.91 2dwo h GLU 405 Ca 0.25 0.00 0.10 0.00 0.07 0.00 0.00 59.36 59.77 2dwo h GLU 405 Cb 0.24 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.38 2dwo h GLU 405 CO -0.02 0.09 -0.35 1.98 0.07 0.00 0.00 179.01 180.78 2dwo h MET 406 N 0.00 -0.18 0.00 1.06 4.05 -0.73 -0.24 114.93 118.90 2dwo h MET 406 Ca -0.04 0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.39 2dwo h MET 406 Cb 1.15 0.04 0.00 0.00 -0.80 0.00 0.00 31.60 31.99 2dwo h MET 406 CO 0.01 -0.12 0.00 -0.35 0.23 0.00 0.00 176.91 176.68 2dwo n PRO 407 N -5.43 0.13 -0.06 0.39 -0.04 -1.26 -2.49 135.00 126.25 2dwo n PRO 407 Ca 0.03 0.20 0.03 0.00 -0.04 0.00 0.00 63.50 63.72 2dwo n PRO 407 Cb 0.35 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.38 2dwo n PRO 407 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2dwo n TYR 408 N -1.29 0.16 -1.83 0.54 4.02 -0.12 -5.02 117.16 113.62 2dwo n TYR 408 Ca 0.04 -0.30 -0.38 0.00 -0.01 0.00 0.00 57.90 57.25 2dwo n TYR 408 Cb 0.08 -0.02 0.04 0.00 -0.02 0.00 0.00 39.34 39.42 2dwo n TYR 408 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2dwo s LEU 409 N -0.82 3.76 -0.25 7.72 1.43 -1.04 -4.94 118.68 124.54 2dwo s LEU 409 Ca 0.11 2.65 -0.19 0.00 -1.03 0.00 0.00 54.13 55.67 2dwo s LEU 409 Cb 0.06 -4.42 -0.03 0.00 0.03 0.00 0.00 46.19 41.84 2dwo s LEU 409 CO 0.09 -1.66 0.55 -0.75 0.23 0.00 0.00 176.35 174.80 2dwo s LYS 410 N -3.09 4.10 -0.43 1.70 2.20 -1.26 -4.97 119.74 117.99 2dwo s LYS 410 Ca 0.75 0.40 0.04 0.00 -0.36 0.00 0.00 55.97 56.81 2dwo s LYS 410 Cb -0.38 -3.64 0.17 0.00 -1.51 0.00 0.00 37.83 32.48 2dwo s LYS 410 CO 0.43 -0.34 0.36 0.00 -0.36 0.00 0.00 175.35 175.44 2dwo s PRO 412 N -0.13 2.83 0.97 0.00 0.04 -1.26 -4.89 135.00 132.55 2dwo s PRO 412 Ca 0.33 1.34 -0.11 0.00 0.04 0.00 0.00 61.00 62.60 2dwo s PRO 412 Cb 0.04 -1.96 0.17 0.00 0.04 0.00 0.00 34.50 32.80 2dwo s PRO 412 CO -0.19 -1.22 1.11 -0.51 0.04 0.00 0.00 177.00 176.23 2dwo s LEU 413 N -4.91 2.30 -1.09 -3.56 1.43 -1.26 -3.36 118.68 108.22 2dwo s LEU 413 Ca 0.66 1.94 0.00 0.00 -1.03 0.00 0.00 54.13 55.70 2dwo s LEU 413 Cb -0.19 -4.22 0.00 0.00 0.03 0.00 0.00 46.19 41.80 2dwo s LEU 413 CO 0.42 -3.28 0.00 1.41 0.23 0.00 0.00 176.35 175.14 2dwo n HIS 414 N -4.33 -0.86 -4.57 0.29 8.25 -1.26 -4.92 115.22 107.82 2dwo n HIS 414 Ca 0.09 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.27 2dwo n HIS 414 Cb 0.53 -2.43 -0.17 0.00 1.12 0.00 0.00 29.99 29.05 2dwo n HIS 414 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2dwo s THR 415 N -2.18 1.48 -0.20 1.59 2.01 -1.22 -1.48 115.64 115.64 2dwo s THR 415 Ca 0.00 -0.65 -0.15 0.00 0.31 0.00 0.00 61.69 61.20 2dwo s THR 415 Cb 0.00 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 2dwo s THR 415 CO 0.00 0.44 0.36 -0.69 -0.69 0.00 0.00 174.62 174.04 2dwo s VAL 416 N 0.85 5.22 -0.36 3.82 1.01 -0.20 -4.46 120.40 126.29 2dwo s VAL 416 Ca -0.10 0.63 -0.15 0.00 0.00 0.00 0.00 61.98 62.36 2dwo s VAL 416 Cb -0.15 -3.70 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 2dwo s VAL 416 CO 0.01 0.27 0.37 -0.76 0.00 0.00 0.00 175.10 174.99 2dwo s LEU 417 N 1.24 4.52 -0.35 3.92 1.43 0.20 -0.69 118.68 128.95 2dwo s LEU 417 Ca 0.17 -0.32 -0.15 0.00 -1.03 0.00 0.00 54.13 52.81 2dwo s LEU 417 Cb -0.14 -2.34 -0.01 0.00 0.03 0.00 0.00 46.19 43.73 2dwo s LEU 417 CO 0.07 -0.37 0.36 -0.75 0.23 0.00 0.00 176.35 175.89 2dwo s LYS 418 N 2.02 3.52 -0.22 1.70 2.20 0.17 -1.69 119.74 127.44 2dwo s LYS 418 Ca 0.12 -0.45 -0.06 0.00 -0.36 0.00 0.00 55.97 55.21 2dwo s LYS 418 Cb -0.17 -3.82 -0.03 0.00 -1.51 0.00 0.00 37.83 32.31 2dwo s LYS 418 CO 0.12 -0.55 0.04 -0.51 -0.36 0.00 0.00 175.35 174.09 2dwo s LEU 419 N 2.02 3.37 -0.13 5.43 1.43 0.79 -0.42 118.68 131.18 2dwo s LEU 419 Ca 0.12 -0.19 0.02 0.00 -1.03 0.00 0.00 54.13 53.05 2dwo s LEU 419 Cb -0.17 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.18 2dwo s LEU 419 CO 0.12 0.02 -0.19 0.42 0.23 0.00 0.00 176.35 176.94 2dwo s THR 420 N 1.28 1.84 -0.05 5.49 -4.23 -0.01 -1.32 115.64 118.65 2dwo s THR 420 Ca 0.04 -0.85 -0.30 0.00 -1.18 0.00 0.00 61.69 59.40 2dwo s THR 420 Cb -0.15 -1.65 -0.05 0.00 1.34 0.00 0.00 72.50 71.99 2dwo s THR 420 CO 0.02 0.51 1.63 -2.16 -0.54 0.00 0.00 174.62 174.08 2dwo s PRO 421 N 0.86 4.19 -0.11 3.99 0.04 -1.26 -0.36 135.00 142.35 2dwo s PRO 421 Ca -0.07 2.17 -0.06 0.00 0.04 0.00 0.00 61.00 63.07 2dwo s PRO 421 Cb -0.15 -3.95 0.05 0.00 0.04 0.00 0.00 34.50 30.48 2dwo s PRO 421 CO -0.01 -0.83 0.26 0.54 0.04 0.00 0.00 177.00 177.00 2dwo s VAL 422 N 3.91 -0.04 0.00 -0.36 0.11 -0.18 -4.93 120.40 118.92 2dwo s VAL 422 Ca 0.72 0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.91 2dwo s VAL 422 Cb -0.33 -0.40 0.00 0.00 -1.53 0.00 0.00 36.38 34.12 2dwo s VAL 422 CO 0.29 0.06 0.00 0.00 -3.33 0.00 0.00 175.10 172.11 2dwo n ALA 423 N 4.18 0.00 -0.55 1.54 0.00 -1.26 -2.00 120.51 122.42 2dwo n ALA 423 Ca -0.25 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.30 2dwo n ALA 423 Cb 0.53 0.00 0.35 0.00 0.00 0.00 0.00 19.45 20.34 2dwo n ALA 423 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2dwo n TYR 424 N 13.11 1.35 -1.27 0.00 0.53 -1.26 -5.01 117.16 124.61 2dwo n TYR 424 Ca 0.00 -0.58 0.00 0.00 -1.02 0.00 0.00 57.90 56.30 2dwo n TYR 424 Cb 0.00 -0.17 0.00 0.00 -1.03 0.00 0.00 39.34 38.14 2dwo n TYR 424 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2dwo n GLY 425 N 1.32 2.90 3.23 2.72 0.00 -0.84 -4.80 105.19 109.72 2dwo n GLY 425 Ca 0.26 -0.45 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 2dwo n GLY 425 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dwo s ARG 427 N 0.42 4.50 -0.13 0.00 3.52 0.51 -4.89 118.95 122.88 2dwo s ARG 427 Ca -0.16 1.07 0.01 0.00 -0.13 0.00 0.00 55.73 56.51 2dwo s ARG 427 Cb -0.17 -3.37 -0.01 0.00 -1.56 0.00 0.00 34.95 29.84 2dwo s ARG 427 CO 0.07 0.26 -0.15 0.54 -0.81 0.00 0.00 175.30 175.21 2dwo s VAL 428 N 0.02 2.81 -0.07 7.11 0.11 -1.26 -0.83 120.40 128.30 2dwo s VAL 428 Ca 0.39 -0.74 0.05 0.00 -2.93 0.00 0.00 61.98 58.75 2dwo s VAL 428 Cb -0.20 -2.16 -0.01 0.00 -1.53 0.00 0.00 36.38 32.48 2dwo s VAL 428 CO 0.23 0.53 -0.24 -1.61 -3.33 0.00 0.00 175.10 170.68 2dwo s GLU 429 N 0.40 2.61 -0.14 1.54 2.02 0.44 -4.95 118.70 120.61 2dwo s GLU 429 Ca -0.12 -0.87 -0.09 0.00 0.02 0.00 0.00 54.97 53.92 2dwo s GLU 429 Cb -0.16 -2.14 -0.04 0.00 0.10 0.00 0.00 34.13 31.89 2dwo s GLU 429 CO 0.06 0.31 0.16 0.45 0.02 0.00 0.00 175.26 176.26 2dwo s SER 430 N 0.01 6.36 -0.29 -0.19 0.15 -1.26 0.44 113.70 118.92 2dwo s SER 430 Ca -0.08 0.43 -0.03 0.00 0.70 0.00 0.00 55.95 56.97 2dwo s SER 430 Cb -0.15 -2.09 0.10 0.00 -1.71 0.00 0.00 66.02 62.17 2dwo s SER 430 CO 0.05 0.32 0.11 -0.63 1.20 0.00 0.00 173.24 174.29 2dwo s ILE 431 N -0.54 0.38 -0.01 6.45 1.01 0.13 -4.98 121.20 123.65 2dwo s ILE 431 Ca 0.14 -1.03 -0.30 0.00 0.00 0.00 0.00 60.65 59.46 2dwo s ILE 431 Cb -0.12 -1.29 -0.03 0.00 0.01 0.00 0.00 42.46 41.03 2dwo s ILE 431 CO 0.03 -0.67 1.02 -0.47 0.00 0.00 0.00 174.94 174.84 2dwo s TYR 432 N 1.87 3.60 -0.47 3.97 5.04 -1.26 -1.04 117.35 129.06 2dwo s TYR 432 Ca 0.09 1.62 0.03 0.00 -2.44 0.00 0.00 57.07 56.37 2dwo s TYR 432 Cb -0.17 -3.18 0.28 0.00 0.35 0.00 0.00 41.96 39.24 2dwo s TYR 432 CO -0.30 -0.25 1.13 1.28 -1.34 0.00 0.00 175.55 176.08 2dwo n LEU 433 N 4.08 3.48 -3.83 6.97 4.77 -0.55 -4.92 117.00 127.01 2dwo n LEU 433 Ca 0.07 -1.79 -0.24 0.00 -0.03 0.00 0.00 56.01 54.02 2dwo n LEU 433 Cb 0.50 -0.59 0.01 0.00 -2.33 0.00 0.00 43.42 41.00 2dwo n LEU 433 CO 0.53 0.53 -0.16 -3.20 -1.33 0.00 0.00 177.39 173.76 2dwo n ASN 434 N 0.08 -1.09 -3.77 -1.43 5.15 -1.26 -4.97 115.26 107.97 2dwo n ASN 434 Ca 0.16 -0.93 -0.20 0.00 -0.60 0.00 0.00 54.58 53.00 2dwo n ASN 434 Cb 0.75 -3.48 -0.17 0.00 -0.53 0.00 0.00 39.78 36.34 2dwo n ASN 434 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2dwo s VAL 435 N -3.80 0.20 0.75 3.44 1.01 -1.26 -5.09 120.40 115.65 2dwo s VAL 435 Ca 0.04 0.18 -0.15 0.00 0.00 0.00 0.00 61.98 62.05 2dwo s VAL 435 Cb -0.02 -0.36 0.05 0.00 0.00 0.00 0.00 36.38 36.06 2dwo s VAL 435 CO 0.86 0.20 1.24 -1.61 0.00 0.00 0.00 175.10 175.79 2dwo s GLU 436 N 1.68 1.93 0.10 2.72 0.41 -1.26 -4.86 118.70 119.42 2dwo s GLU 436 Ca -0.00 1.87 -0.27 0.00 -0.41 0.00 0.00 54.97 56.16 2dwo s GLU 436 Cb -0.13 -1.80 0.08 0.00 -1.78 0.00 0.00 34.13 30.51 2dwo s GLU 436 CO -0.03 -2.02 1.01 -1.54 -0.49 0.00 0.00 175.26 172.19 2dwo s SER 437 N -1.89 -0.18 1.03 -0.19 1.04 -1.26 -4.80 113.70 107.45 2dwo s SER 437 Ca 0.76 -0.30 -0.17 0.00 0.48 0.00 0.00 55.95 56.72 2dwo s SER 437 Cb -0.32 0.42 0.22 0.00 0.10 0.00 0.00 66.02 66.44 2dwo s SER 437 CO 0.47 -0.76 1.24 0.68 0.98 0.00 0.00 173.24 175.85 2dwo s VAL 438 N -3.11 1.87 -0.12 5.02 -7.23 -1.26 -5.06 120.40 110.52 2dwo s VAL 438 Ca 0.12 0.00 0.01 0.00 -1.81 0.00 0.00 61.98 60.30 2dwo s VAL 438 Cb -0.00 -2.82 -0.01 0.00 0.56 0.00 0.00 36.38 34.10 2dwo s VAL 438 CO -0.00 0.00 -0.17 0.00 -0.31 0.00 0.00 175.10 174.62 2dwo n THR 440 N 3.46 0.93 -2.71 0.00 -2.24 -1.26 -5.01 114.28 107.46 2dwo n THR 440 Ca -0.18 -0.97 -0.41 0.00 -2.27 0.00 0.00 64.05 60.23 2dwo n THR 440 Cb 0.53 0.55 -0.05 0.00 -2.10 0.00 0.00 70.33 69.26 2dwo n THR 440 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 2dwo s HIS 441 N -0.99 3.85 -0.15 4.78 5.04 -1.26 -5.04 115.29 121.52 2dwo s HIS 441 Ca 0.20 1.83 -0.02 0.00 -1.54 0.00 0.00 55.06 55.52 2dwo s HIS 441 Cb 0.10 -3.06 0.05 0.00 0.04 0.00 0.00 32.58 29.72 2dwo s HIS 441 CO 0.14 0.20 0.03 1.03 -2.34 0.00 0.00 174.74 173.79 2dwo s ARG 442 N -0.59 0.61 0.93 2.88 0.52 -1.26 -5.14 118.95 116.90 2dwo s ARG 442 Ca 0.45 -0.24 -0.12 0.00 -0.52 0.00 0.00 55.73 55.30 2dwo s ARG 442 Cb -0.25 -1.74 0.15 0.00 0.52 0.00 0.00 34.95 33.62 2dwo s ARG 442 CO 0.32 -0.54 1.10 -1.21 0.02 0.00 0.00 175.30 174.99 2dwo s GLU 443 N 1.91 1.01 0.49 3.54 0.41 -1.26 -4.97 118.70 119.83 2dwo s GLU 443 Ca 0.01 0.67 -0.24 0.00 -0.41 0.00 0.00 54.97 55.00 2dwo s GLU 443 Cb -0.15 -1.79 -0.07 0.00 -1.78 0.00 0.00 34.13 30.33 2dwo s GLU 443 CO -0.07 -2.37 1.38 0.54 -0.49 0.00 0.00 175.26 174.25 2dwo n ARG 444 N -3.95 1.99 -3.87 1.61 1.74 -1.26 -5.18 116.66 107.74 2dwo n ARG 444 Ca 0.06 0.72 -0.11 0.00 -0.77 0.00 0.00 57.85 57.75 2dwo n ARG 444 Cb 0.56 -2.58 -0.10 0.00 -1.02 0.00 0.00 32.46 29.32 2dwo n ARG 444 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2dwo s SER 445 N -0.65 0.01 0.00 0.55 0.01 -1.26 -5.24 113.70 107.12 2dwo s SER 445 Ca 0.65 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 57.76 2dwo s SER 445 Cb -0.44 0.21 0.00 0.00 0.21 0.00 0.00 66.02 66.00 2dwo s SER 445 CO 0.54 -0.32 0.00 0.59 0.41 0.00 0.00 173.24 174.47 2dwo n ASN 453 N 1.70 0.00 0.00 2.44 3.02 -1.26 -5.13 115.26 116.03 2dwo n ASN 453 Ca -0.21 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.34 2dwo n ASN 453 Cb 0.56 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.73 2dwo n ASN 453 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 2dwo n PRO 454 N 0.00 0.00 0.07 3.52 -0.02 -1.26 0.11 135.00 137.42 2dwo n PRO 454 Ca 0.00 0.31 0.04 0.00 -2.02 0.00 0.00 63.50 61.84 2dwo n PRO 454 Cb 0.00 -0.48 0.24 0.00 -0.02 0.00 0.00 33.50 33.24 2dwo n PRO 454 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2dwo n LEU 455 N -2.14 0.22 -2.21 2.45 4.77 -1.18 -2.52 117.00 116.39 2dwo n LEU 455 Ca 0.00 0.56 -0.26 0.00 -0.03 0.00 0.00 56.01 56.28 2dwo n LEU 455 Cb 0.00 -0.57 0.14 0.00 -2.33 0.00 0.00 43.42 40.66 2dwo n LEU 455 CO 0.00 -0.63 1.31 0.23 -1.33 0.00 0.00 177.39 176.96 2dwo n MET 456 N -1.78 2.32 -3.74 3.23 2.81 0.12 -4.83 117.12 115.24 2dwo n MET 456 Ca -0.01 -2.95 -0.11 0.00 -1.81 0.00 0.00 57.70 52.82 2dwo n MET 456 Cb 0.09 -2.16 -0.07 0.00 -0.71 0.00 0.00 33.22 30.37 2dwo n MET 456 CO 0.00 0.00 0.00 -0.98 1.51 0.00 0.00 175.97 176.50 2dwo s ARG 457 N -3.30 0.88 0.66 0.03 1.70 -1.05 -5.09 118.95 112.78 2dwo s ARG 457 Ca 0.57 -0.61 -0.15 0.00 -0.47 0.00 0.00 55.73 55.07 2dwo s ARG 457 Cb 0.47 0.38 -0.00 0.00 -0.57 0.00 0.00 34.95 35.22 2dwo s ARG 457 CO 0.07 -0.30 1.11 1.03 -1.08 0.00 0.00 175.30 176.13 2dwo s ARG 458 N -3.02 2.83 0.00 3.89 0.52 -1.26 -4.36 118.95 117.55 2dwo s ARG 458 Ca -0.02 1.37 0.00 0.00 -0.52 0.00 0.00 55.73 56.56 2dwo s ARG 458 Cb 0.01 -1.96 0.00 0.00 0.52 0.00 0.00 34.95 33.52 2dwo s ARG 458 CO -0.06 -1.22 0.00 0.27 0.02 0.00 0.00 175.30 174.30 2dwo n ASN 459 N -2.42 -6.42 0.00 0.23 0.23 -1.26 -5.09 115.26 100.52 2dwo n ASN 459 Ca 0.10 0.47 0.00 0.00 -0.53 0.00 0.00 54.58 54.62 2dwo n ASN 459 Cb 0.52 -1.49 0.00 0.00 -2.08 0.00 0.00 39.78 36.73 2dwo n ASN 459 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09