#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o4i n HIS 10 N 0.00 0.00 -2.84 1.61 -0.00 -1.26 -5.11 115.22 107.62 2o4i n HIS 10 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 57.72 57.30 2o4i n HIS 10 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 29.95 2o4i n HIS 10 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 2o4i s MET 11 N 0.00 4.30 -0.06 -0.41 1.00 -1.26 -4.36 119.30 118.51 2o4i s MET 11 Ca 0.00 1.10 0.17 0.00 0.00 0.00 0.00 55.69 56.96 2o4i s MET 11 Cb 0.00 -3.58 -0.22 0.00 0.00 0.00 0.00 34.83 31.03 2o4i s MET 11 CO 0.00 -0.37 0.48 1.04 0.00 0.00 0.00 175.02 176.17 2o4i n GLN 12 N 5.37 0.65 -3.64 2.03 1.13 -0.72 -4.70 117.38 117.50 2o4i n GLN 12 Ca 0.06 0.09 -0.20 0.00 -1.94 0.00 0.00 57.00 55.01 2o4i n GLN 12 Cb 0.48 -1.66 -0.17 0.00 0.11 0.00 0.00 30.24 29.00 2o4i n GLN 12 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2o4i s THR 13 N -2.81 -0.17 -0.28 5.09 2.01 -1.23 0.04 115.64 118.29 2o4i s THR 13 Ca -0.06 0.24 -0.21 0.00 0.31 0.00 0.00 61.69 61.96 2o4i s THR 13 Cb 0.08 -0.32 -0.01 0.00 0.01 0.00 0.00 72.50 72.26 2o4i s THR 13 CO 0.83 0.04 0.68 -0.76 -0.69 0.00 0.00 174.62 174.73 2o4i s LEU 14 N 2.21 4.09 -0.46 4.42 1.43 -0.14 -1.63 118.68 128.60 2o4i s LEU 14 Ca 0.04 0.66 -0.16 0.00 -1.03 0.00 0.00 54.13 53.64 2o4i s LEU 14 Cb -0.13 -2.92 0.06 0.00 0.03 0.00 0.00 46.19 43.22 2o4i s LEU 14 CO -0.06 -0.46 0.40 -0.63 0.23 0.00 0.00 176.35 175.83 2o4i s ILE 15 N 2.66 5.20 -0.19 -0.59 1.01 -0.35 -1.59 121.20 127.34 2o4i s ILE 15 Ca 0.28 -0.90 -0.29 0.00 0.00 0.00 0.00 60.65 59.74 2o4i s ILE 15 Cb -0.15 -4.10 -0.00 0.00 0.01 0.00 0.00 42.46 38.21 2o4i s ILE 15 CO 0.10 -0.55 1.14 -0.36 0.00 0.00 0.00 174.94 175.28 2o4i s PHE 16 N 1.77 3.12 0.02 3.97 0.08 -0.35 -0.58 117.98 126.02 2o4i s PHE 16 Ca 0.06 1.26 0.07 0.00 0.12 0.00 0.00 56.93 58.44 2o4i s PHE 16 Cb -0.22 -3.38 -0.02 0.00 -0.57 0.00 0.00 43.02 38.83 2o4i s PHE 16 CO 0.08 -1.04 -0.21 -1.17 -0.10 0.00 0.00 175.22 172.78 2o4i s LEU 17 N 3.24 2.12 -0.15 -0.37 1.98 0.13 -0.85 118.68 124.79 2o4i s LEU 17 Ca 0.49 -0.48 -0.23 0.00 -2.89 0.00 0.00 54.13 51.02 2o4i s LEU 17 Cb -0.18 -1.03 0.06 0.00 0.66 0.00 0.00 46.19 45.70 2o4i s LEU 17 CO 0.11 0.20 0.59 -0.62 -1.89 0.00 0.00 176.35 174.74 2o4i s ASP 18 N -0.95 -0.59 0.08 3.68 2.15 -1.04 -4.10 116.67 115.91 2o4i s ASP 18 Ca 0.08 0.93 0.10 0.00 0.43 0.00 0.00 52.55 54.08 2o4i s ASP 18 Cb -0.09 0.91 -0.03 0.00 -0.30 0.00 0.00 42.92 43.42 2o4i s ASP 18 CO 0.01 -0.36 -0.25 -0.76 -0.17 0.00 0.00 175.17 173.64 2o4i s LEU 19 N -0.34 2.24 -0.11 -1.34 1.43 -1.26 -1.87 118.68 117.43 2o4i s LEU 19 Ca -0.05 -0.65 -0.00 0.00 -1.03 0.00 0.00 54.13 52.40 2o4i s LEU 19 Cb -0.03 -1.17 -0.02 0.00 0.03 0.00 0.00 46.19 44.99 2o4i s LEU 19 CO 0.04 0.19 -0.09 -1.61 0.23 0.00 0.00 176.35 175.11 2o4i s GLU 20 N -1.62 3.16 0.41 1.70 0.41 0.76 -4.97 118.70 118.56 2o4i s GLU 20 Ca 0.11 -0.61 0.03 0.00 -0.41 0.00 0.00 54.97 54.10 2o4i s GLU 20 Cb -0.10 -2.65 -0.01 0.00 -1.78 0.00 0.00 34.13 29.59 2o4i s GLU 20 CO 0.04 0.40 0.12 0.00 -0.49 0.00 0.00 175.26 175.33 2o4i n ALA 21 N 3.00 0.54 0.37 5.21 0.00 -1.26 -0.11 120.51 128.26 2o4i n ALA 21 Ca -0.18 -2.04 0.13 0.00 0.00 0.00 0.00 53.44 51.35 2o4i n ALA 21 Cb 0.53 1.34 0.35 0.00 0.00 0.00 0.00 19.45 21.67 2o4i n ALA 21 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2o4i h THR 22 N 1.60 0.00 0.00 0.00 1.35 -1.72 -3.44 112.91 110.70 2o4i h THR 22 Ca -0.32 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 64.84 2o4i h THR 22 Cb 1.19 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 69.28 2o4i h THR 22 CO 0.52 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.40 2o4i n GLY 23 N 0.91 -1.12 3.83 5.82 0.00 -1.26 -2.45 105.19 110.92 2o4i n GLY 23 Ca 0.04 -0.81 -0.30 0.00 0.00 0.00 0.00 46.02 44.95 2o4i n GLY 23 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2o4i s LEU 24 N 0.00 2.68 0.34 0.99 1.43 -1.26 -4.66 118.68 118.20 2o4i s LEU 24 Ca 0.00 1.25 0.08 0.00 -1.03 0.00 0.00 54.13 54.43 2o4i s LEU 24 Cb 0.00 -3.91 0.79 0.00 0.03 0.00 0.00 46.19 43.10 2o4i s LEU 24 CO 0.00 -1.79 1.85 -0.65 0.23 0.00 0.00 176.35 175.99 2o4i h PRO 25 N -0.97 0.70 0.00 1.29 0.11 -1.99 -1.14 132.00 130.00 2o4i h PRO 25 Ca -0.46 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 2o4i h PRO 25 Cb 1.27 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 2o4i h PRO 25 CO 0.61 0.47 -0.02 0.66 -0.21 0.00 0.00 178.00 179.51 2o4i h SER 26 N 0.72 0.00 -0.21 -2.05 4.64 -2.01 -1.69 113.55 112.96 2o4i h SER 26 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 2o4i h SER 26 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 2o4i h SER 26 CO -0.24 0.02 0.00 -1.54 -0.87 0.00 0.00 176.83 174.20 2o4i n SER 27 N -3.52 2.14 -3.27 4.97 3.41 -0.43 -4.99 113.62 111.93 2o4i n SER 27 Ca -0.03 -1.78 -0.09 0.00 -0.26 0.00 0.00 58.87 56.70 2o4i n SER 27 Cb 0.11 -0.13 0.01 0.00 -0.26 0.00 0.00 64.21 63.94 2o4i n SER 27 CO 0.00 0.00 0.00 -1.14 -0.16 0.00 0.00 175.04 173.74 2o4i n ARG 28 N 0.64 -1.48 -1.93 4.33 0.63 -0.64 -4.96 116.66 113.25 2o4i n ARG 28 Ca 0.17 1.18 -0.29 0.00 -0.92 0.00 0.00 57.85 57.99 2o4i n ARG 28 Cb 0.41 -5.04 0.08 0.00 0.45 0.00 0.00 32.46 28.35 2o4i n ARG 28 CO 0.00 0.00 0.00 -1.25 -2.51 0.00 0.00 177.63 173.87 2o4i s PRO 29 N -3.82 2.22 0.04 -0.14 0.04 -1.26 -5.02 135.00 127.06 2o4i s PRO 29 Ca 0.11 0.16 0.04 0.00 0.04 0.00 0.00 61.00 61.36 2o4i s PRO 29 Cb -0.03 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.50 2o4i s PRO 29 CO 0.78 -1.42 -0.12 -1.21 0.04 0.00 0.00 177.00 175.08 2o4i s GLU 30 N -5.49 0.81 0.03 4.56 2.02 -1.26 -4.93 118.70 114.44 2o4i s GLU 30 Ca 0.61 -0.71 -0.30 0.00 0.02 0.00 0.00 54.97 54.58 2o4i s GLU 30 Cb -0.11 -0.78 -0.06 0.00 0.10 0.00 0.00 34.13 33.28 2o4i s GLU 30 CO 0.49 0.19 1.40 0.08 0.02 0.00 0.00 175.26 177.44 2o4i s VAL 31 N -0.88 3.62 -0.08 2.63 1.01 -1.26 -1.84 120.40 123.60 2o4i s VAL 31 Ca -0.00 1.06 0.21 0.00 0.00 0.00 0.00 61.98 63.24 2o4i s VAL 31 Cb -0.08 -3.68 -0.31 0.00 0.00 0.00 0.00 36.38 32.31 2o4i s VAL 31 CO 0.01 0.02 0.37 0.35 0.00 0.00 0.00 175.10 175.85 2o4i n THR 32 N 4.48 0.38 -3.59 3.92 -2.24 0.84 -4.37 114.28 113.70 2o4i n THR 32 Ca 0.13 -0.60 -0.15 0.00 -2.27 0.00 0.00 64.05 61.16 2o4i n THR 32 Cb 0.43 -0.12 -0.07 0.00 -2.10 0.00 0.00 70.33 68.47 2o4i n THR 32 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2o4i s GLU 33 N -3.23 0.88 0.09 -0.78 2.12 -0.58 -1.00 118.70 116.20 2o4i s GLU 33 Ca -0.08 0.64 0.02 0.00 0.36 0.00 0.00 54.97 55.91 2o4i s GLU 33 Cb 0.12 0.42 -0.04 0.00 0.26 0.00 0.00 34.13 34.89 2o4i s GLU 33 CO 0.88 -0.19 -0.07 -0.48 -0.54 0.00 0.00 175.26 174.86 2o4i s LEU 34 N -0.30 2.47 -0.16 2.70 0.05 -0.62 -0.17 118.68 122.65 2o4i s LEU 34 Ca -0.04 -0.93 -0.06 0.00 0.05 0.00 0.00 54.13 53.15 2o4i s LEU 34 Cb -0.03 -0.13 0.07 0.00 -2.05 0.00 0.00 46.19 44.06 2o4i s LEU 34 CO 0.04 -0.40 0.34 0.00 -0.55 0.00 0.00 176.35 175.77 2o4i s LEU 36 N 2.40 3.65 -0.32 0.00 1.02 -0.07 -2.48 118.68 122.88 2o4i s LEU 36 Ca -0.01 0.09 -0.02 0.00 0.02 0.00 0.00 54.13 54.21 2o4i s LEU 36 Cb -0.12 -2.02 0.11 0.00 0.02 0.00 0.00 46.19 44.18 2o4i s LEU 36 CO -0.11 0.31 0.15 -0.22 0.02 0.00 0.00 176.35 176.51 2o4i s LEU 37 N -1.39 1.07 0.04 1.79 2.96 -0.03 -1.00 118.68 122.12 2o4i s LEU 37 Ca 0.18 -1.66 -0.29 0.00 -0.22 0.00 0.00 54.13 52.14 2o4i s LEU 37 Cb -0.12 -0.49 -0.04 0.00 0.50 0.00 0.00 46.19 46.04 2o4i s LEU 37 CO 0.09 -0.39 0.95 0.00 -1.32 0.00 0.00 176.35 175.67 2o4i s ALA 38 N 1.65 3.21 -0.02 5.97 0.00 0.11 -1.22 121.76 131.46 2o4i s ALA 38 Ca 0.12 0.52 -0.00 0.00 0.00 0.00 0.00 51.96 52.60 2o4i s ALA 38 Cb -0.19 -3.28 0.03 0.00 0.00 0.00 0.00 23.12 19.68 2o4i s ALA 38 CO -0.23 -0.14 0.04 0.08 0.00 0.00 0.00 175.76 175.51 2o4i s VAL 39 N 0.61 -0.05 0.62 0.00 1.01 -0.62 -2.20 120.40 119.76 2o4i s VAL 39 Ca 0.49 0.19 -0.17 0.00 0.00 0.00 0.00 61.98 62.49 2o4i s VAL 39 Cb -0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 36.38 36.05 2o4i s VAL 39 CO 0.28 0.08 1.12 -2.28 0.00 0.00 0.00 175.10 174.30 2o4i s HIS 40 N 0.96 2.62 0.18 5.22 2.46 -1.26 -0.96 115.29 124.50 2o4i s HIS 40 Ca -0.08 1.55 -0.19 0.00 0.47 0.00 0.00 55.06 56.81 2o4i s HIS 40 Cb -0.11 -3.23 0.13 0.00 -0.13 0.00 0.00 32.58 29.24 2o4i s HIS 40 CO -0.03 -1.68 1.61 -0.09 -2.47 0.00 0.00 174.74 172.07 2o4i h ARG 41 N 0.47 -0.14 0.00 2.88 2.43 -0.67 -1.99 114.38 117.35 2o4i h ARG 41 Ca -0.48 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 2o4i h ARG 41 Cb 1.25 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.84 2o4i h ARG 41 CO 0.55 -0.09 0.00 2.89 -1.51 0.00 0.00 179.97 181.81 2o4i n ARG 42 N -5.42 0.13 -0.13 0.20 1.85 -1.26 -2.16 116.66 109.86 2o4i n ARG 42 Ca 0.04 0.24 -0.10 0.00 -1.00 0.00 0.00 57.85 57.03 2o4i n ARG 42 Cb 0.33 -1.69 -0.02 0.00 -1.05 0.00 0.00 32.46 30.03 2o4i n ARG 42 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2o4i h ALA 43 N 2.54 0.50 -0.22 2.89 0.00 -1.70 -1.74 119.26 121.53 2o4i h ALA 43 Ca 0.00 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.54 2o4i h ALA 43 Cb 0.47 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2o4i h ALA 43 CO 0.00 0.25 -0.36 -0.07 0.00 0.00 0.00 179.25 179.08 2o4i h LEU 44 N 0.47 0.69 -0.82 0.00 3.38 -1.41 -3.20 115.31 114.43 2o4i h LEU 44 Ca 0.11 -0.53 0.09 0.00 0.09 0.00 0.00 57.88 57.64 2o4i h LEU 44 Cb 0.44 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.92 2o4i h LEU 44 CO 0.02 1.09 0.48 -0.33 0.09 0.00 0.00 178.44 179.78 2o4i h GLU 45 N 0.33 0.79 -4.33 1.13 5.08 -1.45 -2.96 114.58 113.16 2o4i h GLU 45 Ca 0.02 -0.05 -0.72 0.00 -1.00 0.00 0.00 59.36 57.61 2o4i h GLU 45 Cb 0.94 -0.18 -0.09 0.00 0.50 0.00 0.00 28.75 29.93 2o4i h GLU 45 CO 0.08 0.52 2.49 0.09 -1.00 0.00 0.00 179.01 181.19 2o4i n ASN 46 N -4.73 4.53 -3.76 1.42 3.02 -0.65 -4.89 115.26 110.20 2o4i n ASN 46 Ca 0.13 -2.94 -0.13 0.00 -0.03 0.00 0.00 54.58 51.61 2o4i n ASN 46 Cb 0.26 -1.62 -0.09 0.00 -0.61 0.00 0.00 39.78 37.72 2o4i n ASN 46 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2o4i s THR 47 N 2.54 0.05 0.12 3.41 2.01 -1.12 -4.88 115.64 117.77 2o4i s THR 47 Ca 0.46 -0.43 -0.31 0.00 0.31 0.00 0.00 61.69 61.72 2o4i s THR 47 Cb 0.09 -0.59 -0.08 0.00 0.01 0.00 0.00 72.50 71.93 2o4i s THR 47 CO -0.02 -0.24 1.39 -0.44 -0.69 0.00 0.00 174.62 174.62 2o4i s SER 48 N -1.16 6.83 -0.06 3.53 0.01 -1.26 -4.97 113.70 116.61 2o4i s SER 48 Ca -0.12 2.33 -0.30 0.00 1.31 0.00 0.00 55.95 59.18 2o4i s SER 48 Cb -0.05 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.54 2o4i s SER 48 CO 0.04 -0.65 1.57 -0.63 0.41 0.00 0.00 173.24 173.98 2o4i s ILE 49 N 1.03 3.67 -0.51 1.44 1.01 -1.26 -4.90 121.20 121.69 2o4i s ILE 49 Ca 0.64 0.86 -0.26 0.00 0.00 0.00 0.00 60.65 61.89 2o4i s ILE 49 Cb -0.37 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 2o4i s ILE 49 CO 0.31 -0.06 2.15 -0.44 0.00 0.00 0.00 174.94 176.89 2o4i s SER 50 N 2.93 4.91 0.33 3.58 0.01 -1.22 -4.94 113.70 119.30 2o4i s SER 50 Ca 0.70 0.87 0.10 0.00 1.31 0.00 0.00 55.95 58.92 2o4i s SER 50 Cb -0.32 -2.51 -0.06 0.00 0.21 0.00 0.00 66.02 63.34 2o4i s SER 50 CO 0.27 -2.56 -0.09 -1.10 0.41 0.00 0.00 173.24 170.17 2o4i s GLN 51 N 7.51 1.86 0.00 12.44 -0.21 -1.26 -4.91 119.66 135.08 2o4i s GLN 51 Ca 0.85 -1.86 0.00 0.00 0.02 0.00 0.00 55.36 54.37 2o4i s GLN 51 Cb -0.17 -1.77 0.00 0.00 1.00 0.00 0.00 33.01 32.07 2o4i s GLN 51 CO 0.25 0.18 0.00 0.41 -2.12 0.00 0.00 175.29 174.01 2o4i n GLY 52 N -0.80 1.63 2.90 3.09 0.00 -1.26 -4.25 105.19 106.50 2o4i n GLY 52 Ca -0.05 -1.80 -0.30 0.00 0.00 0.00 0.00 46.02 43.87 2o4i n GLY 52 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2o4i s HIS 53 N -2.78 2.68 0.67 1.61 3.76 -1.26 -1.85 115.29 118.12 2o4i s HIS 53 Ca 0.00 -2.22 -0.12 0.00 -0.15 0.00 0.00 55.06 52.57 2o4i s HIS 53 Cb 0.00 -2.13 -0.01 0.00 1.11 0.00 0.00 32.58 31.55 2o4i s HIS 53 CO 0.00 -0.88 1.06 -1.25 -0.85 0.00 0.00 174.74 172.82 2o4i s PRO 54 N 1.29 3.08 0.48 8.40 0.04 -1.26 -5.15 135.00 141.87 2o4i s PRO 54 Ca 0.06 0.99 -0.19 0.00 0.04 0.00 0.00 61.00 61.90 2o4i s PRO 54 Cb -0.18 -2.01 -0.09 0.00 0.04 0.00 0.00 34.50 32.26 2o4i s PRO 54 CO -0.13 -0.99 0.98 -1.25 0.04 0.00 0.00 177.00 175.65 2o4i s PRO 55 N -4.85 4.03 0.58 0.56 0.04 -0.77 -5.03 135.00 129.57 2o4i s PRO 55 Ca 0.59 1.08 -0.16 0.00 0.04 0.00 0.00 61.00 62.55 2o4i s PRO 55 Cb -0.14 -2.15 -0.04 0.00 0.04 0.00 0.00 34.50 32.21 2o4i s PRO 55 CO 0.51 -0.20 1.05 -1.25 0.04 0.00 0.00 177.00 177.14 2o4i s PRO 56 N -3.60 3.40 -0.05 0.56 0.04 -1.26 -4.69 135.00 129.39 2o4i s PRO 56 Ca 0.61 1.16 -0.30 0.00 0.04 0.00 0.00 61.00 62.52 2o4i s PRO 56 Cb -0.10 -2.05 -0.05 0.00 0.04 0.00 0.00 34.50 32.34 2o4i s PRO 56 CO 0.22 -0.74 1.56 0.08 0.04 0.00 0.00 177.00 178.16 2o4i s VAL 57 N -2.50 3.66 0.36 -0.36 1.01 -1.26 -4.95 120.40 116.37 2o4i s VAL 57 Ca 0.63 0.87 -0.28 0.00 0.00 0.00 0.00 61.98 63.20 2o4i s VAL 57 Cb -0.15 -3.56 -0.11 0.00 0.00 0.00 0.00 36.38 32.56 2o4i s VAL 57 CO 0.37 -0.06 1.40 -2.84 0.00 0.00 0.00 175.10 173.97 2o4i s PRO 58 N 3.59 4.22 0.20 2.72 0.02 -1.26 -4.95 135.00 139.54 2o4i s PRO 58 Ca 0.69 2.41 -0.30 0.00 0.02 0.00 0.00 61.00 63.81 2o4i s PRO 58 Cb -0.32 -3.01 -0.09 0.00 0.02 0.00 0.00 34.50 31.10 2o4i s PRO 58 CO 0.27 -0.38 1.37 0.50 -0.33 0.00 0.00 177.00 178.44 2o4i s ARG 59 N -1.96 4.33 0.68 5.54 3.52 -1.26 -4.91 118.95 124.89 2o4i s ARG 59 Ca 0.51 2.15 -0.17 0.00 -0.13 0.00 0.00 55.73 58.10 2o4i s ARG 59 Cb -0.43 -3.17 0.01 0.00 -1.56 0.00 0.00 34.95 29.80 2o4i s ARG 59 CO 0.58 -0.34 1.24 -2.14 -0.81 0.00 0.00 175.30 173.83 2o4i s PRO 60 N -0.01 2.39 0.72 5.12 0.02 -1.26 -4.97 135.00 137.02 2o4i s PRO 60 Ca 0.59 1.90 -0.14 0.00 0.02 0.00 0.00 61.00 63.37 2o4i s PRO 60 Cb -0.39 -1.85 0.03 0.00 0.02 0.00 0.00 34.50 32.32 2o4i s PRO 60 CO 0.39 -1.68 1.13 -2.14 -0.33 0.00 0.00 177.00 174.37 2o4i s PRO 61 N -3.62 2.37 -0.01 5.54 0.02 -1.26 -4.98 135.00 133.06 2o4i s PRO 61 Ca 0.78 1.44 -0.18 0.00 0.02 0.00 0.00 61.00 63.07 2o4i s PRO 61 Cb -0.33 -1.89 -0.10 0.00 0.02 0.00 0.00 34.50 32.20 2o4i s PRO 61 CO 0.41 -1.59 0.82 -0.09 -0.33 0.00 0.00 177.00 176.23 2o4i h ARG 62 N -0.45 -0.62 -6.35 5.54 9.65 -1.95 -3.40 114.38 116.79 2o4i h ARG 62 Ca -0.46 0.04 -0.54 0.00 -1.10 0.00 0.00 59.98 57.92 2o4i h ARG 62 Cb 1.26 0.14 -0.06 0.00 -1.39 0.00 0.00 29.97 29.92 2o4i h ARG 62 CO 0.51 -0.42 1.12 0.08 2.80 0.00 0.00 179.97 184.06 2o4i s VAL 63 N -3.73 3.73 -0.17 0.20 1.01 -1.26 -4.95 120.40 115.23 2o4i s VAL 63 Ca -0.09 0.56 -0.07 0.00 0.00 0.00 0.00 61.98 62.37 2o4i s VAL 63 Cb 0.01 -4.50 0.07 0.00 0.00 0.00 0.00 36.38 31.96 2o4i s VAL 63 CO 0.28 -1.31 0.37 -0.69 0.00 0.00 0.00 175.10 173.75 2o4i s VAL 64 N 6.31 -0.34 0.05 2.92 1.01 -1.26 -4.66 120.40 124.43 2o4i s VAL 64 Ca 0.50 0.16 -0.22 0.00 0.00 0.00 0.00 61.98 62.41 2o4i s VAL 64 Cb -0.10 -0.58 -0.06 0.00 0.00 0.00 0.00 36.38 35.64 2o4i s VAL 64 CO 0.22 0.07 0.67 -1.81 0.00 0.00 0.00 175.10 174.25 2o4i s ASP 65 N 2.04 7.12 0.02 3.32 1.11 -0.94 -4.96 116.67 124.39 2o4i s ASP 65 Ca -0.05 1.33 0.01 0.00 0.18 0.00 0.00 52.55 54.03 2o4i s ASP 65 Cb -0.11 -2.41 -0.01 0.00 1.07 0.00 0.00 42.92 41.45 2o4i s ASP 65 CO -0.12 0.12 -0.04 -0.75 1.18 0.00 0.00 175.17 175.56 2o4i s LYS 66 N -0.43 0.32 -0.20 8.23 2.20 -1.26 0.07 119.74 128.67 2o4i s LYS 66 Ca 0.34 -0.47 -0.04 0.00 -0.36 0.00 0.00 55.97 55.44 2o4i s LYS 66 Cb -0.20 -0.09 0.10 0.00 -1.51 0.00 0.00 37.83 36.13 2o4i s LYS 66 CO 0.20 0.01 0.28 -1.17 -0.36 0.00 0.00 175.35 174.31 2o4i s LEU 67 N -1.02 -0.31 -0.17 5.43 2.96 -0.17 -5.01 118.68 120.39 2o4i s LEU 67 Ca -0.09 0.08 -0.00 0.00 -0.22 0.00 0.00 54.13 53.90 2o4i s LEU 67 Cb -0.07 0.67 0.01 0.00 0.50 0.00 0.00 46.19 47.30 2o4i s LEU 67 CO -0.00 -0.30 -0.15 -0.55 -1.32 0.00 0.00 176.35 174.02 2o4i s SER 68 N 2.41 3.55 0.03 3.68 0.15 -1.26 -0.89 113.70 121.38 2o4i s SER 68 Ca 0.07 -0.53 0.04 0.00 0.70 0.00 0.00 55.95 56.24 2o4i s SER 68 Cb -0.15 -1.56 -0.02 0.00 -1.71 0.00 0.00 66.02 62.58 2o4i s SER 68 CO -0.13 0.04 -0.13 -0.76 1.20 0.00 0.00 173.24 173.47 2o4i s LEU 69 N 1.09 2.15 -0.09 3.45 1.43 -0.48 -5.02 118.68 121.21 2o4i s LEU 69 Ca -0.00 -0.42 -0.04 0.00 -1.03 0.00 0.00 54.13 52.64 2o4i s LEU 69 Cb -0.14 -0.54 -0.04 0.00 0.03 0.00 0.00 46.19 45.50 2o4i s LEU 69 CO -0.05 0.02 0.08 0.00 0.23 0.00 0.00 176.35 176.63 2o4i s ILE 71 N -1.01 0.89 -0.23 0.00 1.01 -0.17 -4.67 121.20 117.02 2o4i s ILE 71 Ca 0.16 -0.48 -0.23 0.00 0.00 0.00 0.00 60.65 60.10 2o4i s ILE 71 Cb -0.12 -0.74 -0.01 0.00 0.01 0.00 0.00 42.46 41.60 2o4i s ILE 71 CO 0.05 0.25 0.77 0.00 0.00 0.00 0.00 174.94 176.01 2o4i s ALA 72 N -0.25 3.62 0.54 9.38 0.00 -0.30 -4.40 121.76 130.36 2o4i s ALA 72 Ca 0.04 -0.20 -0.14 0.00 0.00 0.00 0.00 51.96 51.66 2o4i s ALA 72 Cb -0.05 -3.19 -0.06 0.00 0.00 0.00 0.00 23.12 19.82 2o4i s ALA 72 CO -0.00 -0.84 0.98 -1.25 0.00 0.00 0.00 175.76 174.65 2o4i s PRO 73 N 2.62 3.82 0.15 0.00 0.04 -1.26 -4.17 135.00 136.19 2o4i s PRO 73 Ca 0.33 0.85 0.25 0.00 0.04 0.00 0.00 61.00 62.46 2o4i s PRO 73 Cb -0.15 -2.14 0.93 0.00 0.04 0.00 0.00 34.50 33.18 2o4i s PRO 73 CO 0.08 -0.35 1.77 0.41 0.04 0.00 0.00 177.00 178.96 2o4i n GLY 74 N -1.94 -1.51 3.24 0.56 0.00 -1.26 -4.87 105.19 99.40 2o4i n GLY 74 Ca 0.06 -0.02 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 2o4i n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2o4i s LYS 75 N -3.11 1.14 0.64 1.61 -2.85 -1.26 -5.15 119.74 110.76 2o4i s LYS 75 Ca 0.10 -1.56 -0.15 0.00 -1.00 0.00 0.00 55.97 53.36 2o4i s LYS 75 Cb 0.13 -0.17 -0.01 0.00 -2.06 0.00 0.00 37.83 35.72 2o4i s LYS 75 CO 0.51 -0.19 1.10 0.00 0.10 0.00 0.00 175.35 176.87 2o4i s ALA 76 N -3.75 2.54 0.24 0.59 0.00 -1.26 -4.84 121.76 115.28 2o4i s ALA 76 Ca 0.27 0.51 -0.11 0.00 0.00 0.00 0.00 51.96 52.63 2o4i s ALA 76 Cb 0.07 -3.30 -0.07 0.00 0.00 0.00 0.00 23.12 19.81 2o4i s ALA 76 CO 0.06 -1.15 0.58 0.00 0.00 0.00 0.00 175.76 175.24 2o4i s SER 78 N -2.30 6.26 0.28 0.00 1.04 -1.03 -4.84 113.70 113.12 2o4i s SER 78 Ca 0.48 1.93 0.02 0.00 0.48 0.00 0.00 55.95 58.85 2o4i s SER 78 Cb -0.11 -2.56 0.57 0.00 0.10 0.00 0.00 66.02 64.02 2o4i s SER 78 CO 0.20 -0.84 1.83 -0.65 0.98 0.00 0.00 173.24 174.76 2o4i h PRO 79 N 1.43 0.94 -0.40 4.02 0.11 -1.98 0.14 132.00 136.26 2o4i h PRO 79 Ca -0.49 -0.06 -0.14 0.00 0.11 0.00 0.00 66.00 65.42 2o4i h PRO 79 Cb 1.22 -0.21 -0.01 0.00 0.11 0.00 0.00 31.00 32.11 2o4i h PRO 79 CO 0.59 0.62 -0.31 0.78 -0.21 0.00 0.00 178.00 179.47 2o4i h GLY 80 N 0.97 0.99 1.45 -0.55 0.00 -1.96 -2.32 103.07 101.64 2o4i h GLY 80 Ca 0.51 -0.97 -0.16 0.00 0.00 0.00 0.00 47.33 46.71 2o4i h GLY 80 CO -0.28 0.88 -0.52 0.00 0.00 0.00 0.00 176.54 176.62 2o4i h ALA 81 N 0.79 0.71 -0.60 3.60 0.00 -1.69 -3.11 119.26 118.95 2o4i h ALA 81 Ca 0.07 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.40 2o4i h ALA 81 Cb 0.89 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2o4i h ALA 81 CO 0.08 0.68 0.02 0.77 0.00 0.00 0.00 179.25 180.80 2o4i h SER 82 N 0.46 1.00 0.03 0.00 0.02 -0.71 -2.95 113.55 111.39 2o4i h SER 82 Ca 0.02 -0.27 -0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2o4i h SER 82 Cb 1.06 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.33 2o4i h SER 82 CO 0.10 1.03 -0.01 -0.08 -1.14 0.00 0.00 176.83 176.73 2o4i h GLU 83 N 0.94 -0.04 -0.26 3.45 4.81 -1.43 0.17 114.58 122.23 2o4i h GLU 83 Ca 0.17 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 2o4i h GLU 83 Cb 0.51 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.89 2o4i h GLU 83 CO 0.02 0.39 0.01 -0.84 -0.73 0.00 0.00 179.01 177.87 2o4i h ILE 84 N -0.48 1.25 0.00 2.32 3.07 -1.63 -3.08 117.51 118.96 2o4i h ILE 84 Ca -0.00 -0.88 -0.16 0.00 1.55 0.00 0.00 64.86 65.36 2o4i h ILE 84 Cb 0.45 1.33 -0.02 0.00 -0.27 0.00 0.00 36.82 38.30 2o4i h ILE 84 CO 0.01 0.28 -0.75 0.71 -1.05 0.00 0.00 178.15 177.34 2o4i h THR 85 N 0.23 1.49 -2.23 0.16 1.35 -1.61 -3.42 112.91 108.88 2o4i h THR 85 Ca 0.07 -2.62 -0.16 0.00 -0.55 0.00 0.00 66.41 63.16 2o4i h THR 85 Cb 0.40 2.43 0.03 0.00 -1.73 0.00 0.00 68.15 69.28 2o4i h THR 85 CO 0.01 0.74 -0.24 0.61 -0.25 0.00 0.00 175.52 176.38 2o4i n GLY 86 N 0.74 0.24 3.30 5.82 0.00 0.58 -4.83 105.19 111.03 2o4i n GLY 86 Ca -0.00 -0.40 -0.17 0.00 0.00 0.00 0.00 46.02 45.44 2o4i n GLY 86 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2o4i s LEU 87 N -3.04 2.52 0.06 0.99 1.43 -1.04 -5.04 118.68 114.57 2o4i s LEU 87 Ca 0.14 -0.98 -0.19 0.00 -1.03 0.00 0.00 54.13 52.07 2o4i s LEU 87 Cb -0.06 -0.55 0.04 0.00 0.03 0.00 0.00 46.19 45.65 2o4i s LEU 87 CO 0.17 -0.22 0.44 -0.94 0.23 0.00 0.00 176.35 176.04 2o4i s SER 88 N -3.13 -0.32 0.29 2.29 1.04 -1.26 -4.50 113.70 108.11 2o4i s SER 88 Ca 0.18 -0.02 -0.02 0.00 0.48 0.00 0.00 55.95 56.58 2o4i s SER 88 Cb -0.00 0.46 0.42 0.00 0.10 0.00 0.00 66.02 67.00 2o4i s SER 88 CO 0.04 -0.73 1.89 0.50 0.98 0.00 0.00 173.24 175.92 2o4i h LYS 89 N 2.79 0.93 -0.51 4.02 3.64 -1.94 -1.39 116.57 124.11 2o4i h LYS 89 Ca -0.32 -0.13 0.02 0.00 -1.27 0.00 0.00 60.65 58.95 2o4i h LYS 89 Cb 1.22 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 32.84 2o4i h LYS 89 CO 0.43 0.73 0.32 0.00 -2.27 0.00 0.00 179.45 178.66 2o4i h ALA 90 N 1.40 0.65 -0.24 5.00 0.00 -1.97 -0.88 119.26 123.23 2o4i h ALA 90 Ca 0.23 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.93 2o4i h ALA 90 Cb 0.11 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2o4i h ALA 90 CO -0.03 0.03 -0.57 1.49 0.00 0.00 0.00 179.25 180.18 2o4i h GLU 91 N 0.63 0.81 -0.63 0.00 4.57 -1.90 -2.53 114.58 115.54 2o4i h GLU 91 Ca 0.20 -0.55 -0.09 0.00 -1.18 0.00 0.00 59.36 57.74 2o4i h GLU 91 Cb -0.01 0.08 -0.02 0.00 -0.16 0.00 0.00 28.75 28.63 2o4i h GLU 91 CO -0.08 1.18 0.06 -0.07 -1.18 0.00 0.00 179.01 178.92 2o4i h LEU 92 N 0.57 1.03 -0.48 1.64 3.38 -1.16 -2.73 115.31 117.56 2o4i h LEU 92 Ca -0.00 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.61 2o4i h LEU 92 Cb 1.19 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 2o4i h LEU 92 CO 0.12 1.05 -0.07 -0.33 0.09 0.00 0.00 178.44 179.30 2o4i h GLU 93 N 0.98 0.89 0.00 1.13 5.08 -1.18 -2.07 114.58 119.42 2o4i h GLU 93 Ca 0.19 -0.32 -0.07 0.00 -1.00 0.00 0.00 59.36 58.16 2o4i h GLU 93 Cb 0.49 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.67 2o4i h GLU 93 CO 0.02 0.96 -0.32 -0.24 -1.00 0.00 0.00 179.01 178.43 2o4i h VAL 94 N 0.74 1.11 -0.26 3.13 3.04 -1.35 -1.84 116.25 120.81 2o4i h VAL 94 Ca 0.13 -1.16 0.00 0.00 -1.01 0.00 0.00 66.70 64.65 2o4i h VAL 94 Cb 0.61 1.65 0.00 0.00 -2.01 0.00 0.00 31.29 31.54 2o4i h VAL 94 CO 0.04 0.32 0.00 0.00 -1.01 0.00 0.00 177.57 176.92 2o4i n GLN 95 N -3.97 1.75 -1.95 4.17 6.02 -1.04 -4.94 117.38 117.43 2o4i n GLN 95 Ca -0.02 -1.16 -0.07 0.00 -0.01 0.00 0.00 57.00 55.75 2o4i n GLN 95 Cb 0.39 -1.32 -0.01 0.00 1.02 0.00 0.00 30.24 30.31 2o4i n GLN 95 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2o4i n GLY 96 N 1.08 0.25 3.70 1.08 0.00 -0.69 -4.99 105.19 105.61 2o4i n GLY 96 Ca 0.14 -0.64 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 2o4i n GLY 96 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2o4i s ARG 97 N -4.00 4.36 0.86 1.61 1.81 -0.79 -5.02 118.95 117.80 2o4i s ARG 97 Ca 0.00 1.78 -0.12 0.00 -1.72 0.00 0.00 55.73 55.67 2o4i s ARG 97 Cb 0.00 -3.48 0.11 0.00 -0.45 0.00 0.00 34.95 31.13 2o4i s ARG 97 CO 0.00 -0.41 1.14 -0.65 -0.68 0.00 0.00 175.30 174.70 2o4i s GLN 98 N 1.83 1.52 1.04 3.54 -0.21 -1.26 -4.09 119.66 122.02 2o4i s GLN 98 Ca 0.59 0.30 -0.16 0.00 0.02 0.00 0.00 55.36 56.10 2o4i s GLN 98 Cb -0.28 -1.88 0.22 0.00 1.00 0.00 0.00 33.01 32.06 2o4i s GLN 98 CO 0.26 -1.94 1.20 1.03 -2.12 0.00 0.00 175.29 173.71 2o4i s ARG 99 N -5.34 0.05 -1.00 2.91 1.81 -1.26 -1.15 118.95 114.97 2o4i s ARG 99 Ca 0.63 -0.11 -0.23 0.00 -1.72 0.00 0.00 55.73 54.30 2o4i s ARG 99 Cb -0.14 -1.75 -0.01 0.00 -0.45 0.00 0.00 34.95 32.60 2o4i s ARG 99 CO 0.52 -2.86 1.77 0.12 -0.68 0.00 0.00 175.30 174.17 2o4i s PHE 100 N -3.40 2.12 0.53 -0.53 5.36 -1.26 -4.77 117.98 116.03 2o4i s PHE 100 Ca 0.70 -0.02 0.05 0.00 -0.96 0.00 0.00 56.93 56.70 2o4i s PHE 100 Cb -0.09 -4.30 0.02 0.00 -0.34 0.00 0.00 43.02 38.31 2o4i s PHE 100 CO 0.54 -1.76 0.33 0.16 -1.46 0.00 0.00 175.22 173.04 2o4i s ASP 101 N 6.62 4.56 0.41 6.13 -4.77 -1.26 -4.91 116.67 123.46 2o4i s ASP 101 Ca 0.61 -1.27 0.09 0.00 -3.30 0.00 0.00 52.55 48.68 2o4i s ASP 101 Cb -0.03 0.34 0.88 0.00 -1.09 0.00 0.00 42.92 43.02 2o4i s ASP 101 CO -0.02 -1.02 2.00 0.44 0.70 0.00 0.00 175.17 177.28 2o4i h ASP 102 N 0.89 0.28 -0.81 2.11 5.19 -2.00 -2.12 116.42 119.96 2o4i h ASP 102 Ca -0.38 -0.03 0.02 0.00 -0.62 0.00 0.00 57.03 56.02 2o4i h ASP 102 Cb 1.30 -0.07 -0.04 0.00 0.18 0.00 0.00 39.33 40.69 2o4i h ASP 102 CO 0.60 0.31 0.54 -1.13 -3.12 0.00 0.00 179.24 176.44 2o4i h ASN 103 N 0.31 0.89 -0.74 6.45 -1.24 -1.95 -2.32 115.58 116.98 2o4i h ASN 103 Ca 0.08 -0.02 -0.06 0.00 0.71 0.00 0.00 56.30 57.01 2o4i h ASN 103 Cb 0.16 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 38.97 2o4i h ASN 103 CO -0.00 0.63 0.24 0.25 -1.29 0.00 0.00 177.43 177.26 2o4i h LEU 104 N 1.05 1.08 -1.04 0.34 5.85 -1.73 -1.95 115.31 118.90 2o4i h LEU 104 Ca 0.31 -0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 2o4i h LEU 104 Cb -0.03 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.69 2o4i h LEU 104 CO -0.08 1.00 0.11 0.00 -0.34 0.00 0.00 178.44 179.12 2o4i h ALA 105 N 1.14 1.22 -0.45 1.25 0.00 -1.37 -1.36 119.26 119.69 2o4i h ALA 105 Ca 0.24 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 2o4i h ALA 105 Cb 0.30 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2o4i h ALA 105 CO -0.01 0.53 0.08 0.82 0.00 0.00 0.00 179.25 180.67 2o4i h ILE 106 N 0.76 1.24 -0.90 0.00 2.04 -1.20 -1.93 117.51 117.52 2o4i h ILE 106 Ca 0.17 -0.87 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 2o4i h ILE 106 Cb 0.31 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 2o4i h ILE 106 CO 0.00 0.31 0.51 0.25 0.00 0.00 0.00 178.15 179.21 2o4i h LEU 107 N 0.60 1.12 -0.17 1.44 5.85 -0.89 -0.50 115.31 122.75 2o4i h LEU 107 Ca 0.14 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 2o4i h LEU 107 Cb 0.37 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2o4i h LEU 107 CO 0.01 0.88 -0.00 -0.07 -0.34 0.00 0.00 178.44 178.92 2o4i h LEU 108 N 1.26 0.29 -0.80 2.25 3.38 -1.18 -2.15 115.31 118.36 2o4i h LEU 108 Ca 0.32 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2o4i h LEU 108 Cb 0.01 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2o4i h LEU 108 CO -0.05 0.54 0.36 -0.09 0.09 0.00 0.00 178.44 179.28 2o4i h ARG 109 N 0.04 1.17 -0.72 1.13 2.43 -1.03 0.32 114.38 117.71 2o4i h ARG 109 Ca 0.05 -0.19 -0.07 0.00 -0.81 0.00 0.00 59.98 58.96 2o4i h ARG 109 Cb 0.39 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.71 2o4i h ARG 109 CO 0.01 0.92 0.18 0.00 -1.51 0.00 0.00 179.97 179.57 2o4i h ALA 110 N 1.19 0.95 -0.33 2.80 0.00 -1.12 -0.90 119.26 121.85 2o4i h ALA 110 Ca 0.27 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 2o4i h ALA 110 Cb 0.16 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 2o4i h ALA 110 CO -0.03 0.67 -0.11 0.35 0.00 0.00 0.00 179.25 180.13 2o4i h PHE 111 N 1.09 0.75 -0.52 0.00 3.57 -0.84 -3.21 116.94 117.79 2o4i h PHE 111 Ca 0.23 -0.17 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2o4i h PHE 111 Cb 0.37 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 2o4i h PHE 111 CO 0.03 0.84 0.27 -0.07 -2.23 0.00 0.00 178.31 177.16 2o4i h LEU 112 N 0.43 0.66 -1.75 0.59 3.38 -0.23 -3.06 115.31 115.34 2o4i h LEU 112 Ca 0.08 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2o4i h LEU 112 Cb 0.62 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 2o4i h LEU 112 CO 0.04 0.58 -0.15 -0.61 0.09 0.00 0.00 178.44 178.38 2o4i h GLN 113 N 0.70 0.00 -0.19 1.13 4.15 -1.18 -0.75 115.11 118.96 2o4i h GLN 113 Ca 0.18 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.56 2o4i h GLN 113 Cb 0.07 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.75 2o4i h GLN 113 CO -0.03 0.15 -0.05 0.00 -1.93 0.00 0.00 178.83 176.98 2o4i h ARG 114 N 0.00 0.29 -6.24 1.69 3.08 -1.53 -3.43 114.38 108.24 2o4i h ARG 114 Ca -0.00 -0.05 -0.56 0.00 0.07 0.00 0.00 59.98 59.43 2o4i h ARG 114 Cb 0.29 -0.05 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 2o4i h ARG 114 CO 0.02 0.36 0.64 -0.65 -1.07 0.00 0.00 179.97 179.27 2o4i s GLN 115 N -4.89 4.38 -0.21 0.04 -1.52 -0.29 -4.96 119.66 112.21 2o4i s GLN 115 Ca -0.06 1.46 -0.39 0.00 -1.95 0.00 0.00 55.36 54.42 2o4i s GLN 115 Cb 0.16 -3.57 -0.15 0.00 -0.22 0.00 0.00 33.01 29.23 2o4i s GLN 115 CO 0.73 -0.40 1.73 -2.30 -0.25 0.00 0.00 175.29 174.80 2o4i n PRO 116 N 5.29 1.34 -2.36 2.91 -0.02 -1.26 -4.85 135.00 136.05 2o4i n PRO 116 Ca 0.10 0.49 -0.32 0.00 -2.02 0.00 0.00 63.50 61.75 2o4i n PRO 116 Cb 0.48 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 2o4i n PRO 116 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2o4i s GLN 117 N 3.32 3.89 0.03 -0.52 -1.52 -1.26 -3.73 119.66 119.87 2o4i s GLN 117 Ca 0.96 0.98 -0.28 0.00 -1.95 0.00 0.00 55.36 55.07 2o4i s GLN 117 Cb -0.99 -2.13 -0.04 0.00 -0.22 0.00 0.00 33.01 29.63 2o4i s GLN 117 CO 0.61 -0.32 0.89 -1.25 -0.25 0.00 0.00 175.29 174.97 2o4i s PRO 118 N -4.07 4.57 0.01 2.91 0.05 -1.26 -4.68 135.00 132.52 2o4i s PRO 118 Ca 0.59 1.28 -0.07 0.00 0.05 0.00 0.00 61.00 62.85 2o4i s PRO 118 Cb -0.10 -3.42 -0.05 0.00 0.05 0.00 0.00 34.50 30.98 2o4i s PRO 118 CO 0.32 0.11 0.28 0.00 0.05 0.00 0.00 177.00 177.75 2o4i s LEU 121 N 0.96 3.93 -0.09 0.00 1.43 0.36 -1.22 118.68 124.05 2o4i s LEU 121 Ca -0.06 2.19 -0.02 0.00 -1.03 0.00 0.00 54.13 55.21 2o4i s LEU 121 Cb -0.15 -4.37 0.03 0.00 0.03 0.00 0.00 46.19 41.73 2o4i s LEU 121 CO -0.03 -0.94 0.02 -0.69 0.23 0.00 0.00 176.35 174.94 2o4i s VAL 122 N -1.68 0.34 -0.00 -1.59 1.01 0.25 -1.09 120.40 117.64 2o4i s VAL 122 Ca 0.66 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.66 2o4i s VAL 122 Cb -0.25 -0.59 0.00 0.00 0.00 0.00 0.00 36.38 35.55 2o4i s VAL 122 CO 0.30 0.15 -0.00 0.00 0.00 0.00 0.00 175.10 175.54 2o4i s ALA 123 N 1.98 0.07 -0.08 5.51 0.00 -1.14 0.22 121.76 128.31 2o4i s ALA 123 Ca 0.04 0.01 -0.30 0.00 0.00 0.00 0.00 51.96 51.71 2o4i s ALA 123 Cb -0.13 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 22.92 2o4i s ALA 123 CO -0.06 0.00 1.12 -1.58 0.00 0.00 0.00 175.76 175.24 2o4i s HIS 124 N 0.11 3.31 -1.45 0.00 2.46 -1.26 -1.80 115.29 116.65 2o4i s HIS 124 Ca -0.01 1.37 -0.09 0.00 0.47 0.00 0.00 55.06 56.80 2o4i s HIS 124 Cb -0.02 -3.33 0.04 0.00 -0.13 0.00 0.00 32.58 29.14 2o4i s HIS 124 CO -0.00 -0.86 0.91 -1.71 -2.47 0.00 0.00 174.74 170.60 2o4i n ASN 125 N 5.20 -5.66 -0.08 9.88 4.05 -1.26 -4.77 115.26 122.62 2o4i n ASN 125 Ca 0.10 -0.52 -0.15 0.00 0.45 0.00 0.00 54.58 54.46 2o4i n ASN 125 Cb 0.47 -4.51 -0.05 0.00 1.23 0.00 0.00 39.78 36.92 2o4i n ASN 125 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 177.26 175.44 2o4i h GLY 126 N -2.02 0.90 2.00 8.20 0.00 -1.68 -0.79 103.07 109.67 2o4i h GLY 126 Ca -0.55 -1.03 -0.01 0.00 0.00 0.00 0.00 47.33 45.74 2o4i h GLY 126 CO 0.59 0.92 -0.05 -0.55 0.00 0.00 0.00 176.54 177.46 2o4i h ASP 127 N 0.59 0.00 -0.00 0.19 3.32 -1.90 -0.41 116.42 118.20 2o4i h ASP 127 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2o4i h ASP 127 Cb 1.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.64 2o4i h ASP 127 CO 0.11 0.05 -0.38 0.54 -1.72 0.00 0.00 179.24 177.83 2o4i n ARG 128 N -3.29 3.22 0.00 3.56 1.74 -1.17 -4.71 116.66 116.02 2o4i n ARG 128 Ca -0.01 -0.20 0.00 0.00 -0.77 0.00 0.00 57.85 56.86 2o4i n ARG 128 Cb 0.21 -1.00 0.00 0.00 -1.02 0.00 0.00 32.46 30.65 2o4i n ARG 128 CO 0.00 0.00 0.00 0.98 -1.52 0.00 0.00 177.63 177.09 2o4i n TYR 129 N -0.91 -0.07 -0.03 -1.55 9.36 -0.31 -4.91 117.16 118.74 2o4i n TYR 129 Ca 0.03 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.24 2o4i n TYR 129 Cb 0.17 0.50 0.26 0.00 -0.63 0.00 0.00 39.34 39.64 2o4i n TYR 129 CO 0.00 0.00 0.00 -0.44 0.22 0.00 0.00 176.86 176.64 2o4i h ASP 130 N 0.00 0.57 0.01 2.98 3.32 -1.57 -2.16 116.42 119.57 2o4i h ASP 130 Ca 0.00 -0.11 -0.00 0.00 0.02 0.00 0.00 57.03 56.94 2o4i h ASP 130 Cb 0.00 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.40 2o4i h ASP 130 CO 0.00 0.63 -0.00 -0.26 -1.72 0.00 0.00 179.24 177.89 2o4i h PHE 131 N 0.58 -0.01 -0.81 4.55 0.05 -1.38 -2.78 116.94 117.13 2o4i h PHE 131 Ca 0.12 -0.00 0.10 0.00 3.82 0.00 0.00 57.97 62.01 2o4i h PHE 131 Cb 0.35 0.00 -0.06 0.00 2.00 0.00 0.00 35.95 38.25 2o4i h PHE 131 CO 0.01 0.66 0.53 -1.35 -0.18 0.00 0.00 178.31 177.98 2o4i h PRO 132 N -0.99 0.71 -0.06 1.51 0.11 -1.71 0.15 132.00 131.72 2o4i h PRO 132 Ca -0.00 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 66.05 2o4i h PRO 132 Cb 0.67 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.62 2o4i h PRO 132 CO 0.00 0.47 -0.03 1.25 -0.21 0.00 0.00 178.00 179.47 2o4i h LEU 133 N 0.73 0.14 -1.23 2.35 6.46 -1.52 -0.66 115.31 121.58 2o4i h LEU 133 Ca 0.38 -0.43 0.02 0.00 -0.12 0.00 0.00 57.88 57.74 2o4i h LEU 133 Cb 0.49 -0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 40.34 2o4i h LEU 133 CO -0.15 0.53 0.53 0.25 -0.62 0.00 0.00 178.44 178.98 2o4i h LEU 134 N -0.26 0.88 -0.60 2.25 5.85 -1.17 0.11 115.31 122.36 2o4i h LEU 134 Ca 0.01 -0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.62 2o4i h LEU 134 Cb 0.48 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 2o4i h LEU 134 CO 0.01 0.62 0.01 -0.61 -0.34 0.00 0.00 178.44 178.13 2o4i h GLN 135 N 1.03 1.06 -0.41 1.25 5.75 -0.62 -1.40 115.11 121.76 2o4i h GLN 135 Ca 0.30 -0.33 -0.10 0.00 -0.15 0.00 0.00 58.65 58.37 2o4i h GLN 135 Cb -0.04 -0.10 -0.02 0.00 1.07 0.00 0.00 27.48 28.39 2o4i h GLN 135 CO -0.08 1.03 -0.15 1.15 -2.65 0.00 0.00 178.83 178.14 2o4i h THR 136 N 0.96 1.26 -0.32 2.39 2.02 -0.35 0.12 112.91 118.99 2o4i h THR 136 Ca 0.17 -1.22 -0.14 0.00 0.77 0.00 0.00 66.41 65.99 2o4i h THR 136 Cb 0.55 1.10 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 2o4i h THR 136 CO 0.03 0.41 -0.36 -0.33 0.37 0.00 0.00 175.52 175.64 2o4i h GLU 137 N 0.68 0.74 0.00 6.66 4.39 -0.89 -2.83 114.58 123.33 2o4i h GLU 137 Ca 0.11 -0.37 -0.06 0.00 0.34 0.00 0.00 59.36 59.39 2o4i h GLU 137 Cb 0.63 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.28 2o4i h GLU 137 CO 0.04 0.99 -0.26 -0.07 -1.16 0.00 0.00 179.01 178.55 2o4i h LEU 138 N 0.62 0.00 -1.11 1.33 3.38 -1.06 -3.03 115.31 115.43 2o4i h LEU 138 Ca 0.06 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.95 2o4i h LEU 138 Cb 0.90 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 2o4i h LEU 138 CO 0.08 0.26 -0.29 0.00 0.09 0.00 0.00 178.44 178.59 2o4i h ALA 139 N 1.74 1.26 -0.26 1.53 0.00 -0.73 -2.89 119.26 119.90 2o4i h ALA 139 Ca -0.00 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 2o4i h ALA 139 Cb 0.83 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 2o4i h ALA 139 CO 0.03 0.50 -0.17 0.00 0.00 0.00 0.00 179.25 179.61 2o4i h ARG 140 N 0.24 0.46 -6.79 0.00 3.08 -1.40 -3.45 114.38 106.52 2o4i h ARG 140 Ca 0.03 -0.14 -0.51 0.00 0.07 0.00 0.00 59.98 59.43 2o4i h ARG 140 Cb 0.63 -0.04 0.03 0.00 0.08 0.00 0.00 29.97 30.67 2o4i h ARG 140 CO 0.05 0.62 0.54 -0.51 -1.07 0.00 0.00 179.97 179.60 2o4i s LEU 141 N -8.77 4.50 0.39 3.04 1.43 -1.09 -4.94 118.68 113.24 2o4i s LEU 141 Ca -0.07 2.37 0.19 0.00 -1.03 0.00 0.00 54.13 55.60 2o4i s LEU 141 Cb 0.14 -3.63 0.76 0.00 0.03 0.00 0.00 46.19 43.49 2o4i s LEU 141 CO 0.78 -0.30 1.77 0.77 0.23 0.00 0.00 176.35 179.60 2o4i h SER 142 N 4.04 0.00 -4.32 2.29 4.64 -1.87 -3.44 113.55 114.89 2o4i h SER 142 Ca -0.47 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.34 2o4i h SER 142 Cb 1.22 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 63.40 2o4i h SER 142 CO 0.68 0.34 0.37 0.42 -0.87 0.00 0.00 176.83 177.78 2o4i s THR 143 N -3.69 3.98 0.89 2.95 -4.23 -1.26 -5.05 115.64 109.23 2o4i s THR 143 Ca -0.00 0.68 -0.11 0.00 -1.18 0.00 0.00 61.69 61.08 2o4i s THR 143 Cb 0.11 -3.38 0.13 0.00 1.34 0.00 0.00 72.50 70.69 2o4i s THR 143 CO 0.68 -0.80 1.09 -2.84 -0.54 0.00 0.00 174.62 172.21 2o4i s PRO 144 N -4.90 1.30 0.04 3.99 0.02 -1.26 -4.97 135.00 129.21 2o4i s PRO 144 Ca 0.59 1.00 -0.30 0.00 0.02 0.00 0.00 61.00 62.30 2o4i s PRO 144 Cb -0.14 -1.80 -0.06 0.00 0.02 0.00 0.00 34.50 32.52 2o4i s PRO 144 CO 0.52 -2.26 1.36 0.45 -0.33 0.00 0.00 177.00 176.74 2o4i s SER 145 N -3.25 6.89 0.37 2.53 0.15 -1.26 -4.92 113.70 114.21 2o4i s SER 145 Ca 0.64 2.14 0.26 0.00 0.70 0.00 0.00 55.95 59.68 2o4i s SER 145 Cb -0.19 -2.57 0.75 0.00 -1.71 0.00 0.00 66.02 62.30 2o4i s SER 145 CO 0.57 -0.66 1.74 1.55 1.20 0.00 0.00 173.24 177.65 2o4i h PRO 146 N 7.39 0.00 -1.23 5.44 0.13 -1.93 -3.21 132.00 138.59 2o4i h PRO 146 Ca -0.39 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.27 2o4i h PRO 146 Cb 1.19 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.11 2o4i h PRO 146 CO 0.88 0.00 0.61 1.28 -0.23 0.00 0.00 178.00 180.53 2o4i n LEU 147 N -2.73 6.82 0.05 1.56 4.77 -1.26 -4.61 117.00 121.59 2o4i n LEU 147 Ca 0.04 -3.63 -0.09 0.00 -0.03 0.00 0.00 56.01 52.29 2o4i n LEU 147 Cb 0.42 -0.97 -0.06 0.00 -2.33 0.00 0.00 43.42 40.47 2o4i n LEU 147 CO 0.30 1.26 0.30 -0.78 -1.33 0.00 0.00 177.39 177.14 2o4i h ASP 148 N 1.55 -0.18 1.30 -1.43 3.58 -1.97 -3.32 116.42 115.94 2o4i h ASP 148 Ca 0.44 -0.30 0.00 0.00 0.42 0.00 0.00 57.03 57.59 2o4i h ASP 148 Cb 1.12 0.05 0.00 0.00 1.72 0.00 0.00 39.33 42.22 2o4i h ASP 148 CO 1.09 0.38 0.00 1.23 -2.88 0.00 0.00 179.24 179.06 2o4i h GLY 149 N -0.95 0.00 -1.56 -0.78 0.00 -1.89 -3.41 103.07 94.48 2o4i h GLY 149 Ca -0.02 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.81 2o4i h GLY 149 CO 0.04 0.00 0.37 -0.51 0.00 0.00 0.00 176.54 176.44 2o4i s THR 150 N -3.36 3.84 0.58 4.70 -4.23 -1.25 -4.83 115.64 111.09 2o4i s THR 150 Ca 0.05 0.75 0.08 0.00 -1.18 0.00 0.00 61.69 61.39 2o4i s THR 150 Cb 0.09 -3.35 0.08 0.00 1.34 0.00 0.00 72.50 70.66 2o4i s THR 150 CO 0.55 -0.63 0.68 -0.36 -0.54 0.00 0.00 174.62 174.32 2o4i s PHE 151 N -2.69 1.37 0.14 3.99 0.08 0.08 -1.85 117.98 119.10 2o4i s PHE 151 Ca 0.61 -0.79 -0.15 0.00 0.12 0.00 0.00 56.93 56.73 2o4i s PHE 151 Cb -0.15 -2.10 0.02 0.00 -0.57 0.00 0.00 43.02 40.22 2o4i s PHE 151 CO 0.45 -0.99 0.40 0.00 -0.10 0.00 0.00 175.22 174.98 2o4i s VAL 153 N -3.85 0.00 -0.18 0.00 0.11 -0.25 -2.26 120.40 113.98 2o4i s VAL 153 Ca 0.06 0.00 -0.20 0.00 -2.93 0.00 0.00 61.98 58.91 2o4i s VAL 153 Cb 0.02 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.84 2o4i s VAL 153 CO -0.08 0.00 0.60 -0.62 -3.33 0.00 0.00 175.10 171.67 2o4i s ASP 154 N 0.05 6.70 0.49 3.54 -1.08 -1.26 -2.90 116.67 122.20 2o4i s ASP 154 Ca -0.01 0.84 0.28 0.00 -0.52 0.00 0.00 52.55 53.14 2o4i s ASP 154 Cb -0.04 -2.34 1.16 0.00 -1.46 0.00 0.00 42.92 40.24 2o4i s ASP 154 CO 0.00 -0.21 1.92 0.77 0.52 0.00 0.00 175.17 178.17 2o4i h SER 155 N 7.32 0.00 -0.27 -0.34 4.64 -1.90 -2.81 113.55 120.19 2o4i h SER 155 Ca -0.34 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.97 2o4i h SER 155 Cb 1.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 2o4i h SER 155 CO 0.76 0.14 0.12 0.40 -0.87 0.00 0.00 176.83 177.39 2o4i h ILE 156 N 0.00 1.16 -0.28 0.95 2.04 -1.92 -0.82 117.51 118.64 2o4i h ILE 156 Ca -0.00 -0.48 -0.03 0.00 1.00 0.00 0.00 64.86 65.35 2o4i h ILE 156 Cb 0.60 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 2o4i h ILE 156 CO 0.02 0.16 0.03 0.00 0.00 0.00 0.00 178.15 178.36 2o4i h ALA 157 N 0.97 1.52 0.10 1.87 0.00 -1.92 -1.36 119.26 120.45 2o4i h ALA 157 Ca 0.09 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2o4i h ALA 157 Cb 0.15 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2o4i h ALA 157 CO -0.01 0.35 -0.05 0.00 0.00 0.00 0.00 179.25 179.54 2o4i h ALA 158 N 1.63 -0.14 -0.09 0.00 0.00 -1.31 -3.04 119.26 116.31 2o4i h ALA 158 Ca 0.09 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.71 2o4i h ALA 158 Cb 0.23 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2o4i h ALA 158 CO 0.00 -0.39 -0.43 -0.07 0.00 0.00 0.00 179.25 178.36 2o4i h LEU 159 N -0.51 0.22 -0.91 0.00 -0.00 -1.04 -1.68 115.31 111.39 2o4i h LEU 159 Ca -0.01 -0.09 0.01 0.00 -0.00 0.00 0.00 57.88 57.78 2o4i h LEU 159 Cb 0.42 -0.06 -0.05 0.00 -0.00 0.00 0.00 40.66 40.97 2o4i h LEU 159 CO 0.02 0.63 0.60 0.11 -0.00 0.00 0.00 178.44 179.80 2o4i h LYS 160 N 0.17 1.19 -0.13 1.13 1.57 -1.31 0.55 116.57 119.75 2o4i h LYS 160 Ca 0.01 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 2o4i h LYS 160 Cb 0.84 -0.27 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 2o4i h LYS 160 CO 0.07 0.79 -0.20 0.00 -0.57 0.00 0.00 179.45 179.53 2o4i h ALA 161 N 1.34 0.20 -0.49 3.86 0.00 -1.35 -2.67 119.26 120.15 2o4i h ALA 161 Ca 0.34 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 2o4i h ALA 161 Cb -0.13 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2o4i h ALA 161 CO -0.08 0.14 0.14 -0.07 0.00 0.00 0.00 179.25 179.38 2o4i h LEU 162 N -0.05 0.72 -0.24 0.00 3.38 -1.20 -2.61 115.31 115.31 2o4i h LEU 162 Ca 0.01 -0.21 -0.20 0.00 0.09 0.00 0.00 57.88 57.56 2o4i h LEU 162 Cb 0.77 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2o4i h LEU 162 CO 0.05 0.74 -0.91 -0.08 0.09 0.00 0.00 178.44 178.33 2o4i h GLU 163 N 0.66 0.21 0.00 1.13 4.81 -0.97 -2.53 114.58 117.89 2o4i h GLU 163 Ca 0.16 -0.24 -0.05 0.00 -0.13 0.00 0.00 59.36 59.09 2o4i h GLU 163 Cb 0.29 0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.73 2o4i h GLU 163 CO -0.00 0.98 -0.26 1.96 -0.73 0.00 0.00 179.01 180.96 2o4i h GLN 164 N 0.11 0.00 -0.67 1.92 4.20 -1.51 -3.51 115.11 115.65 2o4i h GLN 164 Ca -0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.66 2o4i h GLN 164 Cb 1.55 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.33 2o4i h GLN 164 CO 0.14 0.26 0.00 0.00 -0.67 0.00 0.00 178.83 178.56 2o4i n ALA 165 N -2.35 2.26 -2.48 3.87 0.00 -0.96 -5.10 120.51 115.74 2o4i n ALA 165 Ca -0.01 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.29 2o4i n ALA 165 Cb 0.35 -1.00 0.03 0.00 0.00 0.00 0.00 19.45 18.83 2o4i n ALA 165 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2o4i n ARG 174 N -0.02 2.54 0.00 0.00 0.63 -1.26 -4.98 116.66 113.56 2o4i n ARG 174 Ca 0.00 -3.84 0.00 0.00 -0.92 0.00 0.00 57.85 53.09 2o4i n ARG 174 Cb 0.17 -1.88 0.00 0.00 0.45 0.00 0.00 32.46 31.20 2o4i n ARG 174 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2o4i n LYS 175 N -0.53 0.00 -1.59 -0.14 5.02 -1.26 -5.08 118.16 114.58 2o4i n LYS 175 Ca 0.25 0.00 -0.59 0.00 -2.02 0.00 0.00 58.31 55.95 2o4i n LYS 175 Cb 0.84 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 35.76 2o4i n LYS 175 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2o4i n SER 176 N 0.00 1.85 -2.56 4.39 7.64 -1.26 -4.88 113.62 118.80 2o4i n SER 176 Ca 0.00 0.90 -0.32 0.00 1.01 0.00 0.00 58.87 60.46 2o4i n SER 176 Cb 0.00 -1.07 0.03 0.00 -1.01 0.00 0.00 64.21 62.15 2o4i n SER 176 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2o4i n TYR 177 N 6.36 3.16 -1.94 1.43 4.01 -1.26 -4.63 117.16 124.29 2o4i n TYR 177 Ca 0.35 -2.71 -0.30 0.00 -0.16 0.00 0.00 57.90 55.08 2o4i n TYR 177 Cb 0.08 -0.67 0.04 0.00 -0.31 0.00 0.00 39.34 38.48 2o4i n TYR 177 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2o4i s SER 178 N -2.46 5.51 0.11 7.72 0.15 -1.26 -4.92 113.70 118.55 2o4i s SER 178 Ca 0.52 1.11 -0.20 0.00 0.70 0.00 0.00 55.95 58.08 2o4i s SER 178 Cb 0.43 -1.94 -0.07 0.00 -1.71 0.00 0.00 66.02 62.73 2o4i s SER 178 CO -0.22 -1.28 1.73 0.25 1.20 0.00 0.00 173.24 174.91 2o4i h LEU 179 N -0.59 0.26 -0.87 3.45 5.85 -1.98 -1.96 115.31 119.47 2o4i h LEU 179 Ca -0.45 -0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.09 2o4i h LEU 179 Cb 1.25 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 42.20 2o4i h LEU 179 CO 0.63 0.25 -0.41 1.23 -0.34 0.00 0.00 178.44 179.80 2o4i h GLY 180 N 0.25 0.35 1.29 3.75 0.00 -2.00 -2.67 103.07 104.05 2o4i h GLY 180 Ca 0.08 -0.34 -0.16 0.00 0.00 0.00 0.00 47.33 46.91 2o4i h GLY 180 CO -0.01 0.31 -0.46 1.76 0.00 0.00 0.00 176.54 178.13 2o4i h SER 181 N 0.27 0.82 -0.11 0.19 0.02 -1.87 -2.63 113.55 110.25 2o4i h SER 181 Ca 0.02 -0.40 -0.05 0.00 -0.84 0.00 0.00 61.79 60.52 2o4i h SER 181 Cb 0.84 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 63.15 2o4i h SER 181 CO 0.07 1.16 -0.13 0.40 -1.14 0.00 0.00 176.83 177.19 2o4i h ILE 182 N 0.61 1.36 -0.70 3.27 2.04 -1.34 -2.49 117.51 120.25 2o4i h ILE 182 Ca 0.03 -1.31 0.01 0.00 1.00 0.00 0.00 64.86 64.60 2o4i h ILE 182 Cb 1.03 1.97 -0.04 0.00 -0.74 0.00 0.00 36.82 39.04 2o4i h ILE 182 CO 0.10 0.37 0.46 0.22 0.00 0.00 0.00 178.15 179.31 2o4i h TYR 183 N -0.12 0.87 -0.08 1.37 3.20 -1.51 -1.47 116.97 119.23 2o4i h TYR 183 Ca 0.02 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 61.79 2o4i h TYR 183 Cb 0.66 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.62 2o4i h TYR 183 CO 0.09 0.54 -0.47 1.79 -1.64 0.00 0.00 178.16 178.47 2o4i h THR 184 N 0.94 1.34 -0.29 1.81 1.35 -1.53 -2.34 112.91 114.17 2o4i h THR 184 Ca 0.26 -1.67 -0.04 0.00 -0.55 0.00 0.00 66.41 64.41 2o4i h THR 184 Cb -0.09 1.81 -0.01 0.00 -1.73 0.00 0.00 68.15 68.13 2o4i h THR 184 CO -0.07 0.49 0.02 0.03 -0.25 0.00 0.00 175.52 175.75 2o4i h ARG 185 N 0.16 0.50 -0.06 4.72 3.08 -0.95 -1.32 114.38 120.52 2o4i h ARG 185 Ca 0.01 -0.15 -0.07 0.00 0.07 0.00 0.00 59.98 59.84 2o4i h ARG 185 Cb 0.90 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.90 2o4i h ARG 185 CO 0.07 0.64 -0.24 -0.07 -1.07 0.00 0.00 179.97 179.30 2o4i h LEU 186 N 0.31 0.31 -0.08 3.04 3.38 -1.21 -3.39 115.31 117.67 2o4i h LEU 186 Ca 0.09 -0.64 0.00 0.00 0.09 0.00 0.00 57.88 57.42 2o4i h LEU 186 Cb 0.40 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2o4i h LEU 186 CO 0.01 0.90 -0.23 -1.22 0.09 0.00 0.00 178.44 177.99 2o4i n TYR 187 N -4.51 0.00 -3.41 1.13 4.02 -0.89 -4.38 117.16 109.12 2o4i n TYR 187 Ca -0.08 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.61 2o4i n TYR 187 Cb 0.46 0.00 0.07 0.00 -0.02 0.00 0.00 39.34 39.84 2o4i n TYR 187 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 2o4i n TRP 188 N -1.02 -2.41 -4.11 -0.72 7.02 -0.50 -4.79 117.44 110.90 2o4i n TRP 188 Ca 0.01 0.86 -0.11 0.00 -1.02 0.00 0.00 57.50 57.24 2o4i n TRP 188 Cb 0.09 -4.45 -0.10 0.00 -2.42 0.00 0.00 31.31 24.42 2o4i n TRP 188 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 2o4i s GLN 189 N -6.04 0.68 0.28 -0.99 -0.21 -1.26 -5.05 119.66 107.07 2o4i s GLN 189 Ca 0.46 -1.11 -0.29 0.00 0.02 0.00 0.00 55.36 54.44 2o4i s GLN 189 Cb -0.20 -0.14 -0.09 0.00 1.00 0.00 0.00 33.01 33.57 2o4i s GLN 189 CO 0.62 -0.02 0.99 0.00 -2.12 0.00 0.00 175.29 174.77 2o4i s ALA 190 N -2.90 3.31 0.34 6.09 0.00 -1.26 -4.02 121.76 123.33 2o4i s ALA 190 Ca 0.03 0.69 -0.29 0.00 0.00 0.00 0.00 51.96 52.39 2o4i s ALA 190 Cb 0.00 -3.24 -0.11 0.00 0.00 0.00 0.00 23.12 19.77 2o4i s ALA 190 CO -0.04 0.06 1.53 -2.14 0.00 0.00 0.00 175.76 175.17 2o4i s PRO 191 N -1.52 4.12 -0.08 0.00 0.02 -1.26 -4.97 135.00 131.31 2o4i s PRO 191 Ca 0.45 2.57 -0.29 0.00 0.02 0.00 0.00 61.00 63.75 2o4i s PRO 191 Cb -0.26 -2.99 -0.02 0.00 0.02 0.00 0.00 34.50 31.25 2o4i s PRO 191 CO 0.33 -0.57 0.96 0.99 -0.33 0.00 0.00 177.00 178.37 2o4i s THR 192 N -0.64 4.84 -0.56 0.99 2.01 -1.26 -4.34 115.64 116.68 2o4i s THR 192 Ca 0.57 1.96 -0.17 0.00 0.31 0.00 0.00 61.69 64.36 2o4i s THR 192 Cb -0.47 -4.28 0.02 0.00 0.01 0.00 0.00 72.50 67.79 2o4i s THR 192 CO 0.56 0.07 0.64 0.47 -0.69 0.00 0.00 174.62 175.68 2o4i n ASP 193 N 4.61 -6.75 -4.82 3.53 9.92 -1.26 -4.79 116.55 116.98 2o4i n ASP 193 Ca 0.07 -0.01 -0.30 0.00 -0.53 0.00 0.00 54.79 54.01 2o4i n ASP 193 Cb 0.50 -3.74 0.06 0.00 -0.64 0.00 0.00 41.12 37.30 2o4i n ASP 193 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2o4i s SER 194 N -2.41 5.09 -1.28 -2.24 0.01 -1.26 -4.23 113.70 107.37 2o4i s SER 194 Ca 0.20 1.42 -0.04 0.00 1.31 0.00 0.00 55.95 58.84 2o4i s SER 194 Cb -0.04 -2.24 0.01 0.00 0.21 0.00 0.00 66.02 63.96 2o4i s SER 194 CO 0.82 -1.61 1.06 0.00 0.41 0.00 0.00 173.24 173.93 2o4i n ALA 195 N -3.21 -1.71 -3.60 1.44 0.00 -1.26 -4.95 120.51 107.22 2o4i n ALA 195 Ca 0.07 0.14 -0.12 0.00 0.00 0.00 0.00 53.44 53.53 2o4i n ALA 195 Cb 0.55 -3.75 -0.12 0.00 0.00 0.00 0.00 19.45 16.13 2o4i n ALA 195 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2o4i s THR 196 N -3.36 -0.03 0.26 0.00 -4.23 -1.26 -4.39 115.64 102.63 2o4i s THR 196 Ca 0.26 0.11 -0.05 0.00 -1.18 0.00 0.00 61.69 60.83 2o4i s THR 196 Cb -0.12 -0.42 0.31 0.00 1.34 0.00 0.00 72.50 73.61 2o4i s THR 196 CO 0.74 0.04 1.62 0.00 -0.54 0.00 0.00 174.62 176.48 2o4i h ALA 197 N 6.88 0.88 -0.11 3.99 0.00 -1.90 -0.35 119.26 128.65 2o4i h ALA 197 Ca -0.37 0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2o4i h ALA 197 Cb 1.17 0.45 0.00 0.00 0.00 0.00 0.00 17.79 19.41 2o4i h ALA 197 CO 0.35 -0.45 -0.22 1.49 0.00 0.00 0.00 179.25 180.43 2o4i h GLU 198 N 0.09 0.34 -0.77 0.00 4.81 -1.91 -2.73 114.58 114.42 2o4i h GLU 198 Ca 0.46 -0.22 0.05 0.00 -0.13 0.00 0.00 59.36 59.51 2o4i h GLU 198 Cb 0.83 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.20 2o4i h GLU 198 CO -0.72 0.82 0.51 0.78 -0.73 0.00 0.00 179.01 179.67 2o4i h GLY 199 N -0.09 1.07 1.72 1.92 0.00 -1.32 0.73 103.07 107.09 2o4i h GLY 199 Ca 0.00 -0.35 -0.20 0.00 0.00 0.00 0.00 47.33 46.78 2o4i h GLY 199 CO 0.05 0.28 -0.89 -0.55 0.00 0.00 0.00 176.54 175.43 2o4i h ASP 200 N 0.89 0.33 -0.43 0.19 3.32 -1.19 -2.34 116.42 117.18 2o4i h ASP 200 Ca 0.32 -0.26 -0.08 0.00 0.02 0.00 0.00 57.03 57.03 2o4i h ASP 200 Cb 0.14 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2o4i h ASP 200 CO -0.10 1.07 -0.04 0.58 -1.72 0.00 0.00 179.24 179.02 2o4i h VAL 201 N 0.14 1.27 -0.67 -1.35 2.07 -1.02 -0.70 116.25 115.99 2o4i h VAL 201 Ca -0.05 -1.10 -0.05 0.00 0.82 0.00 0.00 66.70 66.31 2o4i h VAL 201 Cb 1.52 1.12 -0.03 0.00 -1.52 0.00 0.00 31.29 32.38 2o4i h VAL 201 CO 0.14 0.38 0.21 -0.07 0.02 0.00 0.00 177.57 178.24 2o4i h LEU 202 N 0.61 0.96 -0.59 2.57 3.38 -0.92 -0.38 115.31 120.95 2o4i h LEU 202 Ca 0.12 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 2o4i h LEU 202 Cb 0.55 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 2o4i h LEU 202 CO 0.03 0.90 0.14 0.74 0.09 0.00 0.00 178.44 180.34 2o4i h THR 203 N 0.99 1.25 -0.69 0.22 2.02 -1.30 -2.16 112.91 113.24 2o4i h THR 203 Ca 0.22 -0.91 -0.04 0.00 0.77 0.00 0.00 66.41 66.45 2o4i h THR 203 Cb 0.29 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 2o4i h THR 203 CO -0.01 0.34 0.27 0.25 0.37 0.00 0.00 175.52 176.74 2o4i h LEU 204 N 0.85 0.96 -0.23 2.58 5.85 -0.77 -2.41 115.31 122.13 2o4i h LEU 204 Ca 0.18 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.75 2o4i h LEU 204 Cb 0.36 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 2o4i h LEU 204 CO 0.00 0.87 0.08 0.25 -0.34 0.00 0.00 178.44 179.30 2o4i h LEU 205 N 0.98 0.09 -0.62 2.25 5.85 -0.91 -1.75 115.31 121.20 2o4i h LEU 205 Ca 0.23 0.02 0.06 0.00 0.84 0.00 0.00 57.88 59.03 2o4i h LEU 205 Cb 0.22 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 2o4i h LEU 205 CO -0.02 0.08 0.33 0.28 -0.34 0.00 0.00 178.44 178.78 2o4i h SER 206 N 0.19 0.48 -0.66 1.25 0.02 -1.20 0.56 113.55 114.18 2o4i h SER 206 Ca 0.10 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.10 2o4i h SER 206 Cb 0.07 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 62.51 2o4i h SER 206 CO -0.10 0.32 0.43 0.40 -1.14 0.00 0.00 176.83 176.73 2o4i h ILE 207 N 0.62 1.13 0.00 3.27 2.04 -1.19 -2.56 117.51 120.82 2o4i h ILE 207 Ca 0.28 -0.29 -0.05 0.00 1.00 0.00 0.00 64.86 65.80 2o4i h ILE 207 Cb 0.18 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 2o4i h ILE 207 CO -0.18 0.16 -0.22 0.00 0.00 0.00 0.00 178.15 177.90 2o4i n GLN 209 N -3.38 0.81 0.48 0.00 6.02 0.10 -3.71 117.38 117.71 2o4i n GLN 209 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.79 2o4i n GLN 209 Cb 0.44 -1.50 -0.10 0.00 1.02 0.00 0.00 30.24 30.10 2o4i n GLN 209 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 177.06 178.40 2o4i h TRP 210 N 0.00 -1.21 -2.88 1.08 7.01 -1.35 -3.37 115.95 115.23 2o4i h TRP 210 Ca 0.00 -0.02 -0.61 0.00 2.11 0.00 0.00 58.89 60.37 2o4i h TRP 210 Cb 0.08 0.41 -0.40 0.00 -2.10 0.00 0.00 29.16 27.15 2o4i h TRP 210 CO 0.00 -0.73 -0.76 0.15 -2.79 0.00 0.00 178.44 174.31 2o4i s LYS 211 N -5.99 1.31 -0.03 2.65 1.02 -1.26 -3.38 119.74 114.07 2o4i s LYS 211 Ca -0.19 -2.12 -0.25 0.00 0.02 0.00 0.00 55.97 53.43 2o4i s LYS 211 Cb 0.03 -2.25 -0.20 0.00 -0.52 0.00 0.00 37.83 34.88 2o4i s LYS 211 CO 0.60 -1.21 1.20 -1.00 -0.92 0.00 0.00 175.35 174.02 2o4i h PRO 212 N 6.46 0.09 0.00 -1.68 0.13 -1.73 -0.27 132.00 134.99 2o4i h PRO 212 Ca 0.05 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 65.06 2o4i h PRO 212 Cb 0.91 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.04 2o4i h PRO 212 CO 0.48 0.64 -0.28 -0.56 -0.23 0.00 0.00 178.00 178.05 2o4i h GLN 213 N -0.46 0.00 -0.14 0.86 -0.00 -1.90 0.37 115.11 113.84 2o4i h GLN 213 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 58.65 58.49 2o4i h GLN 213 Cb 0.64 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 28.13 2o4i h GLN 213 CO 0.01 0.28 -0.56 0.00 -0.00 0.00 0.00 178.83 178.57 2o4i h ALA 214 N 1.72 0.25 -0.32 0.06 0.00 -1.96 -3.04 119.26 115.97 2o4i h ALA 214 Ca -0.00 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 54.36 2o4i h ALA 214 Cb 0.59 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2o4i h ALA 214 CO 0.04 0.47 0.09 1.25 0.00 0.00 0.00 179.25 181.10 2o4i h LEU 215 N 0.27 0.47 -0.38 0.00 7.12 -0.35 -2.81 115.31 119.63 2o4i h LEU 215 Ca -0.03 -0.21 0.07 0.00 0.13 0.00 0.00 57.88 57.84 2o4i h LEU 215 Cb 1.19 -0.12 -0.07 0.00 -0.53 0.00 0.00 40.66 41.13 2o4i h LEU 215 CO 0.12 0.56 -0.05 -0.07 -0.13 0.00 0.00 178.44 178.86 2o4i h LEU 216 N 0.36 -0.26 -1.34 2.25 3.38 -0.38 -1.07 115.31 118.24 2o4i h LEU 216 Ca 0.10 0.10 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 2o4i h LEU 216 Cb 0.26 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 2o4i h LEU 216 CO -0.00 -0.09 -0.25 -0.61 0.09 0.00 0.00 178.44 177.58 2o4i h GLN 217 N 0.04 0.12 -0.26 1.13 5.75 -1.48 -1.85 115.11 118.57 2o4i h GLN 217 Ca 0.18 -0.03 -0.16 0.00 -0.15 0.00 0.00 58.65 58.49 2o4i h GLN 217 Cb 0.27 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.81 2o4i h GLN 217 CO -0.35 0.37 -0.46 2.35 -2.65 0.00 0.00 178.83 178.09 2o4i h TRP 218 N 0.11 0.95 -0.67 3.99 7.01 -1.16 -3.16 115.95 123.02 2o4i h TRP 218 Ca 0.02 -0.34 0.01 0.00 2.11 0.00 0.00 58.89 60.69 2o4i h TRP 218 Cb 0.51 -0.18 -0.04 0.00 -2.10 0.00 0.00 29.16 27.35 2o4i h TRP 218 CO 0.00 1.13 0.44 0.28 -2.79 0.00 0.00 178.44 177.51 2o4i h VAL 219 N 0.50 1.15 -0.74 2.65 2.07 -0.71 -1.78 116.25 119.41 2o4i h VAL 219 Ca 0.02 -0.31 0.10 0.00 0.82 0.00 0.00 66.70 67.33 2o4i h VAL 219 Cb 1.06 0.18 -0.07 0.00 -1.52 0.00 0.00 31.29 30.94 2o4i h VAL 219 CO 0.10 0.16 0.38 0.44 0.02 0.00 0.00 177.57 178.67 2o4i h ASP 220 N 0.89 0.49 0.75 0.57 5.19 -1.36 0.38 116.42 123.33 2o4i h ASP 220 Ca 0.25 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.73 2o4i h ASP 220 Cb -0.08 -0.02 0.00 0.00 0.18 0.00 0.00 39.33 39.41 2o4i h ASP 220 CO -0.07 0.27 -0.47 -0.62 -3.12 0.00 0.00 179.24 175.23 2o4i n GLU 221 N -4.85 0.13 0.00 3.56 1.02 -1.04 -3.95 120.64 115.51 2o4i n GLU 221 Ca 0.12 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 2o4i n GLU 221 Cb 0.29 -1.59 0.00 0.00 -0.02 0.00 0.00 31.44 30.12 2o4i n GLU 221 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 2o4i n HIS 222 N -1.78 0.00 -2.61 -0.32 8.25 -0.70 -5.04 115.22 113.02 2o4i n HIS 222 Ca 0.05 -0.33 -0.41 0.00 -0.26 0.00 0.00 57.72 56.77 2o4i n HIS 222 Cb 0.38 -0.03 -0.04 0.00 1.12 0.00 0.00 29.99 31.42 2o4i n HIS 222 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2o4i s ALA 223 N -0.65 3.31 0.17 -1.41 0.00 0.13 -4.89 121.76 118.43 2o4i s ALA 223 Ca 0.00 0.70 0.07 0.00 0.00 0.00 0.00 51.96 52.73 2o4i s ALA 223 Cb 0.00 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 2o4i s ALA 223 CO 0.00 -0.15 -0.14 -0.98 0.00 0.00 0.00 175.76 174.49 2o4i s ARG 224 N -0.03 1.21 0.46 0.00 1.70 -0.96 -4.92 118.95 116.41 2o4i s ARG 224 Ca 0.49 -1.47 -0.24 0.00 -0.47 0.00 0.00 55.73 54.04 2o4i s ARG 224 Cb -0.26 -0.99 -0.07 0.00 -0.57 0.00 0.00 34.95 33.05 2o4i s ARG 224 CO 0.32 0.17 1.29 -2.14 -1.08 0.00 0.00 175.30 173.86 2o4i s PRO 225 N -3.40 3.66 0.43 3.89 0.02 -1.26 0.79 135.00 139.13 2o4i s PRO 225 Ca 0.18 2.10 0.17 0.00 0.02 0.00 0.00 61.00 63.46 2o4i s PRO 225 Cb -0.01 -2.52 0.95 0.00 0.02 0.00 0.00 34.50 32.94 2o4i s PRO 225 CO 0.05 -0.73 1.92 0.35 -0.33 0.00 0.00 177.00 178.26 2o4i h PHE 226 N 2.15 0.00 0.00 6.54 3.57 -1.60 -2.66 116.94 124.94 2o4i h PHE 226 Ca -0.50 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 60.98 2o4i h PHE 226 Cb 1.26 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 40.00 2o4i h PHE 226 CO 0.51 0.26 -0.08 0.66 -2.23 0.00 0.00 178.31 177.43 2o4i h SER 227 N 0.00 0.00 1.44 0.41 4.64 -1.79 -1.77 113.55 116.47 2o4i h SER 227 Ca -0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 2o4i h SER 227 Cb 0.50 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2o4i h SER 227 CO 0.03 0.08 -0.07 0.71 -0.87 0.00 0.00 176.83 176.71 2o4i h THR 228 N 0.00 0.15 -2.77 2.95 1.35 -1.85 -3.44 112.91 109.30 2o4i h THR 228 Ca -0.00 -0.94 -0.57 0.00 -0.55 0.00 0.00 66.41 64.35 2o4i h THR 228 Cb 0.25 1.82 -0.03 0.00 -1.73 0.00 0.00 68.15 68.47 2o4i h THR 228 CO 0.01 0.07 1.13 -0.69 -0.25 0.00 0.00 175.52 175.80 2o4i s VAL 229 N -3.42 3.69 0.45 6.82 1.01 -0.67 -4.98 120.40 123.30 2o4i s VAL 229 Ca 0.04 0.77 -0.23 0.00 0.00 0.00 0.00 61.98 62.56 2o4i s VAL 229 Cb 0.07 -3.71 -0.08 0.00 0.00 0.00 0.00 36.38 32.67 2o4i s VAL 229 CO 0.62 -0.30 1.12 -0.54 0.00 0.00 0.00 175.10 176.00 2o4i s LYS 230 N 4.72 3.83 0.93 2.72 1.02 -1.26 -4.90 119.74 126.80 2o4i s LYS 230 Ca 0.72 1.66 -0.12 0.00 0.02 0.00 0.00 55.97 58.25 2o4i s LYS 230 Cb -0.25 -2.39 0.15 0.00 -0.52 0.00 0.00 37.83 34.82 2o4i s LYS 230 CO 0.29 -0.46 1.12 -1.25 -0.92 0.00 0.00 175.35 174.13 2o4i s PRO 231 N -2.73 1.00 0.04 -1.68 0.04 -1.26 -4.31 135.00 126.10 2o4i s PRO 231 Ca 0.63 0.38 -0.16 0.00 0.04 0.00 0.00 61.00 61.89 2o4i s PRO 231 Cb -0.26 -1.81 -0.28 0.00 0.04 0.00 0.00 34.50 32.19 2o4i s PRO 231 CO 0.31 -2.31 1.10 1.98 0.04 0.00 0.00 177.00 178.12 2o4i h MET 232 N -1.58 0.59 -3.54 4.56 4.05 -1.64 -3.48 114.93 113.89 2o4i h MET 232 Ca -0.51 -0.76 -0.09 0.00 -0.28 0.00 0.00 59.70 58.06 2o4i h MET 232 Cb 1.33 0.25 -0.06 0.00 -0.80 0.00 0.00 31.60 32.31 2o4i h MET 232 CO 0.60 1.33 0.00 0.71 0.23 0.00 0.00 176.91 179.79 2o4i s TYR 233 N -3.02 0.42 0.00 1.39 2.02 -1.26 -5.07 117.35 111.84 2o4i s TYR 233 Ca -0.10 -0.84 0.00 0.00 -0.37 0.00 0.00 57.07 55.76 2o4i s TYR 233 Cb 0.05 0.34 0.00 0.00 -0.40 0.00 0.00 41.96 41.95 2o4i s TYR 233 CO 0.91 -1.20 0.00 0.41 -1.57 0.00 0.00 175.55 174.10