#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s1p s VAL 8 N -2.87 2.39 -0.08 0.00 0.11 -0.10 -4.88 120.40 114.96 1s1p s VAL 8 Ca 0.33 -1.30 -0.27 0.00 -2.93 0.00 0.00 61.98 57.80 1s1p s VAL 8 Cb 0.06 -1.96 -0.02 0.00 -1.53 0.00 0.00 36.38 32.93 1s1p s VAL 8 CO 0.15 0.36 0.88 -0.75 -3.33 0.00 0.00 175.10 172.42 1s1p s LYS 9 N -1.29 4.44 0.65 1.54 2.20 -1.26 -1.05 119.74 124.96 1s1p s LYS 9 Ca 0.13 1.18 -0.09 0.00 -0.36 0.00 0.00 55.97 56.83 1s1p s LYS 9 Cb -0.10 -3.50 0.01 0.00 -1.51 0.00 0.00 37.83 32.73 1s1p s LYS 9 CO 0.03 -0.15 1.00 -0.51 -0.36 0.00 0.00 175.35 175.36 1s1p s LEU 10 N 1.45 3.07 0.00 5.43 1.43 0.99 -4.96 118.68 126.10 1s1p s LEU 10 Ca 0.44 0.93 0.21 0.00 -1.03 0.00 0.00 54.13 54.68 1s1p s LEU 10 Cb -0.18 -3.74 1.22 0.00 0.03 0.00 0.00 46.19 43.52 1s1p s LEU 10 CO 0.20 -1.19 1.65 -0.46 0.23 0.00 0.00 176.35 176.78 1s1p n ASN 11 N -2.79 0.00 -0.74 2.29 0.23 -1.26 -1.43 115.26 111.56 1s1p n ASN 11 Ca 0.06 -0.52 0.07 0.00 -0.53 0.00 0.00 54.58 53.65 1s1p n ASN 11 Cb 0.57 -0.06 0.17 0.00 -2.08 0.00 0.00 39.78 38.38 1s1p n ASN 11 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1s1p n ASP 12 N -1.06 3.00 0.00 0.53 5.75 -1.26 -4.98 116.55 118.52 1s1p n ASP 12 Ca 0.15 -1.95 0.00 0.00 -0.01 0.00 0.00 54.79 52.98 1s1p n ASP 12 Cb 0.09 -0.25 0.00 0.00 -1.03 0.00 0.00 41.12 39.94 1s1p n ASP 12 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1s1p n GLY 13 N 0.72 1.40 3.91 6.12 0.00 -0.52 -5.06 105.19 111.75 1s1p n GLY 13 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 1s1p n GLY 13 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1s1p s HIS 14 N -2.34 2.98 -0.04 1.61 3.76 -1.26 -4.79 115.29 115.21 1s1p s HIS 14 Ca 0.00 0.70 0.06 0.00 -0.15 0.00 0.00 55.06 55.66 1s1p s HIS 14 Cb 0.00 -3.38 -0.01 0.00 1.11 0.00 0.00 32.58 30.30 1s1p s HIS 14 CO 0.00 -1.63 -0.22 -0.06 -0.85 0.00 0.00 174.74 171.99 1s1p s PHE 15 N -3.47 2.08 -0.15 1.40 0.08 -1.26 -0.01 117.98 116.65 1s1p s PHE 15 Ca 0.61 -0.55 0.02 0.00 0.12 0.00 0.00 56.93 57.13 1s1p s PHE 15 Cb -0.11 -1.37 0.01 0.00 -0.57 0.00 0.00 43.02 40.99 1s1p s PHE 15 CO 0.48 -0.15 -0.21 1.41 -0.10 0.00 0.00 175.22 176.65 1s1p s MET 16 N -0.20 3.03 0.36 0.44 -2.45 -0.21 -4.93 119.30 115.33 1s1p s MET 16 Ca -0.00 -0.84 -0.28 0.00 -1.25 0.00 0.00 55.69 53.31 1s1p s MET 16 Cb -0.12 -2.47 -0.11 0.00 1.25 0.00 0.00 34.83 33.39 1s1p s MET 16 CO 0.02 -0.04 1.44 -2.14 1.05 0.00 0.00 175.02 175.35 1s1p s PRO 17 N 0.88 4.19 0.18 4.11 0.02 -1.26 -0.93 135.00 142.18 1s1p s PRO 17 Ca -0.05 2.46 0.26 0.00 0.02 0.00 0.00 61.00 63.69 1s1p s PRO 17 Cb -0.15 -3.00 0.90 0.00 0.02 0.00 0.00 34.50 32.26 1s1p s PRO 17 CO -0.03 -0.43 1.78 1.33 -0.33 0.00 0.00 177.00 179.32 1s1p n VAL 18 N 0.67 0.54 -4.56 3.83 0.24 -0.40 -4.56 118.33 114.09 1s1p n VAL 18 Ca 0.01 -0.15 -0.33 0.00 -2.04 0.00 0.00 64.34 61.83 1s1p n VAL 18 Cb 0.40 -0.67 -0.15 0.00 -1.47 0.00 0.00 33.84 31.95 1s1p n VAL 18 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1s1p s LEU 19 N -4.23 2.61 0.15 1.34 2.96 -1.26 -1.13 118.68 119.13 1s1p s LEU 19 Ca 0.10 -0.41 0.09 0.00 -0.22 0.00 0.00 54.13 53.70 1s1p s LEU 19 Cb 0.13 -1.60 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 1s1p s LEU 19 CO 0.55 0.10 -0.22 -0.83 -1.32 0.00 0.00 176.35 174.63 1s1p s GLY 20 N 0.70 1.45 -0.24 7.98 0.00 0.04 -4.22 107.32 113.04 1s1p s GLY 20 Ca -0.06 -1.45 -0.16 0.00 0.00 0.00 0.00 44.72 43.04 1s1p s GLY 20 CO 0.02 -1.47 0.44 -0.12 0.00 0.00 0.00 173.10 171.96 1s1p s PHE 21 N -1.56 3.31 -0.10 1.90 2.19 0.71 -1.01 117.98 123.42 1s1p s PHE 21 Ca 0.14 0.59 -0.25 0.00 0.33 0.00 0.00 56.93 57.73 1s1p s PHE 21 Cb -0.08 -2.61 -0.03 0.00 -1.31 0.00 0.00 43.02 39.00 1s1p s PHE 21 CO 0.07 -0.15 0.81 0.20 1.83 0.00 0.00 175.22 177.97 1s1p s GLY 22 N 1.35 2.44 0.00 13.12 0.00 -0.56 -0.90 107.32 122.77 1s1p s GLY 22 Ca 0.19 0.16 0.18 0.00 0.00 0.00 0.00 44.72 45.25 1s1p s GLY 22 CO 0.09 1.49 0.93 -1.30 0.00 0.00 0.00 173.10 174.31 1s1p n THR 23 N 4.23 0.00 -2.21 0.90 -2.24 -1.01 -4.20 114.28 109.75 1s1p n THR 23 Ca 0.03 -0.32 -0.42 0.00 -2.27 0.00 0.00 64.05 61.07 1s1p n THR 23 Cb 0.50 1.22 -0.03 0.00 -2.10 0.00 0.00 70.33 69.92 1s1p n THR 23 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1s1p s TYR 24 N -2.05 3.26 0.02 4.78 5.04 -1.26 -4.99 117.35 122.13 1s1p s TYR 24 Ca 0.15 1.15 0.02 0.00 -2.44 0.00 0.00 57.07 55.95 1s1p s TYR 24 Cb 0.14 -3.62 -0.01 0.00 0.35 0.00 0.00 41.96 38.82 1s1p s TYR 24 CO 0.45 -2.01 -0.07 0.00 -1.34 0.00 0.00 175.55 172.57 1s1p s ALA 25 N 0.43 0.60 0.89 3.97 0.00 -1.26 -4.99 121.76 121.39 1s1p s ALA 25 Ca 0.59 -0.49 -0.11 0.00 0.00 0.00 0.00 51.96 51.96 1s1p s ALA 25 Cb -0.36 -0.08 0.13 0.00 0.00 0.00 0.00 23.12 22.81 1s1p s ALA 25 CO 0.36 0.09 1.11 -1.25 0.00 0.00 0.00 175.76 176.07 1s1p s PRO 26 N -0.72 1.27 0.66 0.00 0.04 -1.26 -4.86 135.00 130.13 1s1p s PRO 26 Ca -0.02 1.30 0.42 0.00 0.04 0.00 0.00 61.00 62.74 1s1p s PRO 26 Cb -0.05 -1.77 2.26 0.00 0.04 0.00 0.00 34.50 34.97 1s1p s PRO 26 CO 0.00 -2.37 2.27 -1.35 0.04 0.00 0.00 177.00 175.59 1s1p h PRO 27 N -1.67 0.00 0.00 0.56 0.11 -2.01 -0.87 132.00 128.12 1s1p h PRO 27 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1s1p h PRO 27 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1s1p h PRO 27 CO 0.47 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.65 1s1p n GLU 28 N -3.01 0.06 -3.18 1.05 4.71 -1.26 -4.64 120.64 114.37 1s1p n GLU 28 Ca -0.03 0.23 -0.39 0.00 -0.01 0.00 0.00 57.16 56.96 1s1p n GLU 28 Cb 0.12 -1.60 -0.06 0.00 -1.01 0.00 0.00 31.44 28.89 1s1p n GLU 28 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 1s1p s VAL 29 N -3.07 5.09 0.36 2.62 1.01 -0.33 -5.03 120.40 121.04 1s1p s VAL 29 Ca 0.08 1.11 -0.27 0.00 0.00 0.00 0.00 61.98 62.91 1s1p s VAL 29 Cb 0.12 -3.90 -0.12 0.00 0.00 0.00 0.00 36.38 32.47 1s1p s VAL 29 CO 0.38 0.20 1.15 -2.65 0.00 0.00 0.00 175.10 174.17 1s1p n PRO 30 N 4.47 1.71 0.13 2.72 -0.02 -1.26 -4.86 135.00 137.89 1s1p n PRO 30 Ca -0.03 0.61 0.07 0.00 -2.02 0.00 0.00 63.50 62.12 1s1p n PRO 30 Cb 0.51 -2.14 0.54 0.00 -0.02 0.00 0.00 33.50 32.39 1s1p n PRO 30 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s1p h ARG 31 N 2.09 0.25 0.00 -0.52 2.47 -1.94 -1.96 114.38 114.77 1s1p h ARG 31 Ca -0.44 -0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 58.26 1s1p h ARG 31 Cb 1.31 -0.06 -0.00 0.00 -1.65 0.00 0.00 29.97 29.58 1s1p h ARG 31 CO 0.60 0.16 -0.04 0.66 0.56 0.00 0.00 179.97 181.92 1s1p h SER 32 N 0.26 0.00 -0.48 7.04 4.64 -1.99 -3.01 113.55 120.00 1s1p h SER 32 Ca 0.08 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.37 1s1p h SER 32 Cb 0.02 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.08 1s1p h SER 32 CO -0.02 0.04 0.19 0.50 -0.87 0.00 0.00 176.83 176.67 1s1p h LYS 33 N 0.00 0.78 -0.50 4.77 1.63 -1.71 -2.42 116.57 119.13 1s1p h LYS 33 Ca -0.00 -0.13 0.03 0.00 -0.85 0.00 0.00 60.65 59.70 1s1p h LYS 33 Cb 0.16 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.63 1s1p h LYS 33 CO 0.00 0.67 0.33 0.00 -3.45 0.00 0.00 179.45 177.00 1s1p h ALA 34 N 1.44 1.77 0.10 5.00 0.00 -1.73 -0.99 119.26 124.85 1s1p h ALA 34 Ca 0.18 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1s1p h ALA 34 Cb 0.20 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1s1p h ALA 34 CO -0.01 0.17 -0.05 1.25 0.00 0.00 0.00 179.25 180.62 1s1p h LEU 35 N 0.56 -0.11 -0.01 0.00 5.85 -1.61 -1.69 115.31 118.30 1s1p h LEU 35 Ca 0.20 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1s1p h LEU 35 Cb 0.11 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.16 1s1p h LEU 35 CO -0.05 0.09 -0.01 -0.08 -0.34 0.00 0.00 178.44 178.05 1s1p h GLU 36 N -0.30 -0.01 -0.02 1.25 4.81 -1.33 -2.59 114.58 116.38 1s1p h GLU 36 Ca -0.01 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.07 1s1p h GLU 36 Cb 0.25 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1s1p h GLU 36 CO 0.02 -0.01 -0.67 -0.39 -0.73 0.00 0.00 179.01 177.23 1s1p h VAL 37 N -0.01 1.45 -0.40 0.32 -1.51 -1.24 -1.97 116.25 112.89 1s1p h VAL 37 Ca 0.01 -2.23 -0.13 0.00 -1.23 0.00 0.00 66.70 63.12 1s1p h VAL 37 Cb 0.02 2.19 -0.01 0.00 -2.13 0.00 0.00 31.29 31.37 1s1p h VAL 37 CO -0.02 0.65 -0.25 0.74 -1.23 0.00 0.00 177.57 177.45 1s1p h THR 38 N 0.06 1.27 -0.56 7.19 2.02 -1.25 0.80 112.91 122.43 1s1p h THR 38 Ca -0.01 -1.39 -0.02 0.00 0.77 0.00 0.00 66.41 65.76 1s1p h THR 38 Cb 1.19 1.23 -0.03 0.00 -1.74 0.00 0.00 68.15 68.81 1s1p h THR 38 CO 0.09 0.47 0.28 0.11 0.37 0.00 0.00 175.52 176.84 1s1p h LYS 39 N 0.72 0.81 -0.87 6.66 1.57 -1.28 -1.38 116.57 122.80 1s1p h LYS 39 Ca 0.09 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 1s1p h LYS 39 Cb 0.79 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.91 1s1p h LYS 39 CO 0.07 0.65 0.51 -0.07 -0.57 0.00 0.00 179.45 180.04 1s1p h LEU 40 N 0.76 1.05 -0.35 2.94 3.38 -1.01 -0.30 115.31 121.78 1s1p h LEU 40 Ca 0.19 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1s1p h LEU 40 Cb 0.11 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1s1p h LEU 40 CO -0.03 0.82 0.20 0.00 0.09 0.00 0.00 178.44 179.52 1s1p h ALA 41 N 1.28 0.45 -0.57 1.53 0.00 -0.50 0.19 119.26 121.64 1s1p h ALA 41 Ca 0.31 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1s1p h ALA 41 Cb -0.03 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1s1p h ALA 41 CO -0.06 -0.02 0.28 0.82 0.00 0.00 0.00 179.25 180.28 1s1p h ILE 42 N 0.45 1.20 -0.76 0.00 2.04 -0.95 -0.48 117.51 119.01 1s1p h ILE 42 Ca 0.12 -0.55 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1s1p h ILE 42 Cb 0.05 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 1s1p h ILE 42 CO -0.02 0.23 0.49 -0.33 0.00 0.00 0.00 178.15 178.52 1s1p h GLU 43 N 0.77 1.01 0.00 2.37 5.08 -0.71 -1.84 114.58 121.26 1s1p h GLU 43 Ca 0.20 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1s1p h GLU 43 Cb 0.10 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.13 1s1p h GLU 43 CO -0.03 0.68 0.00 0.00 -1.00 0.00 0.00 179.01 178.66 1s1p h ALA 44 N 1.51 1.00 0.00 3.43 0.00 -0.44 -3.47 119.26 121.29 1s1p h ALA 44 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1s1p h ALA 44 Cb -0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1s1p h ALA 44 CO -0.06 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.60 1s1p n GLY 45 N 0.29 1.03 3.77 0.00 0.00 -0.69 -4.92 105.19 104.66 1s1p n GLY 45 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1s1p n GLY 45 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1s1p s PHE 46 N -1.71 3.08 0.00 1.61 0.08 -0.25 -4.90 117.98 115.89 1s1p s PHE 46 Ca 0.00 1.38 0.00 0.00 0.12 0.00 0.00 56.93 58.43 1s1p s PHE 46 Cb 0.00 -3.67 0.00 0.00 -0.57 0.00 0.00 43.02 38.78 1s1p s PHE 46 CO 0.00 -1.88 0.00 0.54 -0.10 0.00 0.00 175.22 173.78 1s1p n ARG 47 N 1.04 3.01 -3.09 0.44 5.12 -1.26 -4.17 116.66 117.75 1s1p n ARG 47 Ca 0.01 0.00 -0.40 0.00 -1.93 0.00 0.00 57.85 55.52 1s1p n ARG 47 Cb 0.42 -0.89 -0.06 0.00 -1.16 0.00 0.00 32.46 30.77 1s1p n ARG 47 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1s1p s HIS 48 N -1.78 3.35 -0.12 -1.55 2.46 -1.26 -0.85 115.29 115.55 1s1p s HIS 48 Ca 0.00 0.94 0.01 0.00 0.47 0.00 0.00 55.06 56.48 1s1p s HIS 48 Cb 0.00 -2.84 0.02 0.00 -0.13 0.00 0.00 32.58 29.63 1s1p s HIS 48 CO 0.00 -0.23 -0.14 0.42 -2.47 0.00 0.00 174.74 172.33 1s1p s ILE 49 N 2.12 1.42 -0.28 0.89 1.01 0.18 -0.21 121.20 126.33 1s1p s ILE 49 Ca 0.29 -0.58 -0.07 0.00 0.00 0.00 0.00 60.65 60.29 1s1p s ILE 49 Cb -0.16 -1.33 -0.00 0.00 0.01 0.00 0.00 42.46 40.98 1s1p s ILE 49 CO 0.10 0.43 0.08 -0.62 0.00 0.00 0.00 174.94 174.93 1s1p s ASP 50 N 1.17 5.15 0.00 3.58 2.15 -0.08 -1.31 116.67 127.34 1s1p s ASP 50 Ca -0.03 -0.55 0.00 0.00 0.43 0.00 0.00 52.55 52.40 1s1p s ASP 50 Cb -0.14 -1.90 0.00 0.00 -0.30 0.00 0.00 42.92 40.58 1s1p s ASP 50 CO -0.04 -0.15 0.00 -0.24 -0.17 0.00 0.00 175.17 174.57 1s1p n SER 51 N 4.89 0.91 -3.63 -0.34 2.88 -0.13 -2.40 113.62 115.82 1s1p n SER 51 Ca -0.15 -0.73 -0.03 0.00 -1.33 0.00 0.00 58.87 56.62 1s1p n SER 51 Cb 0.49 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.91 1s1p n SER 51 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1s1p s ALA 52 N -2.00 -2.10 0.25 -1.46 0.00 -1.26 -3.92 121.76 111.27 1s1p s ALA 52 Ca 0.00 1.81 -0.04 0.00 0.00 0.00 0.00 51.96 53.73 1s1p s ALA 52 Cb 0.00 -1.00 0.42 0.00 0.00 0.00 0.00 23.12 22.54 1s1p s ALA 52 CO 0.00 -0.36 1.81 1.25 0.00 0.00 0.00 175.76 178.46 1s1p h HIS 53 N 2.10 0.88 -0.17 0.00 -0.00 -1.92 -2.22 115.15 113.82 1s1p h HIS 53 Ca -0.09 0.03 0.05 0.00 -0.00 0.00 0.00 60.37 60.36 1s1p h HIS 53 Cb 1.17 -0.27 -0.01 0.00 -0.00 0.00 0.00 27.41 28.30 1s1p h HIS 53 CO 0.24 0.35 0.16 1.25 -0.00 0.00 0.00 177.93 179.93 1s1p h LEU 54 N 0.81 0.00 -0.17 0.26 5.85 -1.96 -2.78 115.31 117.32 1s1p h LEU 54 Ca 0.41 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.13 1s1p h LEU 54 Cb 0.39 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.42 1s1p h LEU 54 CO -0.25 0.00 0.00 -1.22 -0.34 0.00 0.00 178.44 176.63 1s1p n TYR 55 N -4.00 0.50 -3.86 1.25 0.53 -0.83 -4.89 117.16 105.85 1s1p n TYR 55 Ca 0.01 0.17 -0.28 0.00 -1.02 0.00 0.00 57.90 56.78 1s1p n TYR 55 Cb 0.28 -0.77 0.03 0.00 -1.03 0.00 0.00 39.34 37.85 1s1p n TYR 55 CO 0.00 0.00 0.00 -1.71 -1.02 0.00 0.00 176.86 174.13 1s1p n ASN 56 N -1.93 -3.60 0.00 7.72 4.05 -1.05 -4.83 115.26 115.63 1s1p n ASN 56 Ca 0.05 -0.80 0.00 0.00 0.45 0.00 0.00 54.58 54.27 1s1p n ASN 56 Cb 0.31 -3.88 0.00 0.00 1.23 0.00 0.00 39.78 37.44 1s1p n ASN 56 CO 0.00 0.00 0.00 -0.46 -3.05 0.00 0.00 177.26 173.75 1s1p n ASN 57 N -2.90 0.00 0.07 1.20 0.23 -1.26 -4.92 115.26 107.68 1s1p n ASN 57 Ca -0.07 -1.00 0.03 0.00 -0.53 0.00 0.00 54.58 53.01 1s1p n ASN 57 Cb 0.57 0.00 0.41 0.00 -2.08 0.00 0.00 39.78 38.68 1s1p n ASN 57 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1s1p h GLU 58 N 0.00 0.37 -0.65 -3.83 5.08 -1.88 0.10 114.58 113.76 1s1p h GLU 58 Ca 0.00 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1s1p h GLU 58 Cb 0.65 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 1s1p h GLU 58 CO 0.00 0.36 0.11 1.05 -1.00 0.00 0.00 179.01 179.53 1s1p h GLU 59 N 0.36 1.06 0.04 2.33 9.09 -1.92 0.13 114.58 125.67 1s1p h GLU 59 Ca 0.09 -0.27 -0.20 0.00 0.05 0.00 0.00 59.36 59.03 1s1p h GLU 59 Cb 0.18 -0.13 0.02 0.00 -1.65 0.00 0.00 28.75 27.17 1s1p h GLU 59 CO -0.00 0.97 -0.79 1.96 0.05 0.00 0.00 179.01 181.20 1s1p h GLN 60 N 0.99 0.47 -0.52 1.06 1.08 -1.60 -1.83 115.11 114.75 1s1p h GLN 60 Ca 0.20 -0.55 -0.05 0.00 -1.45 0.00 0.00 58.65 56.80 1s1p h GLN 60 Cb 0.42 0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 28.00 1s1p h GLN 60 CO 0.01 1.20 0.15 0.28 -0.95 0.00 0.00 178.83 179.52 1s1p h VAL 61 N -0.02 1.24 -0.83 -0.54 2.07 -1.00 -1.56 116.25 115.61 1s1p h VAL 61 Ca -0.11 -0.81 -0.02 0.00 0.82 0.00 0.00 66.70 66.57 1s1p h VAL 61 Cb 1.51 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 32.01 1s1p h VAL 61 CO 0.15 0.30 0.43 1.23 0.02 0.00 0.00 177.57 179.70 1s1p h GLY 62 N 0.72 1.25 1.11 2.17 0.00 -0.79 -2.01 103.07 105.52 1s1p h GLY 62 Ca 0.17 -0.59 -0.04 0.00 0.00 0.00 0.00 47.33 46.86 1s1p h GLY 62 CO -0.00 0.57 0.30 -2.00 0.00 0.00 0.00 176.54 175.41 1s1p h LEU 63 N 1.16 1.05 -0.44 3.11 5.85 -1.06 -0.72 115.31 124.25 1s1p h LEU 63 Ca 0.29 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1s1p h LEU 63 Cb 0.07 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.81 1s1p h LEU 63 CO -0.04 0.93 0.29 0.00 -0.34 0.00 0.00 178.44 179.28 1s1p h ALA 64 N 1.22 0.56 -0.15 1.25 0.00 -0.84 0.82 119.26 122.12 1s1p h ALA 64 Ca 0.26 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1s1p h ALA 64 Cb 0.21 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1s1p h ALA 64 CO -0.02 0.01 0.08 0.82 0.00 0.00 0.00 179.25 180.13 1s1p h ILE 65 N 0.59 1.11 -0.80 0.00 2.04 -1.03 -1.63 117.51 117.79 1s1p h ILE 65 Ca 0.16 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1s1p h ILE 65 Cb -0.07 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.02 1s1p h ILE 65 CO -0.04 0.10 0.49 0.03 0.00 0.00 0.00 178.15 178.74 1s1p h ARG 66 N 0.13 1.08 -0.62 2.37 -0.00 -0.91 -1.36 114.38 115.06 1s1p h ARG 66 Ca 0.05 -0.09 -0.05 0.00 -0.50 0.00 0.00 59.98 59.39 1s1p h ARG 66 Cb 0.09 -0.23 -0.03 0.00 0.00 0.00 0.00 29.97 29.81 1s1p h ARG 66 CO -0.01 0.74 0.18 1.03 0.00 0.00 0.00 179.97 181.91 1s1p h SER 67 N 1.10 0.92 1.43 7.04 0.87 -0.56 0.28 113.55 124.62 1s1p h SER 67 Ca 0.29 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1s1p h SER 67 Cb -0.06 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 61.65 1s1p h SER 67 CO -0.06 0.89 0.00 0.11 -0.53 0.00 0.00 176.83 177.25 1s1p h LYS 68 N 0.90 0.00 0.22 2.24 1.79 -0.84 -1.96 116.57 118.92 1s1p h LYS 68 Ca 0.20 0.00 -0.33 0.00 -2.18 0.00 0.00 60.65 58.34 1s1p h LYS 68 Cb 0.32 0.00 0.03 0.00 -1.58 0.00 0.00 32.23 30.99 1s1p h LYS 68 CO -0.00 0.00 -1.47 0.82 -1.08 0.00 0.00 179.45 177.72 1s1p h ILE 69 N 0.00 1.28 -0.33 1.86 2.04 -0.91 -1.64 117.51 119.81 1s1p h ILE 69 Ca 0.00 -2.75 -0.08 0.00 1.00 0.00 0.00 64.86 63.02 1s1p h ILE 69 Cb 0.71 2.99 -0.02 0.00 -0.74 0.00 0.00 36.82 39.77 1s1p h ILE 69 CO 0.00 0.83 -0.14 0.00 0.00 0.00 0.00 178.15 178.85 1s1p h ALA 70 N 0.24 1.15 -0.20 1.87 0.00 -0.67 -2.53 119.26 119.12 1s1p h ALA 70 Ca -0.24 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1s1p h ALA 70 Cb 2.13 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.77 1s1p h ALA 70 CO 0.25 0.54 0.00 -0.40 0.00 0.00 0.00 179.25 179.64 1s1p n ASP 71 N -4.18 1.58 0.00 0.00 5.68 -0.76 -4.92 116.55 113.95 1s1p n ASP 71 Ca 0.01 -1.76 0.00 0.00 -0.50 0.00 0.00 54.79 52.53 1s1p n ASP 71 Cb 0.35 -0.13 0.00 0.00 -1.14 0.00 0.00 41.12 40.20 1s1p n ASP 71 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1s1p n GLY 72 N 1.08 0.67 0.28 6.12 0.00 -0.95 -4.93 105.19 107.46 1s1p n GLY 72 Ca 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 1s1p n GLY 72 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1s1p h SER 73 N 0.00 0.95 -5.31 1.61 0.02 -1.56 -3.46 113.55 105.80 1s1p h SER 73 Ca 0.00 -0.30 -0.13 0.00 -0.84 0.00 0.00 61.79 60.52 1s1p h SER 73 Cb 0.00 -0.26 -0.14 0.00 0.14 0.00 0.00 62.40 62.15 1s1p h SER 73 CO 0.00 1.02 -0.46 0.68 -1.14 0.00 0.00 176.83 176.93 1s1p s VAL 74 N -5.04 0.09 0.25 2.27 -7.23 -0.86 -5.03 120.40 104.85 1s1p s VAL 74 Ca -0.12 -1.58 0.08 0.00 -1.81 0.00 0.00 61.98 58.54 1s1p s VAL 74 Cb 0.13 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 35.16 1s1p s VAL 74 CO 0.84 -0.41 0.15 -0.54 -0.31 0.00 0.00 175.10 174.82 1s1p s LYS 75 N -3.99 2.79 0.28 4.82 1.02 -1.26 -4.06 119.74 119.34 1s1p s LYS 75 Ca 0.18 -1.13 0.01 0.00 0.02 0.00 0.00 55.97 55.06 1s1p s LYS 75 Cb 0.05 -2.48 0.57 0.00 -0.52 0.00 0.00 37.83 35.45 1s1p s LYS 75 CO -0.01 0.40 1.81 -0.09 -0.92 0.00 0.00 175.35 176.54 1s1p h ARG 76 N 1.61 0.86 0.00 1.68 9.65 -1.96 -0.12 114.38 126.10 1s1p h ARG 76 Ca -0.48 -0.05 0.00 0.00 -1.10 0.00 0.00 59.98 58.35 1s1p h ARG 76 Cb 1.24 -0.19 0.00 0.00 -1.39 0.00 0.00 29.97 29.63 1s1p h ARG 76 CO 0.61 0.57 0.00 1.05 2.80 0.00 0.00 179.97 184.99 1s1p h GLU 77 N 0.88 0.00 0.00 0.20 9.09 -2.04 -1.99 114.58 120.73 1s1p h GLU 77 Ca 0.50 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.91 1s1p h GLU 77 Cb 0.58 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.68 1s1p h GLU 77 CO -0.30 0.00 -0.36 -0.44 0.05 0.00 0.00 179.01 177.96 1s1p h ASP 78 N 0.00 0.00 -2.85 3.06 3.32 -1.41 -3.45 116.42 115.09 1s1p h ASP 78 Ca 0.00 -0.08 -0.65 0.00 0.02 0.00 0.00 57.03 56.32 1s1p h ASP 78 Cb 0.23 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.70 1s1p h ASP 78 CO 0.00 0.04 -0.47 -0.63 -1.72 0.00 0.00 179.24 176.46 1s1p s ILE 79 N -3.18 5.46 -0.40 0.35 -1.09 -0.75 -4.83 121.20 116.77 1s1p s ILE 79 Ca 0.07 0.23 -0.04 0.00 -2.23 0.00 0.00 60.65 58.68 1s1p s ILE 79 Cb 0.11 -3.44 0.09 0.00 -1.58 0.00 0.00 42.46 37.65 1s1p s ILE 79 CO 0.68 0.56 0.19 0.12 -1.23 0.00 0.00 174.94 175.26 1s1p s PHE 80 N -0.60 3.48 -0.19 3.97 5.36 -0.03 -4.93 117.98 125.04 1s1p s PHE 80 Ca 0.13 -2.12 -0.07 0.00 -0.96 0.00 0.00 56.93 53.92 1s1p s PHE 80 Cb -0.12 -3.02 -0.03 0.00 -0.34 0.00 0.00 43.02 39.51 1s1p s PHE 80 CO 0.03 -0.92 0.04 -0.47 -1.46 0.00 0.00 175.22 172.43 1s1p s TYR 81 N 1.23 3.15 -0.11 10.12 5.04 -1.26 -0.64 117.35 134.88 1s1p s TYR 81 Ca 0.05 -0.14 -0.01 0.00 -2.44 0.00 0.00 57.07 54.53 1s1p s TYR 81 Cb -0.23 -2.10 -0.03 0.00 0.35 0.00 0.00 41.96 39.96 1s1p s TYR 81 CO -0.02 -0.03 -0.07 0.99 -1.34 0.00 0.00 175.55 175.08 1s1p s THR 82 N 0.71 3.64 0.42 4.34 2.01 -0.43 -0.54 115.64 125.79 1s1p s THR 82 Ca 0.02 -0.48 0.03 0.00 0.31 0.00 0.00 61.69 61.58 1s1p s THR 82 Cb -0.14 -2.53 -0.04 0.00 0.01 0.00 0.00 72.50 69.81 1s1p s THR 82 CO 0.02 0.55 0.06 -0.55 -0.69 0.00 0.00 174.62 174.01 1s1p s SER 83 N -0.20 3.19 -0.03 3.53 0.15 -0.50 -0.95 113.70 118.88 1s1p s SER 83 Ca 0.03 -1.56 -0.03 0.00 0.70 0.00 0.00 55.95 55.08 1s1p s SER 83 Cb -0.13 0.26 0.01 0.00 -1.71 0.00 0.00 66.02 64.45 1s1p s SER 83 CO 0.03 -0.77 0.09 -0.54 1.20 0.00 0.00 173.24 173.24 1s1p s LYS 84 N -3.80 0.13 -0.21 5.44 1.02 -1.25 -1.76 119.74 119.30 1s1p s LYS 84 Ca 0.23 0.08 -0.29 0.00 0.02 0.00 0.00 55.97 56.01 1s1p s LYS 84 Cb 0.05 0.06 -0.01 0.00 -0.52 0.00 0.00 37.83 37.41 1s1p s LYS 84 CO 0.12 -0.02 1.25 -1.17 -0.92 0.00 0.00 175.35 174.61 1s1p s LEU 85 N -0.06 4.08 0.65 3.17 2.96 0.91 -3.03 118.68 127.37 1s1p s LEU 85 Ca -0.01 1.51 -0.12 0.00 -0.22 0.00 0.00 54.13 55.28 1s1p s LEU 85 Cb -0.01 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.12 1s1p s LEU 85 CO 0.00 -0.85 1.05 0.86 -1.32 0.00 0.00 176.35 176.09 1s1p s TRP 86 N 3.73 3.20 -0.49 5.38 -0.00 -1.26 -1.94 118.94 127.55 1s1p s TRP 86 Ca 0.54 1.42 0.23 0.00 -0.00 0.00 0.00 56.10 58.29 1s1p s TRP 86 Cb -0.19 -2.87 0.97 0.00 -0.00 0.00 0.00 33.47 31.37 1s1p s TRP 86 CO 0.16 -1.05 1.70 0.43 -0.00 0.00 0.00 176.95 178.18 1s1p n SER 87 N -2.73 0.64 -0.18 5.86 7.64 -1.26 -1.23 113.62 122.37 1s1p n SER 87 Ca 0.07 0.66 0.15 0.00 1.01 0.00 0.00 58.87 60.76 1s1p n SER 87 Cb 0.53 -0.80 0.77 0.00 -1.01 0.00 0.00 64.21 63.71 1s1p n SER 87 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1s1p n THR 88 N -2.21 0.01 -1.32 0.44 -2.24 -1.26 -1.04 114.28 106.65 1s1p n THR 88 Ca 0.02 -0.09 0.08 0.00 -2.27 0.00 0.00 64.05 61.78 1s1p n THR 88 Cb 0.22 -0.13 0.18 0.00 -2.10 0.00 0.00 70.33 68.50 1s1p n THR 88 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1s1p n PHE 89 N -0.56 0.05 0.18 4.78 3.01 -0.36 -4.16 117.46 120.41 1s1p n PHE 89 Ca 0.21 -1.25 0.04 0.00 1.01 0.00 0.00 57.45 57.47 1s1p n PHE 89 Cb 0.19 -0.21 0.31 0.00 -0.01 0.00 0.00 39.48 39.77 1s1p n PHE 89 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1s1p h HIS 90 N 0.53 0.00 -2.72 1.38 3.86 -1.70 -3.34 115.15 113.16 1s1p h HIS 90 Ca 0.01 0.00 -0.54 0.00 -1.16 0.00 0.00 60.37 58.68 1s1p h HIS 90 Cb 1.03 0.00 0.07 0.00 1.06 0.00 0.00 27.41 29.57 1s1p h HIS 90 CO 0.39 0.42 0.92 0.54 0.86 0.00 0.00 177.93 181.06 1s1p n ARG 91 N -3.61 2.60 -0.31 2.45 1.74 -1.26 -4.30 116.66 113.97 1s1p n ARG 91 Ca -0.01 0.93 0.11 0.00 -0.77 0.00 0.00 57.85 58.12 1s1p n ARG 91 Cb 0.52 -2.74 0.33 0.00 -1.02 0.00 0.00 32.46 29.55 1s1p n ARG 91 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1s1p h PRO 92 N 6.00 0.76 0.00 5.56 0.13 -1.85 0.25 132.00 142.85 1s1p h PRO 92 Ca -0.44 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1s1p h PRO 92 Cb 1.22 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.18 1s1p h PRO 92 CO 0.89 0.50 0.00 -0.85 -0.23 0.00 0.00 178.00 178.32 1s1p n GLU 93 N -4.60 0.16 0.00 0.86 0.00 -1.26 -2.39 120.64 113.40 1s1p n GLU 93 Ca 0.19 0.52 0.11 0.00 0.00 0.00 0.00 57.16 57.98 1s1p n GLU 93 Cb 0.46 -1.90 0.04 0.00 0.00 0.00 0.00 31.44 30.04 1s1p n GLU 93 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1s1p n LEU 94 N -2.22 0.86 0.08 -1.84 4.77 0.07 -4.57 117.00 114.16 1s1p n LEU 94 Ca 0.00 -0.32 -0.12 0.00 -0.03 0.00 0.00 56.01 55.54 1s1p n LEU 94 Cb 0.13 -0.10 -0.08 0.00 -2.33 0.00 0.00 43.42 41.05 1s1p n LEU 94 CO 0.14 0.21 0.49 0.58 -1.33 0.00 0.00 177.39 177.48 1s1p h VAL 95 N 0.14 0.89 -0.33 4.08 2.07 -1.52 -1.71 116.25 119.87 1s1p h VAL 95 Ca 0.00 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 1s1p h VAL 95 Cb 0.51 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 1s1p h VAL 95 CO 0.00 0.20 0.18 -0.09 0.02 0.00 0.00 177.57 177.87 1s1p h ARG 96 N -0.76 0.46 -0.89 1.57 2.43 -1.81 -1.54 114.38 113.84 1s1p h ARG 96 Ca -0.03 -0.06 0.09 0.00 -0.81 0.00 0.00 59.98 59.17 1s1p h ARG 96 Cb 0.51 -0.09 -0.06 0.00 -0.42 0.00 0.00 29.97 29.91 1s1p h ARG 96 CO 0.04 0.40 0.57 -1.35 -1.51 0.00 0.00 179.97 178.12 1s1p h PRO 97 N 0.41 0.89 -0.51 0.20 0.11 -1.80 0.49 132.00 131.78 1s1p h PRO 97 Ca 0.12 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 66.14 1s1p h PRO 97 Cb 0.07 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 30.96 1s1p h PRO 97 CO -0.02 0.59 0.18 0.00 -0.21 0.00 0.00 178.00 178.54 1s1p h ALA 98 N 1.55 0.67 -0.48 -0.75 0.00 -0.76 -0.72 119.26 118.76 1s1p h ALA 98 Ca 0.40 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1s1p h ALA 98 Cb 0.34 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1s1p h ALA 98 CO -0.17 0.31 0.08 1.25 0.00 0.00 0.00 179.25 180.72 1s1p h LEU 99 N 0.69 0.77 -1.23 0.00 5.85 -0.69 -1.92 115.31 118.78 1s1p h LEU 99 Ca 0.17 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1s1p h LEU 99 Cb 0.25 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 1s1p h LEU 99 CO -0.01 0.83 0.36 -0.33 -0.34 0.00 0.00 178.44 178.96 1s1p h GLU 100 N 0.67 0.89 -0.54 1.25 5.08 -0.68 -0.28 114.58 120.97 1s1p h GLU 100 Ca 0.15 -0.09 -0.07 0.00 -1.00 0.00 0.00 59.36 58.34 1s1p h GLU 100 Cb 0.39 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 1s1p h GLU 100 CO 0.01 0.65 0.05 -0.91 -1.00 0.00 0.00 179.01 177.81 1s1p h ASN 101 N 0.90 0.89 -0.74 1.42 2.35 -0.84 -0.79 115.58 118.77 1s1p h ASN 101 Ca 0.23 -0.28 -0.03 0.00 -0.55 0.00 0.00 56.30 55.68 1s1p h ASN 101 Cb 0.01 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.11 1s1p h ASN 101 CO -0.04 0.95 0.36 0.28 -1.65 0.00 0.00 177.43 177.33 1s1p h SER 102 N 0.80 0.96 -0.71 5.81 0.02 -0.65 -1.02 113.55 118.77 1s1p h SER 102 Ca 0.16 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 60.92 1s1p h SER 102 Cb 0.46 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.72 1s1p h SER 102 CO 0.02 0.82 0.21 -0.07 -1.14 0.00 0.00 176.83 176.67 1s1p h LEU 103 N 1.04 1.05 -0.47 5.07 3.38 -0.86 -1.50 115.31 123.02 1s1p h LEU 103 Ca 0.26 -0.20 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 1s1p h LEU 103 Cb 0.11 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1s1p h LEU 103 CO -0.03 0.98 0.10 0.50 0.09 0.00 0.00 178.44 180.08 1s1p h LYS 104 N 1.07 0.76 -0.35 1.13 3.64 -0.82 0.11 116.57 122.11 1s1p h LYS 104 Ca 0.23 -0.19 -0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1s1p h LYS 104 Cb 0.32 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 1s1p h LYS 104 CO -0.01 0.76 0.20 0.87 -2.27 0.00 0.00 179.45 179.01 1s1p h LYS 105 N 0.63 0.48 0.00 1.90 1.79 -0.96 -2.75 116.57 117.67 1s1p h LYS 105 Ca 0.14 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 1s1p h LYS 105 Cb 0.35 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.91 1s1p h LYS 105 CO 0.01 0.38 0.00 0.00 -1.08 0.00 0.00 179.45 178.76 1s1p n ALA 106 N -2.23 2.29 -3.55 3.86 0.00 -0.58 -3.81 120.51 116.48 1s1p n ALA 106 Ca -0.01 -0.05 -0.21 0.00 0.00 0.00 0.00 53.44 53.17 1s1p n ALA 106 Cb 0.07 -1.47 0.08 0.00 0.00 0.00 0.00 19.45 18.13 1s1p n ALA 106 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1s1p n GLN 107 N -2.02 -7.09 -4.34 0.00 1.13 0.32 -4.40 117.38 100.98 1s1p n GLN 107 Ca 0.06 0.81 -0.27 0.00 -1.94 0.00 0.00 57.00 55.66 1s1p n GLN 107 Cb 0.40 -5.81 -0.11 0.00 0.11 0.00 0.00 30.24 24.83 1s1p n GLN 107 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1s1p s LEU 108 N -6.87 2.73 0.22 1.08 1.43 -0.82 -5.03 118.68 111.42 1s1p s LEU 108 Ca 0.31 -0.68 0.15 0.00 -1.03 0.00 0.00 54.13 52.87 1s1p s LEU 108 Cb -0.14 -1.46 0.00 0.00 0.03 0.00 0.00 46.19 44.62 1s1p s LEU 108 CO 0.74 0.12 1.30 0.44 0.23 0.00 0.00 176.35 179.18 1s1p h ASP 109 N 3.14 0.00 -5.03 2.29 3.32 -1.95 -3.43 116.42 114.76 1s1p h ASP 109 Ca -0.47 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.53 1s1p h ASP 109 Cb 1.20 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.61 1s1p h ASP 109 CO 0.51 0.55 0.05 -0.72 -1.72 0.00 0.00 179.24 177.91 1s1p s TYR 110 N -2.94 -0.40 0.03 4.55 1.13 -1.26 -4.77 117.35 113.70 1s1p s TYR 110 Ca 0.02 0.31 -0.01 0.00 -1.41 0.00 0.00 57.07 55.98 1s1p s TYR 110 Cb 0.08 0.37 -0.04 0.00 -1.10 0.00 0.00 41.96 41.27 1s1p s TYR 110 CO 0.76 -0.70 0.19 0.14 -2.51 0.00 0.00 175.55 173.44 1s1p s VAL 111 N -3.04 5.37 0.29 -3.49 -7.23 -0.37 -5.00 120.40 106.94 1s1p s VAL 111 Ca -0.02 -0.31 0.10 0.00 -1.81 0.00 0.00 61.98 59.93 1s1p s VAL 111 Cb -0.00 -3.58 0.00 0.00 0.56 0.00 0.00 36.38 33.36 1s1p s VAL 111 CO -0.06 0.21 1.66 0.44 -0.31 0.00 0.00 175.10 177.04 1s1p h ASP 112 N 3.38 0.07 -3.46 4.85 3.32 -1.14 -0.49 116.42 122.94 1s1p h ASP 112 Ca -0.47 -0.03 -0.18 0.00 0.02 0.00 0.00 57.03 56.38 1s1p h ASP 112 Cb 1.17 -0.02 -0.28 0.00 0.22 0.00 0.00 39.33 40.42 1s1p h ASP 112 CO 0.73 0.59 -0.44 -0.22 -1.72 0.00 0.00 179.24 178.19 1s1p s LEU 113 N -7.85 0.50 -0.11 1.55 2.96 -0.88 -1.36 118.68 113.48 1s1p s LEU 113 Ca -0.02 0.58 0.03 0.00 -0.22 0.00 0.00 54.13 54.49 1s1p s LEU 113 Cb 0.13 0.87 0.01 0.00 0.50 0.00 0.00 46.19 47.69 1s1p s LEU 113 CO 0.76 -0.15 -0.19 -0.47 -1.32 0.00 0.00 176.35 174.98 1s1p s TYR 114 N 0.98 2.24 0.07 5.38 5.04 -0.56 -1.41 117.35 129.08 1s1p s TYR 114 Ca -0.07 -1.02 0.07 0.00 -2.44 0.00 0.00 57.07 53.61 1s1p s TYR 114 Cb -0.08 -1.56 -0.04 0.00 0.35 0.00 0.00 41.96 40.64 1s1p s TYR 114 CO -0.07 -0.48 -0.15 -0.51 -1.34 0.00 0.00 175.55 173.00 1s1p s LEU 115 N 0.75 2.77 -0.24 6.97 1.43 -0.72 -1.44 118.68 128.20 1s1p s LEU 115 Ca -0.11 -0.43 -0.29 0.00 -1.03 0.00 0.00 54.13 52.28 1s1p s LEU 115 Cb -0.16 -1.62 -0.02 0.00 0.03 0.00 0.00 46.19 44.43 1s1p s LEU 115 CO 0.02 0.22 1.46 -0.63 0.23 0.00 0.00 176.35 177.65 1s1p s ILE 116 N -1.05 3.92 0.36 -0.59 1.01 -0.76 -0.06 121.20 124.03 1s1p s ILE 116 Ca 0.17 1.05 0.05 0.00 0.00 0.00 0.00 60.65 61.92 1s1p s ILE 116 Cb -0.11 -3.90 0.19 0.00 0.01 0.00 0.00 42.46 38.65 1s1p s ILE 116 CO 0.08 -0.34 1.93 -0.74 0.00 0.00 0.00 174.94 175.87 1s1p h HIS 117 N 9.86 0.55 -1.95 3.97 2.76 -1.66 -0.21 115.15 128.47 1s1p h HIS 117 Ca -0.30 -0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 57.79 1s1p h HIS 117 Cb 1.13 -0.17 -0.20 0.00 1.55 0.00 0.00 27.41 29.72 1s1p h HIS 117 CO 0.89 0.48 0.22 0.45 -1.30 0.00 0.00 177.93 178.67 1s1p s SER 118 N -6.71 -0.65 0.00 3.26 0.15 -1.24 -4.27 113.70 104.24 1s1p s SER 118 Ca -0.08 0.82 0.29 0.00 0.70 0.00 0.00 55.95 57.69 1s1p s SER 118 Cb 0.16 0.69 1.51 0.00 -1.71 0.00 0.00 66.02 66.67 1s1p s SER 118 CO 0.76 -0.51 2.03 -0.81 1.20 0.00 0.00 173.24 175.90 1s1p n PRO 119 N 1.23 0.47 -2.90 5.44 -0.04 -1.26 -4.62 135.00 133.32 1s1p n PRO 119 Ca -0.17 0.01 -0.44 0.00 -0.04 0.00 0.00 63.50 62.86 1s1p n PRO 119 Cb 0.57 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.52 1s1p n PRO 119 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1s1p s MET 120 N -2.51 3.92 0.41 0.54 -1.94 -1.26 -4.79 119.30 113.67 1s1p s MET 120 Ca 0.29 -2.25 -0.27 0.00 -1.71 0.00 0.00 55.69 51.76 1s1p s MET 120 Cb 0.20 -5.06 -0.10 0.00 2.01 0.00 0.00 34.83 31.88 1s1p s MET 120 CO 0.43 -1.82 1.47 -1.12 -0.01 0.00 0.00 175.02 173.98 1s1p s SER 121 N 3.24 6.10 0.22 3.03 0.01 -1.26 -4.85 113.70 120.19 1s1p s SER 121 Ca 0.41 3.02 0.10 0.00 1.31 0.00 0.00 55.95 60.79 1s1p s SER 121 Cb -0.03 -2.66 -0.05 0.00 0.21 0.00 0.00 66.02 63.49 1s1p s SER 121 CO -0.03 -1.03 -0.20 -0.76 0.41 0.00 0.00 173.24 171.63 1s1p s LEU 122 N -2.39 2.50 0.11 2.44 1.43 -0.21 -1.57 118.68 120.99 1s1p s LEU 122 Ca 0.57 -0.94 -0.34 0.00 -1.03 0.00 0.00 54.13 52.39 1s1p s LEU 122 Cb -0.46 -1.01 -0.14 0.00 0.03 0.00 0.00 46.19 44.62 1s1p s LEU 122 CO 0.61 0.03 1.63 1.17 0.23 0.00 0.00 176.35 180.02 1s1p n LYS 123 N -0.08 2.14 -2.20 1.70 4.81 -0.75 -4.25 118.16 119.52 1s1p n LYS 123 Ca -0.10 0.77 -0.35 0.00 -0.87 0.00 0.00 58.31 57.77 1s1p n LYS 123 Cb 0.58 -2.55 0.01 0.00 0.02 0.00 0.00 35.03 33.08 1s1p n LYS 123 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1s1p s PRO 124 N 1.50 3.30 0.00 1.64 0.05 -1.26 -4.75 135.00 135.48 1s1p s PRO 124 Ca 0.81 1.58 0.00 0.00 0.05 0.00 0.00 61.00 63.45 1s1p s PRO 124 Cb -0.69 -2.00 0.00 0.00 0.05 0.00 0.00 34.50 31.86 1s1p s PRO 124 CO 0.41 -0.89 0.00 0.41 0.05 0.00 0.00 177.00 176.98 1s1p n GLY 125 N 0.07 0.07 0.14 0.56 0.00 -1.26 -5.00 105.19 99.76 1s1p n GLY 125 Ca 0.11 -1.22 -0.12 0.00 0.00 0.00 0.00 46.02 44.79 1s1p n GLY 125 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1s1p h GLU 126 N 0.00 -0.22 -6.92 1.61 3.07 -2.00 -3.45 114.58 106.66 1s1p h GLU 126 Ca 0.00 0.02 -0.52 0.00 -0.50 0.00 0.00 59.36 58.36 1s1p h GLU 126 Cb 0.00 0.05 0.07 0.00 -0.84 0.00 0.00 28.75 28.03 1s1p h GLU 126 CO 0.00 0.19 0.58 -1.21 -1.40 0.00 0.00 179.01 177.17 1s1p s GLU 127 N -3.97 4.12 0.11 2.33 2.02 -1.26 -4.94 118.70 117.11 1s1p s GLU 127 Ca -0.14 2.06 -0.13 0.00 0.02 0.00 0.00 54.97 56.77 1s1p s GLU 127 Cb 0.01 -2.83 -0.09 0.00 0.10 0.00 0.00 34.13 31.32 1s1p s GLU 127 CO 0.54 -0.33 1.40 -0.07 0.02 0.00 0.00 175.26 176.82 1s1p h LEU 128 N 2.89 0.87 -6.84 1.80 3.38 -1.97 -3.38 115.31 112.06 1s1p h LEU 128 Ca -0.49 -0.51 -0.61 0.00 0.09 0.00 0.00 57.88 56.36 1s1p h LEU 128 Cb 1.24 -0.25 -0.41 0.00 0.09 0.00 0.00 40.66 41.33 1s1p h LEU 128 CO 0.63 1.22 -0.72 -0.55 0.09 0.00 0.00 178.44 179.11 1s1p s SER 129 N -6.77 3.61 0.01 -0.43 0.15 -1.26 -4.73 113.70 104.28 1s1p s SER 129 Ca -0.12 -3.50 -0.30 0.00 0.70 0.00 0.00 55.95 52.73 1s1p s SER 129 Cb 0.09 -1.20 -0.07 0.00 -1.71 0.00 0.00 66.02 63.14 1s1p s SER 129 CO 0.86 -0.13 1.60 -2.16 1.20 0.00 0.00 173.24 174.62 1s1p s PRO 130 N -0.82 4.21 0.09 5.44 0.04 -1.26 -4.93 135.00 137.77 1s1p s PRO 130 Ca 0.27 2.21 0.06 0.00 0.04 0.00 0.00 61.00 63.58 1s1p s PRO 130 Cb -0.03 -3.72 -0.03 0.00 0.04 0.00 0.00 34.50 30.75 1s1p s PRO 130 CO -0.16 -0.74 -0.16 0.95 0.04 0.00 0.00 177.00 176.93 1s1p s THR 131 N 3.05 1.33 0.00 1.26 -4.23 -1.26 0.10 115.64 115.89 1s1p s THR 131 Ca 0.72 -1.42 0.00 0.00 -1.18 0.00 0.00 61.69 59.81 1s1p s THR 131 Cb -0.36 -1.27 0.00 0.00 1.34 0.00 0.00 72.50 72.21 1s1p s THR 131 CO 0.30 -0.19 0.00 -0.90 -0.54 0.00 0.00 174.62 173.29 1s1p n ASP 132 N 1.15 -0.06 0.00 3.99 3.85 0.44 -4.80 116.55 121.12 1s1p n ASP 132 Ca -0.20 -0.91 0.14 0.00 -0.71 0.00 0.00 54.79 53.11 1s1p n ASP 132 Cb 0.54 0.00 0.59 0.00 -1.35 0.00 0.00 41.12 40.91 1s1p n ASP 132 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1s1p n GLU 133 N -0.97 0.00 -0.14 0.11 -0.58 -1.26 -3.14 120.64 114.66 1s1p n GLU 133 Ca 0.00 0.00 0.12 0.00 -0.42 0.00 0.00 57.16 56.86 1s1p n GLU 133 Cb 0.00 -1.51 0.25 0.00 -0.57 0.00 0.00 31.44 29.62 1s1p n GLU 133 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1s1p n ASN 134 N -1.51 2.92 0.00 1.62 3.02 -1.26 -4.96 115.26 115.09 1s1p n ASN 134 Ca 0.07 -1.91 0.00 0.00 -0.03 0.00 0.00 54.58 52.70 1s1p n ASN 134 Cb 0.34 -0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 1s1p n ASN 134 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1s1p n GLY 135 N 1.39 3.21 3.78 7.41 0.00 -1.19 -5.04 105.19 114.76 1s1p n GLY 135 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 1s1p n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s1p s LYS 136 N -0.50 3.68 0.28 1.61 1.02 -1.26 -4.69 119.74 119.87 1s1p s LYS 136 Ca 0.00 1.54 -0.29 0.00 0.02 0.00 0.00 55.97 57.24 1s1p s LYS 136 Cb 0.00 -2.17 -0.10 0.00 -0.52 0.00 0.00 37.83 35.04 1s1p s LYS 136 CO 0.00 -0.56 1.16 0.14 -0.92 0.00 0.00 175.35 175.16 1s1p s VAL 137 N -1.79 3.33 -0.36 3.17 -7.23 -1.09 -0.42 120.40 116.01 1s1p s VAL 137 Ca 0.67 1.31 -0.29 0.00 -1.81 0.00 0.00 61.98 61.87 1s1p s VAL 137 Cb -0.22 -3.83 0.00 0.00 0.56 0.00 0.00 36.38 32.89 1s1p s VAL 137 CO 0.26 0.30 1.47 -0.63 -0.31 0.00 0.00 175.10 176.19 1s1p s ILE 138 N -1.01 3.86 0.55 -0.62 1.01 0.29 -4.78 121.20 120.49 1s1p s ILE 138 Ca 0.46 0.91 -0.12 0.00 0.00 0.00 0.00 60.65 61.90 1s1p s ILE 138 Cb -0.34 -4.07 -0.06 0.00 0.01 0.00 0.00 42.46 38.01 1s1p s ILE 138 CO 0.43 -0.61 0.96 0.72 0.00 0.00 0.00 174.94 176.44 1s1p s PHE 139 N 5.42 3.54 0.02 3.97 -0.71 -1.26 -1.81 117.98 127.15 1s1p s PHE 139 Ca 0.64 1.28 0.06 0.00 -1.04 0.00 0.00 56.93 57.87 1s1p s PHE 139 Cb -0.17 -2.67 -0.02 0.00 -1.21 0.00 0.00 43.02 38.95 1s1p s PHE 139 CO 0.31 -0.47 -0.18 0.34 -1.34 0.00 0.00 175.22 173.87 1s1p s ASP 140 N -3.67 2.14 -0.40 1.98 2.15 -0.61 -4.32 116.67 113.95 1s1p s ASP 140 Ca 0.55 -0.42 -0.11 0.00 0.43 0.00 0.00 52.55 53.00 1s1p s ASP 140 Cb -0.10 -0.20 0.05 0.00 -0.30 0.00 0.00 42.92 42.36 1s1p s ASP 140 CO 0.43 0.16 0.25 -0.63 -0.17 0.00 0.00 175.17 175.21 1s1p s ILE 141 N -0.64 4.63 -0.04 4.11 -1.09 -1.26 -4.42 121.20 122.48 1s1p s ILE 141 Ca 0.06 -1.01 0.03 0.00 -2.23 0.00 0.00 60.65 57.50 1s1p s ILE 141 Cb -0.08 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 37.14 1s1p s ILE 141 CO 0.01 -0.36 -0.12 -0.69 -1.23 0.00 0.00 174.94 172.55 1s1p s VAL 142 N 1.54 1.05 -0.36 2.92 1.01 -1.26 -5.09 120.40 120.21 1s1p s VAL 142 Ca 0.03 -0.49 -0.28 0.00 0.00 0.00 0.00 61.98 61.24 1s1p s VAL 142 Cb -0.21 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.23 1s1p s VAL 142 CO 0.06 0.32 1.66 -0.62 0.00 0.00 0.00 175.10 176.52 1s1p s ASP 143 N 0.30 6.05 0.42 3.32 2.15 -1.26 -4.85 116.67 122.80 1s1p s ASP 143 Ca -0.07 1.12 0.29 0.00 0.43 0.00 0.00 52.55 54.32 1s1p s ASP 143 Cb -0.12 -2.53 1.41 0.00 -0.30 0.00 0.00 42.92 41.38 1s1p s ASP 143 CO 0.02 -1.62 1.88 -0.07 -0.17 0.00 0.00 175.17 175.21 1s1p h LEU 144 N 13.16 0.00 -1.32 -1.34 3.38 -1.97 0.20 115.31 127.42 1s1p h LEU 144 Ca -0.31 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 1s1p h LEU 144 Cb 1.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1s1p h LEU 144 CO 1.05 0.00 -0.20 0.00 0.09 0.00 0.00 178.44 179.39 1s1p h THR 146 N 0.20 1.28 -0.62 0.00 1.35 -1.35 -1.89 112.91 111.88 1s1p h THR 146 Ca 0.04 -1.84 0.04 0.00 -0.55 0.00 0.00 66.41 64.10 1s1p h THR 146 Cb 0.46 1.78 -0.04 0.00 -1.73 0.00 0.00 68.15 68.62 1s1p h THR 146 CO 0.03 0.59 0.37 0.74 -0.25 0.00 0.00 175.52 177.00 1s1p h THR 147 N 0.60 1.03 -0.62 6.82 2.02 -1.44 -2.52 112.91 118.80 1s1p h THR 147 Ca -0.01 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 1s1p h THR 147 Cb 1.25 0.26 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 1s1p h THR 147 CO 0.14 0.13 0.35 -0.25 0.37 0.00 0.00 175.52 176.25 1s1p h TRP 148 N 0.71 0.85 -0.97 3.16 2.91 -0.84 -1.08 115.95 120.68 1s1p h TRP 148 Ca 0.26 -0.02 0.07 0.00 1.13 0.00 0.00 58.89 60.34 1s1p h TRP 148 Cb 0.08 -0.27 -0.07 0.00 -0.51 0.00 0.00 29.16 28.39 1s1p h TRP 148 CO -0.06 0.60 0.63 0.93 -1.03 0.00 0.00 178.44 179.51 1s1p h GLU 149 N 0.84 1.07 -0.33 2.65 5.08 -1.03 0.30 114.58 123.17 1s1p h GLU 149 Ca 0.22 -0.06 -0.10 0.00 -1.00 0.00 0.00 59.36 58.42 1s1p h GLU 149 Cb 0.03 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.03 1s1p h GLU 149 CO -0.04 0.71 -0.21 0.00 -1.00 0.00 0.00 179.01 178.47 1s1p h ALA 150 N 1.49 1.03 -0.60 3.43 0.00 -0.93 -2.30 119.26 121.38 1s1p h ALA 150 Ca 0.43 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1s1p h ALA 150 Cb 0.22 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1s1p h ALA 150 CO -0.17 0.58 0.28 0.52 0.00 0.00 0.00 179.25 180.45 1s1p h MET 151 N 0.55 0.87 -0.98 0.00 2.86 -0.01 -2.57 114.93 115.64 1s1p h MET 151 Ca 0.08 -0.14 0.04 0.00 -2.06 0.00 0.00 59.70 57.63 1s1p h MET 151 Cb 0.66 -0.15 -0.06 0.00 0.06 0.00 0.00 31.60 32.11 1s1p h MET 151 CO 0.05 0.71 0.64 0.93 1.06 0.00 0.00 176.91 180.30 1s1p h GLU 152 N 0.82 1.19 -0.14 1.72 5.08 -0.62 -1.20 114.58 121.44 1s1p h GLU 152 Ca 0.20 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.45 1s1p h GLU 152 Cb 0.14 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.11 1s1p h GLU 152 CO -0.02 0.79 -0.12 0.87 -1.00 0.00 0.00 179.01 179.52 1s1p h LYS 153 N 1.23 0.21 -0.43 2.33 1.57 -1.13 -0.99 116.57 119.37 1s1p h LYS 153 Ca 0.39 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 59.02 1s1p h LYS 153 Cb 0.02 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.28 1s1p h LYS 153 CO -0.13 0.35 -0.16 0.00 -0.57 0.00 0.00 179.45 178.94 1s1p h LYS 155 N 0.72 0.65 -0.05 0.00 3.64 -0.88 -1.83 116.57 118.83 1s1p h LYS 155 Ca 0.11 -0.25 -0.03 0.00 -1.27 0.00 0.00 60.65 59.21 1s1p h LYS 155 Cb 0.67 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.45 1s1p h LYS 155 CO 0.05 0.82 -0.09 -0.44 -2.27 0.00 0.00 179.45 177.52 1s1p h ASP 156 N 0.43 0.07 1.01 4.20 3.32 -0.99 -1.41 116.42 123.05 1s1p h ASP 156 Ca 0.08 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1s1p h ASP 156 Cb 0.59 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1s1p h ASP 156 CO 0.03 0.17 0.00 0.00 -1.72 0.00 0.00 179.24 177.73 1s1p n ALA 157 N -2.51 2.26 -0.67 3.45 0.00 -0.45 -4.92 120.51 117.67 1s1p n ALA 157 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1s1p n ALA 157 Cb 0.19 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1s1p n ALA 157 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s1p n GLY 158 N 1.34 0.72 0.12 0.00 0.00 -0.53 -4.93 105.19 101.91 1s1p n GLY 158 Ca 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.06 1s1p n GLY 158 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1s1p h LEU 159 N 0.00 0.00 -7.95 0.99 3.38 -1.56 -3.43 115.31 106.74 1s1p h LEU 159 Ca 0.00 0.00 -0.48 0.00 0.09 0.00 0.00 57.88 57.49 1s1p h LEU 159 Cb 0.00 0.00 -0.33 0.00 0.09 0.00 0.00 40.66 40.42 1s1p h LEU 159 CO 0.00 0.69 -0.80 0.00 0.09 0.00 0.00 178.44 178.42 1s1p s ALA 160 N -3.42 1.09 0.14 1.53 0.00 -1.19 -1.24 121.76 118.68 1s1p s ALA 160 Ca -0.01 -0.34 -0.11 0.00 0.00 0.00 0.00 51.96 51.50 1s1p s ALA 160 Cb 0.12 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.71 1s1p s ALA 160 CO 0.77 0.11 1.47 0.87 0.00 0.00 0.00 175.76 178.98 1s1p h LYS 161 N 6.85 0.94 -4.52 0.00 1.79 -1.14 -3.38 116.57 117.12 1s1p h LYS 161 Ca -0.33 -0.50 -0.23 0.00 -2.18 0.00 0.00 60.65 57.41 1s1p h LYS 161 Cb 1.18 0.02 -0.18 0.00 -1.58 0.00 0.00 32.23 31.66 1s1p h LYS 161 CO 0.48 1.16 -0.71 -1.12 -1.08 0.00 0.00 179.45 178.17 1s1p s SER 162 N -6.84 0.87 0.06 0.86 0.01 -0.47 -5.00 113.70 103.19 1s1p s SER 162 Ca -0.11 -0.77 0.06 0.00 1.31 0.00 0.00 55.95 56.44 1s1p s SER 162 Cb 0.11 0.08 -0.03 0.00 0.21 0.00 0.00 66.02 66.40 1s1p s SER 162 CO 0.88 -0.35 -0.16 0.27 0.41 0.00 0.00 173.24 174.29 1s1p s ILE 163 N -2.51 1.30 0.00 1.44 -4.36 -1.26 -1.50 121.20 114.31 1s1p s ILE 163 Ca -0.00 -1.20 0.00 0.00 -0.26 0.00 0.00 60.65 59.18 1s1p s ILE 163 Cb -0.02 -1.19 0.00 0.00 1.25 0.00 0.00 42.46 42.50 1s1p s ILE 163 CO -0.03 -0.03 0.00 0.61 0.24 0.00 0.00 174.94 175.73 1s1p n GLY 164 N 1.59 2.47 3.42 6.27 0.00 -0.52 -1.10 105.19 117.33 1s1p n GLY 164 Ca -0.19 -1.09 -0.21 0.00 0.00 0.00 0.00 46.02 44.54 1s1p n GLY 164 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1s1p s VAL 165 N -2.81 0.95 -0.08 1.61 -7.23 -0.71 -1.82 120.40 110.32 1s1p s VAL 165 Ca 0.00 -2.00 -0.09 0.00 -1.81 0.00 0.00 61.98 58.08 1s1p s VAL 165 Cb 0.00 -2.71 0.02 0.00 0.56 0.00 0.00 36.38 34.26 1s1p s VAL 165 CO 0.00 0.00 0.24 -0.55 -0.31 0.00 0.00 175.10 174.48 1s1p s SER 166 N -3.45 -0.23 -1.41 4.85 0.15 -0.09 -1.29 113.70 112.22 1s1p s SER 166 Ca 0.36 0.41 0.00 0.00 0.70 0.00 0.00 55.95 57.42 1s1p s SER 166 Cb 0.08 0.46 0.00 0.00 -1.71 0.00 0.00 66.02 64.85 1s1p s SER 166 CO 0.15 -0.13 0.00 0.59 1.20 0.00 0.00 173.24 175.05 1s1p n ASN 167 N 2.74 -4.63 -4.85 5.45 3.02 0.02 -3.60 115.26 113.40 1s1p n ASN 167 Ca -0.14 0.17 -0.35 0.00 -0.03 0.00 0.00 54.58 54.24 1s1p n ASN 167 Cb 0.58 -3.60 -0.06 0.00 -0.61 0.00 0.00 39.78 36.09 1s1p n ASN 167 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1s1p s PHE 168 N -2.64 3.58 0.73 3.10 0.40 -1.26 -4.50 117.98 117.38 1s1p s PHE 168 Ca 0.00 0.96 0.01 0.00 -0.60 0.00 0.00 56.93 57.30 1s1p s PHE 168 Cb 0.00 -2.30 0.14 0.00 0.51 0.00 0.00 43.02 41.37 1s1p s PHE 168 CO 0.00 0.44 1.00 0.54 0.70 0.00 0.00 175.22 177.90 1s1p s ASN 169 N -1.80 4.30 0.18 1.36 2.20 -1.26 -4.90 114.94 115.01 1s1p s ASN 169 Ca 0.37 -0.54 -0.14 0.00 -0.94 0.00 0.00 52.86 51.62 1s1p s ASN 169 Cb -0.14 0.24 0.10 0.00 -2.00 0.00 0.00 41.25 39.45 1s1p s ASN 169 CO 0.19 -1.91 1.81 0.03 -2.94 0.00 0.00 177.10 174.27 1s1p h ARG 170 N -0.51 0.56 -0.65 3.55 3.08 -1.96 -1.48 114.38 116.98 1s1p h ARG 170 Ca -0.34 -0.03 -0.00 0.00 0.07 0.00 0.00 59.98 59.67 1s1p h ARG 170 Cb 1.26 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 31.16 1s1p h ARG 170 CO 0.38 0.37 0.39 -0.09 -1.07 0.00 0.00 179.97 179.95 1s1p h ARG 171 N 0.58 0.88 -0.54 0.04 9.65 -1.98 0.02 114.38 123.03 1s1p h ARG 171 Ca 0.21 -0.08 -0.08 0.00 -1.10 0.00 0.00 59.98 58.92 1s1p h ARG 171 Cb 0.04 -0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 28.42 1s1p h ARG 171 CO -0.10 0.63 0.01 1.96 2.80 0.00 0.00 179.97 185.27 1s1p h GLN 172 N 0.88 0.90 -0.42 0.20 4.20 -1.88 -1.48 115.11 117.52 1s1p h GLN 172 Ca 0.23 -0.26 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 1s1p h GLN 172 Cb -0.02 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1s1p h GLN 172 CO -0.04 0.89 0.17 -0.07 -0.67 0.00 0.00 178.83 179.11 1s1p h LEU 173 N 0.84 0.58 -1.12 1.46 3.38 -0.89 -2.93 115.31 116.63 1s1p h LEU 173 Ca 0.16 -0.17 0.06 0.00 0.09 0.00 0.00 57.88 58.02 1s1p h LEU 173 Cb 0.48 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.02 1s1p h LEU 173 CO 0.02 0.59 0.60 -0.33 0.09 0.00 0.00 178.44 179.41 1s1p h GLU 174 N 0.53 1.03 -0.96 1.13 4.39 -0.65 -0.29 114.58 119.77 1s1p h GLU 174 Ca 0.14 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.79 1s1p h GLU 174 Cb 0.19 -0.23 -0.05 0.00 -0.10 0.00 0.00 28.75 28.56 1s1p h GLU 174 CO -0.01 0.68 0.64 0.52 -1.16 0.00 0.00 179.01 179.68 1s1p h MET 175 N 1.06 1.25 -0.09 2.33 2.86 -1.10 -0.50 114.93 120.75 1s1p h MET 175 Ca 0.39 -0.08 -0.07 0.00 -2.06 0.00 0.00 59.70 57.89 1s1p h MET 175 Cb 0.17 -0.28 0.00 0.00 0.06 0.00 0.00 31.60 31.55 1s1p h MET 175 CO -0.15 0.83 -0.21 0.82 1.06 0.00 0.00 176.91 179.26 1s1p h ILE 176 N 1.29 1.40 0.00 -1.22 1.08 -1.17 -3.07 117.51 115.82 1s1p h ILE 176 Ca 0.36 -1.53 -0.01 0.00 -0.39 0.00 0.00 64.86 63.29 1s1p h ILE 176 Cb -0.12 2.17 -0.00 0.00 -3.07 0.00 0.00 36.82 35.80 1s1p h ILE 176 CO -0.08 0.44 -0.05 -0.07 -0.69 0.00 0.00 178.15 177.69 1s1p h LEU 177 N -0.16 0.00 -1.76 1.44 3.38 -0.74 -2.01 115.31 115.45 1s1p h LEU 177 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1s1p h LEU 177 Cb 0.81 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1s1p h LEU 177 CO 0.05 0.05 0.00 0.59 0.09 0.00 0.00 178.44 179.22 1s1p n ASN 178 N -4.46 2.64 -4.70 -0.43 3.02 -0.23 -4.95 115.26 106.16 1s1p n ASN 178 Ca -0.03 -1.87 -0.42 0.00 -0.03 0.00 0.00 54.58 52.23 1s1p n ASN 178 Cb 0.13 -0.17 -0.03 0.00 -0.61 0.00 0.00 39.78 39.10 1s1p n ASN 178 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1s1p s LYS 179 N -1.65 4.19 0.32 3.52 2.20 -0.76 -4.93 119.74 122.62 1s1p s LYS 179 Ca 0.35 2.41 -0.29 0.00 -0.36 0.00 0.00 55.97 58.08 1s1p s LYS 179 Cb 0.20 -3.36 -0.12 0.00 -1.51 0.00 0.00 37.83 33.05 1s1p s LYS 179 CO 0.29 -0.70 1.55 -2.30 -0.36 0.00 0.00 175.35 173.83 1s1p n PRO 180 N 4.77 2.65 -1.05 4.03 -0.02 -1.26 -2.26 135.00 141.85 1s1p n PRO 180 Ca 0.15 0.94 -0.02 0.00 -2.02 0.00 0.00 63.50 62.55 1s1p n PRO 180 Cb 0.39 -2.69 -0.01 0.00 -0.02 0.00 0.00 33.50 31.17 1s1p n PRO 180 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s1p n GLY 181 N 1.63 0.52 3.62 -1.23 0.00 -1.26 -4.97 105.19 103.50 1s1p n GLY 181 Ca 0.06 -0.32 -0.49 0.00 0.00 0.00 0.00 46.02 45.28 1s1p n GLY 181 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1s1p n LEU 182 N -0.20 2.16 -0.11 0.99 7.94 -0.96 -4.90 117.00 121.92 1s1p n LEU 182 Ca -0.02 1.12 -0.18 0.00 -1.11 0.00 0.00 56.01 55.82 1s1p n LEU 182 Cb 0.13 -1.28 -0.10 0.00 0.53 0.00 0.00 43.42 42.70 1s1p n LEU 182 CO 0.03 -0.85 -1.25 1.17 -1.11 0.00 0.00 177.39 175.38 1s1p n LYS 183 N 2.49 0.54 -4.12 1.96 4.81 -1.26 -4.97 118.16 117.61 1s1p n LYS 183 Ca 0.16 0.15 -0.23 0.00 -0.87 0.00 0.00 58.31 57.52 1s1p n LYS 183 Cb 0.24 -1.42 -0.17 0.00 0.02 0.00 0.00 35.03 33.71 1s1p n LYS 183 CO 0.00 0.00 0.00 0.71 1.17 0.00 0.00 177.40 179.28 1s1p s TYR 184 N -2.44 1.06 0.63 5.64 2.02 -1.26 -5.13 117.35 117.87 1s1p s TYR 184 Ca -0.31 -0.40 -0.17 0.00 -0.37 0.00 0.00 57.07 55.83 1s1p s TYR 184 Cb 0.09 -0.92 -0.02 0.00 -0.40 0.00 0.00 41.96 40.72 1s1p s TYR 184 CO 0.49 -0.31 1.13 0.15 -1.57 0.00 0.00 175.55 175.43 1s1p s LYS 185 N 1.25 2.91 0.32 -0.62 1.02 -1.26 -4.98 119.74 118.39 1s1p s LYS 185 Ca -0.05 1.52 -0.29 0.00 0.02 0.00 0.00 55.97 57.16 1s1p s LYS 185 Cb -0.14 -1.95 -0.11 0.00 -0.52 0.00 0.00 37.83 35.11 1s1p s LYS 185 CO -0.02 -1.18 1.54 -2.14 -0.92 0.00 0.00 175.35 172.63 1s1p s PRO 186 N -3.79 4.13 0.40 -1.68 0.02 -1.26 -4.86 135.00 127.95 1s1p s PRO 186 Ca 0.70 2.56 0.22 0.00 0.02 0.00 0.00 61.00 64.50 1s1p s PRO 186 Cb -0.23 -3.01 0.44 0.00 0.02 0.00 0.00 34.50 31.72 1s1p s PRO 186 CO 0.37 -0.58 1.63 -0.39 -0.33 0.00 0.00 177.00 177.70 1s1p h VAL 187 N 3.23 0.34 -3.29 3.83 -1.51 -1.47 -3.44 116.25 113.94 1s1p h VAL 187 Ca -0.48 -1.34 -0.01 0.00 -1.23 0.00 0.00 66.70 63.63 1s1p h VAL 187 Cb 1.23 2.05 -0.09 0.00 -2.13 0.00 0.00 31.29 32.35 1s1p h VAL 187 CO 0.73 0.18 0.05 0.00 -1.23 0.00 0.00 177.57 177.31 1s1p s ASN 189 N -2.90 3.30 -0.30 0.00 2.47 -0.07 -1.74 114.94 115.70 1s1p s ASN 189 Ca 0.12 -1.05 -0.22 0.00 0.42 0.00 0.00 52.86 52.13 1s1p s ASN 189 Cb -0.02 -0.74 -0.01 0.00 -1.45 0.00 0.00 41.25 39.04 1s1p s ASN 189 CO 0.01 -0.32 0.71 -1.58 -3.72 0.00 0.00 177.10 172.21 1s1p s GLN 190 N 1.74 3.97 0.09 0.43 0.74 -0.41 -1.84 119.66 124.38 1s1p s GLN 190 Ca 0.00 0.50 -0.02 0.00 0.05 0.00 0.00 55.36 55.90 1s1p s GLN 190 Cb -0.17 -3.71 -0.04 0.00 1.10 0.00 0.00 33.01 30.19 1s1p s GLN 190 CO -0.12 -0.60 0.03 0.14 -0.55 0.00 0.00 175.29 174.20 1s1p s VAL 191 N 2.77 0.16 0.08 1.34 -7.23 0.18 -0.80 120.40 116.89 1s1p s VAL 191 Ca 0.29 -1.81 -0.31 0.00 -1.81 0.00 0.00 61.98 58.34 1s1p s VAL 191 Cb -0.15 -1.77 -0.08 0.00 0.56 0.00 0.00 36.38 34.95 1s1p s VAL 191 CO 0.11 -0.71 1.57 -0.70 -0.31 0.00 0.00 175.10 175.06 1s1p s GLU 192 N -3.98 4.23 -0.28 4.82 2.12 -1.26 -1.00 118.70 123.34 1s1p s GLU 192 Ca 0.15 2.25 -0.11 0.00 0.36 0.00 0.00 54.97 57.62 1s1p s GLU 192 Cb 0.07 -3.47 0.11 0.00 0.26 0.00 0.00 34.13 31.11 1s1p s GLU 192 CO -0.04 -0.65 0.64 0.00 -0.54 0.00 0.00 175.26 174.66 1s1p s HIS 194 N 2.54 -0.06 0.64 0.00 -3.43 -0.95 -3.77 115.29 110.26 1s1p s HIS 194 Ca -0.07 -0.29 0.36 0.00 -0.80 0.00 0.00 55.06 54.26 1s1p s HIS 194 Cb -0.10 0.67 1.99 0.00 -1.43 0.00 0.00 32.58 33.71 1s1p s HIS 194 CO -0.19 -0.88 2.19 -1.35 -2.00 0.00 0.00 174.74 172.51 1s1p h PRO 195 N 2.00 0.00 -0.00 -0.38 0.11 -1.90 -0.31 132.00 131.51 1s1p h PRO 195 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1s1p h PRO 195 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1s1p h PRO 195 CO 0.29 0.00 -0.26 0.66 -0.21 0.00 0.00 178.00 178.48 1s1p n TYR 196 N -3.29 0.00 -2.85 0.65 4.01 -1.26 -1.99 117.16 112.43 1s1p n TYR 196 Ca -0.02 0.00 -0.09 0.00 -0.16 0.00 0.00 57.90 57.63 1s1p n TYR 196 Cb 0.21 -0.19 0.01 0.00 -0.31 0.00 0.00 39.34 39.06 1s1p n TYR 196 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 1s1p n PHE 197 N -0.99 -3.10 1.21 -0.72 7.35 -0.19 -1.40 117.46 119.62 1s1p n PHE 197 Ca 0.11 -1.88 0.14 0.00 -0.76 0.00 0.00 57.45 55.06 1s1p n PHE 197 Cb 0.33 1.26 0.52 0.00 0.35 0.00 0.00 39.48 41.94 1s1p n PHE 197 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 1s1p n ASN 198 N 2.26 0.39 -2.78 -2.13 2.04 -0.85 -2.23 115.26 111.96 1s1p n ASN 198 Ca 0.16 -0.25 -0.21 0.00 -0.44 0.00 0.00 54.58 53.83 1s1p n ASN 198 Cb 0.58 -0.09 0.01 0.00 -2.53 0.00 0.00 39.78 37.75 1s1p n ASN 198 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1s1p n ARG 199 N -1.20 -3.36 -0.28 -3.83 5.12 -1.26 -4.78 116.66 107.07 1s1p n ARG 199 Ca 0.10 0.87 0.01 0.00 -1.93 0.00 0.00 57.85 56.90 1s1p n ARG 199 Cb 0.31 -5.62 0.14 0.00 -1.16 0.00 0.00 32.46 26.13 1s1p n ARG 199 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1s1p h SER 200 N -0.72 0.67 -0.44 0.55 4.64 -1.99 0.16 113.55 116.42 1s1p h SER 200 Ca -0.48 0.04 -0.09 0.00 -0.47 0.00 0.00 61.79 60.79 1s1p h SER 200 Cb 1.34 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.32 1s1p h SER 200 CO 0.55 0.40 -0.06 0.11 -0.87 0.00 0.00 176.83 176.96 1s1p h LYS 201 N 0.79 0.82 -0.62 4.77 1.57 -2.00 -0.81 116.57 121.10 1s1p h LYS 201 Ca 0.37 -0.29 -0.08 0.00 -1.87 0.00 0.00 60.65 58.77 1s1p h LYS 201 Cb 0.28 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1s1p h LYS 201 CO -0.22 0.91 0.07 1.25 -0.57 0.00 0.00 179.45 180.89 1s1p h LEU 202 N 0.65 0.99 -0.33 2.94 5.85 -1.78 -1.63 115.31 122.00 1s1p h LEU 202 Ca 0.12 -0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 1s1p h LEU 202 Cb 0.58 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1s1p h LEU 202 CO 0.03 1.00 0.20 0.25 -0.34 0.00 0.00 178.44 179.58 1s1p h LEU 203 N 0.96 0.39 -0.67 2.25 5.85 -0.49 0.84 115.31 124.44 1s1p h LEU 203 Ca 0.19 -0.05 0.03 0.00 0.84 0.00 0.00 57.88 58.88 1s1p h LEU 203 Cb 0.46 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.35 1s1p h LEU 203 CO 0.02 0.33 0.42 -0.78 -0.34 0.00 0.00 178.44 178.08 1s1p h ASP 204 N 0.42 0.69 -0.08 1.25 1.82 -0.90 0.09 116.42 119.70 1s1p h ASP 204 Ca 0.12 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.75 1s1p h ASP 204 Cb 0.01 -0.15 -0.00 0.00 0.68 0.00 0.00 39.33 39.87 1s1p h ASP 204 CO -0.02 0.48 0.04 0.15 -1.61 0.00 0.00 179.24 178.28 1s1p h PHE 205 N 0.82 0.12 -0.47 0.28 3.57 -0.94 -1.80 116.94 118.52 1s1p h PHE 205 Ca 0.27 -0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.80 1s1p h PHE 205 Cb 0.02 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.69 1s1p h PHE 205 CO -0.05 0.18 0.25 0.00 -2.23 0.00 0.00 178.31 176.47 1s1p h LYS 207 N 0.50 1.08 0.00 0.00 1.57 -0.88 0.52 116.57 119.36 1s1p h LYS 207 Ca 0.20 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1s1p h LYS 207 Cb 0.08 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.14 1s1p h LYS 207 CO -0.12 0.71 0.00 0.66 -0.57 0.00 0.00 179.45 180.13 1s1p h SER 208 N 1.11 0.00 -0.30 0.86 4.64 -0.53 -2.11 113.55 117.23 1s1p h SER 208 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1s1p h SER 208 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1s1p h SER 208 CO -0.15 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.10 1s1p n LYS 209 N -2.89 2.68 -3.81 4.77 4.76 -0.59 -4.98 118.16 118.09 1s1p n LYS 209 Ca -0.01 -1.94 -0.26 0.00 -2.87 0.00 0.00 58.31 53.23 1s1p n LYS 209 Cb 0.18 -1.25 0.03 0.00 -1.84 0.00 0.00 35.03 32.15 1s1p n LYS 209 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1s1p n ASP 210 N 0.46 -3.10 -4.40 4.39 4.64 -0.68 -5.00 116.55 112.86 1s1p n ASP 210 Ca 0.10 -0.80 -0.34 0.00 -1.38 0.00 0.00 54.79 52.38 1s1p n ASP 210 Cb 0.40 -3.97 -0.13 0.00 -1.04 0.00 0.00 41.12 36.38 1s1p n ASP 210 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 1s1p s ILE 211 N -3.48 3.50 0.11 5.18 1.01 0.07 -4.40 121.20 123.19 1s1p s ILE 211 Ca 0.35 -0.48 -0.30 0.00 0.00 0.00 0.00 60.65 60.21 1s1p s ILE 211 Cb -0.17 -2.54 -0.06 0.00 0.01 0.00 0.00 42.46 39.70 1s1p s ILE 211 CO 0.82 0.48 1.09 -0.69 0.00 0.00 0.00 174.94 176.64 1s1p s VAL 212 N 0.74 4.15 -0.18 2.92 1.01 -0.45 -3.91 120.40 124.68 1s1p s VAL 212 Ca -0.03 1.70 -0.20 0.00 0.00 0.00 0.00 61.98 63.46 1s1p s VAL 212 Cb -0.15 -4.09 -0.03 0.00 0.00 0.00 0.00 36.38 32.11 1s1p s VAL 212 CO 0.02 0.22 0.56 -0.22 0.00 0.00 0.00 175.10 175.68 1s1p s LEU 213 N 0.26 4.18 -0.20 3.92 0.20 -1.26 -0.89 118.68 124.89 1s1p s LEU 213 Ca 0.52 0.78 -0.04 0.00 0.69 0.00 0.00 54.13 56.08 1s1p s LEU 213 Cb -0.27 -2.79 -0.02 0.00 -0.43 0.00 0.00 46.19 42.68 1s1p s LEU 213 CO 0.32 -0.18 -0.03 -0.69 -0.29 0.00 0.00 176.35 175.47 1s1p s VAL 214 N 1.52 3.61 -0.18 1.68 1.01 -0.77 -1.67 120.40 125.60 1s1p s VAL 214 Ca 0.27 -0.43 -0.19 0.00 0.00 0.00 0.00 61.98 61.63 1s1p s VAL 214 Cb -0.16 -2.62 -0.03 0.00 0.00 0.00 0.00 36.38 33.57 1s1p s VAL 214 CO 0.11 0.44 0.55 0.00 0.00 0.00 0.00 175.10 176.20 1s1p s ALA 215 N 1.08 3.52 0.31 5.51 0.00 0.55 -0.65 121.76 132.08 1s1p s ALA 215 Ca 0.01 -0.31 0.08 0.00 0.00 0.00 0.00 51.96 51.74 1s1p s ALA 215 Cb -0.15 -2.84 -0.04 0.00 0.00 0.00 0.00 23.12 20.10 1s1p s ALA 215 CO 0.00 -0.40 0.16 1.52 0.00 0.00 0.00 175.76 177.04 1s1p s TYR 216 N 1.53 2.82 -1.35 0.00 1.13 -0.17 -1.68 117.35 119.63 1s1p s TYR 216 Ca 0.26 -0.29 -0.06 0.00 -1.41 0.00 0.00 57.07 55.57 1s1p s TYR 216 Cb -0.16 -1.55 0.04 0.00 -1.10 0.00 0.00 41.96 39.20 1s1p s TYR 216 CO 0.10 0.39 0.45 0.43 -2.51 0.00 0.00 175.55 174.42 1s1p n SER 217 N -1.15 -4.51 0.31 -0.18 7.64 -1.26 -1.73 113.62 112.73 1s1p n SER 217 Ca -0.04 -0.27 0.20 0.00 1.01 0.00 0.00 58.87 59.77 1s1p n SER 217 Cb 0.60 -3.71 0.96 0.00 -1.01 0.00 0.00 64.21 61.05 1s1p n SER 217 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1s1p h ALA 218 N 0.99 1.00 -0.59 -0.43 0.00 -1.79 -0.77 119.26 117.67 1s1p h ALA 218 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1s1p h ALA 218 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1s1p h ALA 218 CO 0.52 0.00 0.00 1.28 0.00 0.00 0.00 179.25 181.05 1s1p n LEU 219 N -3.06 3.71 0.00 0.00 4.77 -1.26 -4.69 117.00 116.47 1s1p n LEU 219 Ca -0.01 -2.07 0.00 0.00 -0.03 0.00 0.00 56.01 53.89 1s1p n LEU 219 Cb 0.18 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 1s1p n LEU 219 CO 0.23 0.88 0.00 0.61 -1.33 0.00 0.00 177.39 177.78 1s1p n GLY 220 N 1.17 0.96 0.24 -0.72 0.00 -0.29 -4.43 105.19 102.13 1s1p n GLY 220 Ca 0.20 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.26 1s1p n GLY 220 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1s1p n SER 221 N 0.00 -1.45 -0.29 1.61 3.41 -1.24 -4.54 113.62 111.12 1s1p n SER 221 Ca 0.00 0.18 0.14 0.00 -0.26 0.00 0.00 58.87 58.94 1s1p n SER 221 Cb 0.00 -0.79 0.68 0.00 -0.26 0.00 0.00 64.21 63.83 1s1p n SER 221 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1s1p n GLN 222 N -2.76 1.40 -3.80 4.33 6.02 -1.26 -4.94 117.38 116.37 1s1p n GLN 222 Ca -0.01 -0.58 -0.27 0.00 -0.01 0.00 0.00 57.00 56.13 1s1p n GLN 222 Cb 0.11 -1.48 0.04 0.00 1.02 0.00 0.00 30.24 29.94 1s1p n GLN 222 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1s1p n ARG 223 N -0.29 -6.00 -1.99 -1.09 1.74 -1.26 -4.89 116.66 102.88 1s1p n ARG 223 Ca 0.21 0.66 -0.42 0.00 -0.77 0.00 0.00 57.85 57.53 1s1p n ARG 223 Cb 0.25 -5.54 -0.03 0.00 -1.02 0.00 0.00 32.46 26.12 1s1p n ARG 223 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1s1p s ASP 224 N -3.51 6.64 0.62 0.55 3.68 -1.26 -4.79 116.67 118.60 1s1p s ASP 224 Ca 0.53 2.58 0.35 0.00 2.13 0.00 0.00 52.55 58.13 1s1p s ASP 224 Cb -0.26 -2.60 2.01 0.00 -1.45 0.00 0.00 42.92 40.63 1s1p s ASP 224 CO 0.80 -0.77 2.27 0.11 0.13 0.00 0.00 175.17 177.71 1s1p h LYS 225 N 6.49 0.00 -0.15 4.34 1.79 -1.90 0.65 116.57 127.78 1s1p h LYS 225 Ca -0.43 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.01 1s1p h LYS 225 Cb 1.21 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.85 1s1p h LYS 225 CO 0.88 0.00 -0.04 0.00 -1.08 0.00 0.00 179.45 179.21 1s1p h ARG 226 N 0.00 0.22 0.00 3.15 3.08 -2.02 -3.37 114.38 115.44 1s1p h ARG 226 Ca 0.01 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1s1p h ARG 226 Cb 0.07 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1s1p h ARG 226 CO -0.00 0.29 -0.35 0.91 -1.07 0.00 0.00 179.97 179.75 1s1p n TRP 227 N -4.36 0.00 -5.17 3.04 8.01 -0.54 -4.90 117.44 113.52 1s1p n TRP 227 Ca -0.01 0.00 -0.32 0.00 -1.31 0.00 0.00 57.50 55.86 1s1p n TRP 227 Cb 0.20 0.00 -0.17 0.00 -2.01 0.00 0.00 31.31 29.33 1s1p n TRP 227 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.69 176.76 1s1p s VAL 228 N -0.88 2.18 -0.04 -0.99 1.01 0.11 -0.90 120.40 120.89 1s1p s VAL 228 Ca 0.00 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 60.71 1s1p s VAL 228 Cb 0.00 -1.84 -0.05 0.00 0.00 0.00 0.00 36.38 34.48 1s1p s VAL 228 CO 0.00 0.56 1.58 -0.62 0.00 0.00 0.00 175.10 176.62 1s1p s ASP 229 N 0.33 6.71 0.64 3.32 2.15 -1.26 -4.49 116.67 124.07 1s1p s ASP 229 Ca -0.18 2.19 0.40 0.00 0.43 0.00 0.00 52.55 55.40 1s1p s ASP 229 Cb -0.18 -2.54 2.25 0.00 -0.30 0.00 0.00 42.92 42.15 1s1p s ASP 229 CO 0.08 -0.88 2.34 1.55 -0.17 0.00 0.00 175.17 178.10 1s1p h PRO 230 N 9.04 0.00 0.00 4.34 0.13 -1.95 -0.80 132.00 142.77 1s1p h PRO 230 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1s1p h PRO 230 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1s1p h PRO 230 CO 0.95 0.00 0.00 -0.91 -0.23 0.00 0.00 178.00 177.81 1s1p h ASN 231 N 0.00 0.00 -2.88 1.44 2.35 -2.03 -3.45 115.58 111.01 1s1p h ASN 231 Ca -0.00 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.23 1s1p h ASN 231 Cb 0.01 0.00 0.07 0.00 0.05 0.00 0.00 38.32 38.44 1s1p h ASN 231 CO 0.00 0.00 0.98 -0.44 -1.65 0.00 0.00 177.43 176.32 1s1p s SER 232 N -5.61 6.36 0.25 5.81 0.01 -0.31 -4.89 113.70 115.33 1s1p s SER 232 Ca 0.02 2.91 -0.30 0.00 1.31 0.00 0.00 55.95 59.90 1s1p s SER 232 Cb 0.09 -2.61 -0.14 0.00 0.21 0.00 0.00 66.02 63.56 1s1p s SER 232 CO 0.54 -0.97 1.08 -2.65 0.41 0.00 0.00 173.24 171.65 1s1p n PRO 233 N 3.39 1.33 -2.60 12.44 -0.02 -1.26 -4.90 135.00 143.38 1s1p n PRO 233 Ca 0.13 0.47 -0.43 0.00 -2.02 0.00 0.00 63.50 61.66 1s1p n PRO 233 Cb 0.36 -1.89 -0.02 0.00 -0.02 0.00 0.00 33.50 31.92 1s1p n PRO 233 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1s1p s VAL 234 N -0.73 4.46 0.19 -1.45 1.01 -1.26 -4.94 120.40 117.67 1s1p s VAL 234 Ca 0.63 1.69 -0.15 0.00 0.00 0.00 0.00 61.98 64.15 1s1p s VAL 234 Cb -0.74 -4.36 0.15 0.00 0.00 0.00 0.00 36.38 31.43 1s1p s VAL 234 CO 0.57 -0.44 1.66 0.25 0.00 0.00 0.00 175.10 177.13 1s1p h LEU 235 N 10.13 -0.39 0.00 3.92 5.85 -1.86 -1.04 115.31 131.93 1s1p h LEU 235 Ca -0.21 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1s1p h LEU 235 Cb 1.07 0.28 0.00 0.00 0.37 0.00 0.00 40.66 42.38 1s1p h LEU 235 CO 1.03 -0.14 0.00 0.18 -0.34 0.00 0.00 178.44 179.17 1s1p n LEU 236 N -5.32 0.00 -0.73 2.25 4.77 -1.26 -1.32 117.00 115.39 1s1p n LEU 236 Ca 0.05 0.36 0.12 0.00 -0.03 0.00 0.00 56.01 56.50 1s1p n LEU 236 Cb 0.27 -0.36 0.33 0.00 -2.33 0.00 0.00 43.42 41.33 1s1p n LEU 236 CO 0.12 -0.15 0.76 -0.62 -1.33 0.00 0.00 177.39 176.17 1s1p n GLU 237 N -1.36 1.97 -1.93 3.23 1.02 -0.40 -4.77 120.64 118.41 1s1p n GLU 237 Ca 0.07 -1.44 -0.42 0.00 -0.02 0.00 0.00 57.16 55.34 1s1p n GLU 237 Cb 0.16 -1.45 -0.03 0.00 -0.02 0.00 0.00 31.44 30.10 1s1p n GLU 237 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1s1p s ASP 238 N -1.71 6.59 0.47 1.62 2.15 -0.43 -4.90 116.67 120.46 1s1p s ASP 238 Ca 0.34 2.58 0.12 0.00 0.43 0.00 0.00 52.55 56.02 1s1p s ASP 238 Cb 0.20 -2.58 1.07 0.00 -0.30 0.00 0.00 42.92 41.30 1s1p s ASP 238 CO 0.30 -0.85 2.11 1.55 -0.17 0.00 0.00 175.17 178.10 1s1p h PRO 239 N 7.32 0.26 -0.23 4.34 0.13 -1.92 -0.81 132.00 141.10 1s1p h PRO 239 Ca -0.43 -0.02 -0.07 0.00 -0.87 0.00 0.00 66.00 64.62 1s1p h PRO 239 Cb 1.20 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1s1p h PRO 239 CO 0.92 0.18 -0.13 0.28 -0.23 0.00 0.00 178.00 179.01 1s1p h VAL 240 N 0.27 1.31 -0.76 1.56 2.07 -1.97 0.05 116.25 118.77 1s1p h VAL 240 Ca 0.07 -1.23 -0.04 0.00 0.82 0.00 0.00 66.70 66.32 1s1p h VAL 240 Cb -0.03 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.33 1s1p h VAL 240 CO -0.02 0.38 0.30 -0.07 0.02 0.00 0.00 177.57 178.18 1s1p h LEU 241 N 0.20 1.05 -0.68 2.57 3.38 -1.83 -0.96 115.31 119.04 1s1p h LEU 241 Ca 0.05 -0.16 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1s1p h LEU 241 Cb 0.64 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1s1p h LEU 241 CO 0.04 0.93 -0.30 0.00 0.09 0.00 0.00 178.44 179.20 1s1p h ALA 243 N 1.07 0.79 -0.49 0.00 0.00 -0.69 -1.41 119.26 118.54 1s1p h ALA 243 Ca 0.07 -0.34 -0.09 0.00 0.00 0.00 0.00 54.91 54.55 1s1p h ALA 243 Cb 0.81 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1s1p h ALA 243 CO 0.07 0.68 -0.07 -0.07 0.00 0.00 0.00 179.25 179.85 1s1p h LEU 244 N 0.96 0.86 -0.62 0.00 3.38 -1.00 -0.29 115.31 118.60 1s1p h LEU 244 Ca 0.16 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1s1p h LEU 244 Cb 0.63 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.12 1s1p h LEU 244 CO 0.04 0.97 0.40 0.00 0.09 0.00 0.00 178.44 179.94 1s1p h ALA 245 N 1.12 0.79 -0.36 1.53 0.00 -0.81 -1.28 119.26 120.24 1s1p h ALA 245 Ca 0.14 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1s1p h ALA 245 Cb 0.58 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1s1p h ALA 245 CO 0.04 0.23 0.08 -0.22 0.00 0.00 0.00 179.25 179.38 1s1p h LYS 246 N 0.84 0.58 -0.74 0.00 3.64 -0.97 0.98 116.57 120.90 1s1p h LYS 246 Ca 0.23 -0.15 0.07 0.00 -1.27 0.00 0.00 60.65 59.53 1s1p h LYS 246 Cb -0.07 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 31.61 1s1p h LYS 246 CO -0.05 0.64 0.42 -0.22 -2.27 0.00 0.00 179.45 177.96 1s1p h LYS 247 N 0.43 0.72 -0.02 1.90 3.64 -0.70 -2.59 116.57 119.95 1s1p h LYS 247 Ca 0.11 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1s1p h LYS 247 Cb 0.32 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1s1p h LYS 247 CO 0.00 0.48 -0.06 0.72 -2.27 0.00 0.00 179.45 178.32 1s1p n HIS 248 N -4.76 0.00 -3.87 1.91 8.25 -0.52 -4.95 115.22 111.28 1s1p n HIS 248 Ca 0.10 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.32 1s1p n HIS 248 Cb 0.21 -0.01 -0.00 0.00 1.12 0.00 0.00 29.99 31.30 1s1p n HIS 248 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1s1p n LYS 249 N 0.44 -3.49 0.00 -0.41 5.02 0.13 -4.99 118.16 114.85 1s1p n LYS 249 Ca 0.16 0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.91 1s1p n LYS 249 Cb 0.44 -4.64 0.00 0.00 -0.02 0.00 0.00 35.03 30.81 1s1p n LYS 249 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1s1p n ARG 250 N -4.35 2.83 -4.21 1.97 5.12 -0.00 -5.03 116.66 112.98 1s1p n ARG 250 Ca -0.29 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.49 1s1p n ARG 250 Cb 0.68 0.00 -0.10 0.00 -1.16 0.00 0.00 32.46 31.87 1s1p n ARG 250 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1s1p s THR 251 N 2.23 0.99 0.31 0.55 -4.23 -1.26 -4.63 115.64 109.59 1s1p s THR 251 Ca 0.00 -1.90 0.03 0.00 -1.18 0.00 0.00 61.69 58.64 1s1p s THR 251 Cb 0.00 -1.65 0.29 0.00 1.34 0.00 0.00 72.50 72.48 1s1p s THR 251 CO 0.00 -0.71 1.87 -0.65 -0.54 0.00 0.00 174.62 174.59 1s1p h PRO 252 N 3.07 0.91 -0.38 3.99 0.11 -1.89 -1.54 132.00 136.27 1s1p h PRO 252 Ca -0.36 -0.05 0.01 0.00 0.11 0.00 0.00 66.00 65.70 1s1p h PRO 252 Cb 1.18 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 1s1p h PRO 252 CO 0.60 0.60 0.25 0.00 -0.21 0.00 0.00 178.00 179.24 1s1p h ALA 253 N 1.54 0.49 -0.66 -0.75 0.00 -1.93 -1.38 119.26 116.56 1s1p h ALA 253 Ca 0.45 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 1s1p h ALA 253 Cb 0.44 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 1s1p h ALA 253 CO -0.21 -0.06 0.29 -0.07 0.00 0.00 0.00 179.25 179.20 1s1p h LEU 254 N 0.51 0.86 -0.42 0.00 3.38 -1.73 -0.94 115.31 116.98 1s1p h LEU 254 Ca 0.14 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1s1p h LEU 254 Cb -0.05 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1s1p h LEU 254 CO -0.04 0.75 0.23 0.40 0.09 0.00 0.00 178.44 179.88 1s1p h ILE 255 N 0.94 1.16 -0.50 1.22 1.08 -0.96 -0.41 117.51 120.04 1s1p h ILE 255 Ca 0.23 -0.41 -0.06 0.00 -0.39 0.00 0.00 64.86 64.23 1s1p h ILE 255 Cb 0.14 0.66 -0.02 0.00 -3.07 0.00 0.00 36.82 34.53 1s1p h ILE 255 CO -0.02 0.16 0.06 0.00 -0.69 0.00 0.00 178.15 177.66 1s1p h ALA 256 N 1.08 1.18 -0.19 1.87 0.00 -0.70 -0.98 119.26 121.52 1s1p h ALA 256 Ca 0.15 -0.23 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1s1p h ALA 256 Cb 0.06 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1s1p h ALA 256 CO -0.02 0.55 -0.37 -0.07 0.00 0.00 0.00 179.25 179.33 1s1p h LEU 257 N 0.75 0.66 -0.92 0.00 3.38 -1.00 -3.21 115.31 114.97 1s1p h LEU 257 Ca 0.16 -0.55 -0.06 0.00 0.09 0.00 0.00 57.88 57.52 1s1p h LEU 257 Cb 0.37 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1s1p h LEU 257 CO 0.01 1.08 0.11 -0.09 0.09 0.00 0.00 178.44 179.64 1s1p h ARG 258 N 0.26 0.91 -0.59 1.13 9.65 -0.84 -2.26 114.38 122.65 1s1p h ARG 258 Ca 0.01 -0.21 0.11 0.00 -1.10 0.00 0.00 59.98 58.79 1s1p h ARG 258 Cb 0.97 -0.12 -0.09 0.00 -1.39 0.00 0.00 29.97 29.33 1s1p h ARG 258 CO 0.08 0.83 0.09 -0.92 2.80 0.00 0.00 179.97 182.85 1s1p h TYR 259 N 0.86 0.13 -0.27 2.20 3.20 -1.22 -1.54 116.97 120.33 1s1p h TYR 259 Ca 0.18 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 62.05 1s1p h TYR 259 Cb 0.35 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 1s1p h TYR 259 CO 0.02 -0.07 0.01 1.96 -1.64 0.00 0.00 178.16 178.45 1s1p h GLN 260 N 0.21 0.47 -1.01 1.82 1.08 -1.42 -2.93 115.11 113.34 1s1p h GLN 260 Ca 0.31 -0.14 0.06 0.00 -1.45 0.00 0.00 58.65 57.42 1s1p h GLN 260 Cb 0.47 -0.05 -0.06 0.00 -0.05 0.00 0.00 27.48 27.79 1s1p h GLN 260 CO -0.43 0.62 0.65 -0.07 -0.95 0.00 0.00 178.83 178.66 1s1p h LEU 261 N 0.27 1.06 -0.52 1.46 3.38 -1.04 -1.23 115.31 118.68 1s1p h LEU 261 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1s1p h LEU 261 Cb 0.40 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1s1p h LEU 261 CO 0.01 0.69 0.00 0.00 0.09 0.00 0.00 178.44 179.23 1s1p n GLN 262 N -4.48 0.21 -0.01 1.13 6.02 -0.63 -1.69 117.38 117.93 1s1p n GLN 262 Ca 0.15 0.37 0.13 0.00 -0.01 0.00 0.00 57.00 57.64 1s1p n GLN 262 Cb 0.16 -1.85 0.37 0.00 1.02 0.00 0.00 30.24 29.94 1s1p n GLN 262 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1s1p n ARG 263 N -2.24 1.90 -0.90 -1.09 1.74 -0.55 -4.93 116.66 110.58 1s1p n ARG 263 Ca 0.03 -1.31 0.00 0.00 -0.77 0.00 0.00 57.85 55.80 1s1p n ARG 263 Cb 0.28 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.25 1s1p n ARG 263 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1s1p n GLY 264 N 1.24 0.44 3.82 -0.13 0.00 -0.68 -5.05 105.19 104.83 1s1p n GLY 264 Ca 0.17 -0.99 -0.37 0.00 0.00 0.00 0.00 46.02 44.83 1s1p n GLY 264 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1s1p s VAL 265 N -2.00 5.26 0.05 1.61 1.01 -0.68 -4.73 120.40 120.92 1s1p s VAL 265 Ca 0.00 0.56 -0.26 0.00 0.00 0.00 0.00 61.98 62.28 1s1p s VAL 265 Cb 0.00 -3.59 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1s1p s VAL 265 CO 0.00 0.53 0.82 -0.69 0.00 0.00 0.00 175.10 175.77 1s1p s VAL 266 N -0.58 4.70 -0.06 2.92 1.01 -0.67 -3.75 120.40 123.96 1s1p s VAL 266 Ca 0.19 1.76 0.05 0.00 0.00 0.00 0.00 61.98 63.98 1s1p s VAL 266 Cb -0.14 -4.17 -0.01 0.00 0.00 0.00 0.00 36.38 32.06 1s1p s VAL 266 CO 0.08 0.33 -0.22 0.54 0.00 0.00 0.00 175.10 175.83 1s1p s VAL 267 N 0.07 1.86 0.24 2.92 0.11 -0.28 -0.33 120.40 124.98 1s1p s VAL 267 Ca 0.41 -0.95 -0.01 0.00 -2.93 0.00 0.00 61.98 58.50 1s1p s VAL 267 Cb -0.21 -1.59 -0.04 0.00 -1.53 0.00 0.00 36.38 33.01 1s1p s VAL 267 CO 0.25 0.52 0.44 -0.76 -3.33 0.00 0.00 175.10 172.21 1s1p s LEU 268 N -0.01 4.18 -0.17 2.54 1.43 -0.68 -0.78 118.68 125.19 1s1p s LEU 268 Ca -0.06 0.44 -0.04 0.00 -1.03 0.00 0.00 54.13 53.44 1s1p s LEU 268 Cb -0.14 -3.23 0.08 0.00 0.03 0.00 0.00 46.19 42.93 1s1p s LEU 268 CO 0.04 -0.10 0.27 0.00 0.23 0.00 0.00 176.35 176.79 1s1p s ALA 269 N -1.97 -0.56 -0.09 4.21 0.00 -0.18 -4.49 121.76 118.69 1s1p s ALA 269 Ca 0.39 0.74 -0.18 0.00 0.00 0.00 0.00 51.96 52.91 1s1p s ALA 269 Cb -0.11 -1.21 -0.05 0.00 0.00 0.00 0.00 23.12 21.76 1s1p s ALA 269 CO 0.30 -0.90 0.49 0.21 0.00 0.00 0.00 175.76 175.86 1s1p s LYS 270 N 2.41 4.29 -0.14 0.00 2.36 -1.26 -1.50 119.74 125.90 1s1p s LYS 270 Ca 0.04 0.50 -0.11 0.00 -2.55 0.00 0.00 55.97 53.85 1s1p s LYS 270 Cb -0.14 -3.40 0.04 0.00 -1.05 0.00 0.00 37.83 33.29 1s1p s LYS 270 CO -0.11 0.25 0.36 0.45 1.55 0.00 0.00 175.35 177.85 1s1p s SER 271 N 0.30 -0.40 -0.20 1.43 0.15 -1.26 -4.94 113.70 108.79 1s1p s SER 271 Ca 0.27 0.75 0.16 0.00 0.70 0.00 0.00 55.95 57.82 1s1p s SER 271 Cb -0.16 0.71 0.61 0.00 -1.71 0.00 0.00 66.02 65.48 1s1p s SER 271 CO 0.12 -0.15 1.52 -1.22 1.20 0.00 0.00 173.24 174.71 1s1p n TYR 272 N 3.34 1.27 -4.48 3.44 4.02 -1.26 -4.82 117.16 118.68 1s1p n TYR 272 Ca -0.17 -0.84 -0.34 0.00 -0.01 0.00 0.00 57.90 56.54 1s1p n TYR 272 Cb 0.56 -0.37 -0.14 0.00 -0.02 0.00 0.00 39.34 39.37 1s1p n TYR 272 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1s1p s ASN 273 N -1.62 4.06 0.23 7.72 3.84 -1.26 -4.98 114.94 122.93 1s1p s ASN 273 Ca 0.46 -0.36 -0.07 0.00 0.21 0.00 0.00 52.86 53.10 1s1p s ASN 273 Cb 0.36 -1.64 0.28 0.00 -0.55 0.00 0.00 41.25 39.71 1s1p s ASN 273 CO 0.11 0.10 1.83 -0.08 -2.79 0.00 0.00 177.10 176.27 1s1p h GLU 274 N 7.17 0.82 -0.40 0.43 4.81 -1.99 -0.44 114.58 124.98 1s1p h GLU 274 Ca -0.32 -0.05 -0.06 0.00 -0.13 0.00 0.00 59.36 58.80 1s1p h GLU 274 Cb 1.19 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 30.37 1s1p h GLU 274 CO 0.58 0.54 0.00 1.96 -0.73 0.00 0.00 179.01 181.37 1s1p h GLN 275 N 0.85 0.71 -0.19 1.92 4.20 -2.00 -2.61 115.11 117.98 1s1p h GLN 275 Ca 0.34 -0.22 -0.14 0.00 0.06 0.00 0.00 58.65 58.68 1s1p h GLN 275 Cb 0.16 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 1s1p h GLN 275 CO -0.17 0.79 -0.48 0.00 -0.67 0.00 0.00 178.83 178.30 1s1p h ARG 276 N 0.54 0.50 -0.39 1.46 3.08 -1.87 -0.77 114.38 116.94 1s1p h ARG 276 Ca 0.11 -0.29 0.04 0.00 0.07 0.00 0.00 59.98 59.92 1s1p h ARG 276 Cb 0.47 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.50 1s1p h ARG 276 CO 0.02 0.88 0.15 0.82 -1.07 0.00 0.00 179.97 180.76 1s1p h ILE 277 N 0.40 0.90 -0.30 2.04 2.04 -1.02 -0.72 117.51 120.85 1s1p h ILE 277 Ca 0.02 -0.11 -0.11 0.00 1.00 0.00 0.00 64.86 65.66 1s1p h ILE 277 Cb 0.99 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.63 1s1p h ILE 277 CO 0.09 0.06 -0.29 0.03 0.00 0.00 0.00 178.15 178.04 1s1p h ARG 278 N 0.31 0.61 -0.75 2.37 3.08 -1.25 -3.05 114.38 115.69 1s1p h ARG 278 Ca 0.17 -0.26 -0.05 0.00 0.07 0.00 0.00 59.98 59.92 1s1p h ARG 278 Cb 0.14 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 1s1p h ARG 278 CO -0.17 0.83 0.28 0.37 -1.07 0.00 0.00 179.97 180.22 1s1p h GLN 279 N 0.52 1.13 0.00 0.04 4.15 -0.58 -3.18 115.11 117.19 1s1p h GLN 279 Ca 0.07 -0.22 -0.03 0.00 0.77 0.00 0.00 58.65 59.24 1s1p h GLN 279 Cb 0.77 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 28.27 1s1p h GLN 279 CO 0.06 0.93 -0.13 -0.91 -1.93 0.00 0.00 178.83 176.86 1s1p h ASN 280 N 1.09 0.00 0.55 -0.69 2.35 -1.03 -0.53 115.58 117.32 1s1p h ASN 280 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1s1p h ASN 280 Cb 0.24 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.61 1s1p h ASN 280 CO -0.02 0.13 0.00 1.33 -1.65 0.00 0.00 177.43 177.22 1s1p n VAL 281 N -4.06 0.97 0.90 2.81 0.24 -1.20 -2.48 118.33 115.51 1s1p n VAL 281 Ca -0.02 0.25 0.08 0.00 -2.04 0.00 0.00 64.34 62.61 1s1p n VAL 281 Cb 0.21 -1.05 0.45 0.00 -1.47 0.00 0.00 33.84 31.98 1s1p n VAL 281 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1s1p n GLN 282 N -1.70 0.37 0.24 7.34 6.02 -0.21 -3.30 117.38 126.14 1s1p n GLN 282 Ca 0.03 0.07 0.17 0.00 -0.01 0.00 0.00 57.00 57.26 1s1p n GLN 282 Cb 0.18 -1.50 0.87 0.00 1.02 0.00 0.00 30.24 30.82 1s1p n GLN 282 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.06 175.81 1s1p h VAL 283 N 0.00 0.39 -0.00 5.09 3.04 -1.69 -0.03 116.25 123.05 1s1p h VAL 283 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1s1p h VAL 283 Cb 0.08 0.85 0.00 0.00 -2.01 0.00 0.00 31.29 30.21 1s1p h VAL 283 CO 0.00 0.00 -0.08 0.49 -1.01 0.00 0.00 177.57 176.97 1s1p n PHE 284 N -3.66 0.00 1.17 3.17 3.72 -1.21 -4.11 117.46 116.54 1s1p n PHE 284 Ca 0.00 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.53 1s1p n PHE 284 Cb 0.28 -0.15 0.26 0.00 -0.94 0.00 0.00 39.48 38.93 1s1p n PHE 284 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1s1p n GLU 285 N -0.89 0.89 -4.03 -1.08 1.02 -0.02 -4.97 120.64 111.56 1s1p n GLU 285 Ca 0.16 -0.60 -0.10 0.00 -0.02 0.00 0.00 57.16 56.60 1s1p n GLU 285 Cb 0.26 -1.49 -0.05 0.00 -0.02 0.00 0.00 31.44 30.14 1s1p n GLU 285 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1s1p s PHE 286 N -2.53 0.54 0.10 -0.32 -0.12 -1.26 -5.18 117.98 109.22 1s1p s PHE 286 Ca 0.22 -0.88 0.04 0.00 -0.05 0.00 0.00 56.93 56.26 1s1p s PHE 286 Cb 0.19 0.09 -0.04 0.00 -0.63 0.00 0.00 43.02 42.63 1s1p s PHE 286 CO 0.55 -0.99 -0.11 -0.65 -0.05 0.00 0.00 175.22 173.97 1s1p s GLN 287 N -3.86 0.86 -0.05 1.99 -0.21 -1.26 -5.03 119.66 112.11 1s1p s GLN 287 Ca 0.25 -1.15 -0.03 0.00 0.02 0.00 0.00 55.36 54.45 1s1p s GLN 287 Cb 0.00 -0.60 -0.04 0.00 1.00 0.00 0.00 33.01 33.37 1s1p s GLN 287 CO 0.11 0.10 0.13 -0.51 -2.12 0.00 0.00 175.29 173.00 1s1p s LEU 288 N -2.37 4.21 0.82 2.90 1.43 -1.26 -5.10 118.68 119.30 1s1p s LEU 288 Ca 0.05 0.32 -0.11 0.00 -1.03 0.00 0.00 54.13 53.36 1s1p s LEU 288 Cb -0.04 -2.31 0.11 0.00 0.03 0.00 0.00 46.19 43.98 1s1p s LEU 288 CO 0.01 0.32 1.17 0.42 0.23 0.00 0.00 176.35 178.49 1s1p s THR 289 N -1.17 2.08 0.25 5.49 -4.23 -1.26 -4.85 115.64 111.94 1s1p s THR 289 Ca 0.21 -0.10 -0.05 0.00 -1.18 0.00 0.00 61.69 60.58 1s1p s THR 289 Cb -0.12 -2.97 0.25 0.00 1.34 0.00 0.00 72.50 71.00 1s1p s THR 289 CO 0.12 0.00 1.90 0.00 -0.54 0.00 0.00 174.62 176.10 1s1p h ALA 290 N -1.07 1.30 -0.40 3.99 0.00 -1.99 -0.56 119.26 120.52 1s1p h ALA 290 Ca -0.45 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.30 1s1p h ALA 290 Cb 1.30 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1s1p h ALA 290 CO 0.56 0.51 -0.24 0.93 0.00 0.00 0.00 179.25 181.01 1s1p h GLU 291 N 1.22 0.82 -0.39 0.00 3.07 -1.99 -0.44 114.58 116.87 1s1p h GLU 291 Ca 0.39 -0.34 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 1s1p h GLU 291 Cb 0.02 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.88 1s1p h GLU 291 CO -0.13 0.97 0.25 -0.44 -1.40 0.00 0.00 179.01 178.27 1s1p h ASP 292 N 0.70 0.46 -0.79 1.42 3.45 -1.76 -1.31 116.42 118.60 1s1p h ASP 292 Ca 0.09 -0.02 -0.04 0.00 0.43 0.00 0.00 57.03 57.49 1s1p h ASP 292 Cb 0.77 -0.11 -0.04 0.00 -0.56 0.00 0.00 39.33 39.39 1s1p h ASP 292 CO 0.06 0.35 0.35 0.24 -1.57 0.00 0.00 179.24 178.67 1s1p h MET 293 N 0.53 1.17 -0.62 3.56 2.86 -0.82 -1.55 114.93 120.06 1s1p h MET 293 Ca 0.14 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1s1p h MET 293 Cb -0.04 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.39 1s1p h MET 293 CO -0.03 0.92 0.23 -0.22 1.06 0.00 0.00 176.91 178.87 1s1p h LYS 294 N 1.15 0.95 -0.76 1.72 3.64 -0.82 0.30 116.57 122.75 1s1p h LYS 294 Ca 0.27 -0.19 0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1s1p h LYS 294 Cb 0.17 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 1s1p h LYS 294 CO -0.03 0.82 0.50 0.00 -2.27 0.00 0.00 179.45 178.47 1s1p h ALA 295 N 1.08 0.97 -0.43 5.00 0.00 -0.73 -1.61 119.26 123.54 1s1p h ALA 295 Ca 0.21 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 1s1p h ALA 295 Cb 0.24 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1s1p h ALA 295 CO -0.01 0.36 -0.21 0.82 0.00 0.00 0.00 179.25 180.21 1s1p h ILE 296 N 1.02 1.27 -0.21 0.00 2.04 -0.98 -2.60 117.51 118.05 1s1p h ILE 296 Ca 0.28 -1.36 0.06 0.00 1.00 0.00 0.00 64.86 64.84 1s1p h ILE 296 Cb -0.10 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1s1p h ILE 296 CO -0.07 0.46 0.15 0.44 0.00 0.00 0.00 178.15 179.13 1s1p h ASP 297 N 0.74 0.00 0.51 1.72 3.32 -0.56 -1.28 116.42 120.87 1s1p h ASP 297 Ca 0.10 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 1s1p h ASP 297 Cb 0.78 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.32 1s1p h ASP 297 CO 0.06 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.19 1s1p n GLY 298 N -1.58 -1.07 0.05 2.75 0.00 -0.64 -2.69 105.19 102.01 1s1p n GLY 298 Ca 0.02 0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.22 1s1p n GLY 298 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s1p n LEU 299 N -1.92 0.46 -4.66 0.99 4.77 -0.48 -4.90 117.00 111.25 1s1p n LEU 299 Ca 0.02 0.47 -0.47 0.00 -0.03 0.00 0.00 56.01 56.00 1s1p n LEU 299 Cb 0.17 -0.37 -0.05 0.00 -2.33 0.00 0.00 43.42 40.84 1s1p n LEU 299 CO 0.15 -0.08 1.21 -0.67 -1.33 0.00 0.00 177.39 176.68 1s1p n ASP 300 N -1.89 2.98 -0.88 -1.43 2.03 -0.84 -4.39 116.55 112.13 1s1p n ASP 300 Ca 0.06 1.07 -0.01 0.00 0.52 0.00 0.00 54.79 56.43 1s1p n ASP 300 Cb 0.39 -1.39 -0.01 0.00 -0.72 0.00 0.00 41.12 39.39 1s1p n ASP 300 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1s1p n ARG 301 N 3.90 0.00 -3.65 -0.67 1.85 -0.49 -4.98 116.66 112.62 1s1p n ARG 301 Ca 0.18 -1.00 -0.27 0.00 -1.00 0.00 0.00 57.85 55.76 1s1p n ARG 301 Cb 0.28 0.02 0.03 0.00 -1.05 0.00 0.00 32.46 31.73 1s1p n ARG 301 CO 0.00 0.00 0.00 -1.71 -0.01 0.00 0.00 177.63 175.91 1s1p n ASN 302 N 0.12 -4.93 -4.30 2.89 5.15 -0.80 -4.93 115.26 108.45 1s1p n ASN 302 Ca -0.06 -0.61 -0.46 0.00 -0.60 0.00 0.00 54.58 52.86 1s1p n ASN 302 Cb 0.76 -3.96 -0.05 0.00 -0.53 0.00 0.00 39.78 36.01 1s1p n ASN 302 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1s1p s LEU 303 N -7.04 6.29 -0.28 1.20 0.20 -0.60 -5.00 118.68 113.45 1s1p s LEU 303 Ca 0.56 -2.08 -0.20 0.00 0.69 0.00 0.00 54.13 53.10 1s1p s LEU 303 Cb -0.28 -2.19 -0.01 0.00 -0.43 0.00 0.00 46.19 43.28 1s1p s LEU 303 CO 0.69 -0.75 0.62 -1.38 -0.29 0.00 0.00 176.35 175.23 1s1p s HIS 304 N 1.14 3.25 0.21 5.38 -3.43 -1.26 -4.30 115.29 116.27 1s1p s HIS 304 Ca 0.08 0.68 -0.09 0.00 -0.80 0.00 0.00 55.06 54.93 1s1p s HIS 304 Cb -0.24 -2.91 0.17 0.00 -1.43 0.00 0.00 32.58 28.17 1s1p s HIS 304 CO -0.01 -0.40 1.85 1.88 -2.00 0.00 0.00 174.74 176.06 1s1p h TYR 305 N 8.05 1.06 -3.09 0.38 0.05 -1.94 -3.37 116.97 118.11 1s1p h TYR 305 Ca -0.27 -0.01 -0.57 0.00 0.05 0.00 0.00 58.73 57.93 1s1p h TYR 305 Cb 1.12 -0.34 -0.04 0.00 1.01 0.00 0.00 36.73 38.47 1s1p h TYR 305 CO 0.76 0.72 1.13 -0.06 -1.05 0.00 0.00 178.16 179.65 1s1p s PHE 306 N -5.94 2.23 -0.50 4.88 0.40 -1.26 -4.10 117.98 113.69 1s1p s PHE 306 Ca -0.13 0.66 0.07 0.00 -0.60 0.00 0.00 56.93 56.92 1s1p s PHE 306 Cb 0.15 -4.24 0.19 0.00 0.51 0.00 0.00 43.02 39.63 1s1p s PHE 306 CO 0.80 -2.29 0.67 1.21 0.70 0.00 0.00 175.22 176.32 1s1p s ASN 307 N 4.50 -1.08 0.06 1.36 2.47 -0.08 -5.03 114.94 117.14 1s1p s ASN 307 Ca 0.67 -1.85 0.05 0.00 0.42 0.00 0.00 52.86 52.14 1s1p s ASN 307 Cb -0.17 1.60 -0.03 0.00 -1.45 0.00 0.00 41.25 41.21 1s1p s ASN 307 CO 0.33 -0.07 -0.14 -0.55 -3.72 0.00 0.00 177.10 172.94 1s1p s SER 308 N 0.82 1.66 0.31 -4.21 0.15 -1.25 -4.73 113.70 106.45 1s1p s SER 308 Ca 0.30 -0.55 0.06 0.00 0.70 0.00 0.00 55.95 56.46 1s1p s SER 308 Cb 0.00 -0.07 0.73 0.00 -1.71 0.00 0.00 66.02 64.97 1s1p s SER 308 CO -0.07 -0.03 1.81 0.44 1.20 0.00 0.00 173.24 176.59 1s1p h ASP 309 N 4.57 0.78 -1.41 5.45 3.45 -1.95 -0.30 116.42 127.01 1s1p h ASP 309 Ca -0.40 0.07 0.47 0.00 0.43 0.00 0.00 57.03 57.61 1s1p h ASP 309 Cb 1.19 -0.07 -0.12 0.00 -0.56 0.00 0.00 39.33 39.76 1s1p h ASP 309 CO 0.42 0.33 0.92 -1.20 -1.57 0.00 0.00 179.24 178.14 1s1p n SER 310 N -4.69 0.17 0.00 6.45 7.64 -1.26 -2.38 113.62 119.55 1s1p n SER 310 Ca 0.21 1.27 0.00 0.00 1.01 0.00 0.00 58.87 61.36 1s1p n SER 310 Cb 0.52 -0.62 0.00 0.00 -1.01 0.00 0.00 64.21 63.10 1s1p n SER 310 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 1s1p n PHE 311 N -4.50 0.00 0.31 1.43 1.16 -1.04 -2.66 117.46 112.15 1s1p n PHE 311 Ca 0.39 0.00 0.20 0.00 -1.87 0.00 0.00 57.45 56.17 1s1p n PHE 311 Cb 1.57 0.00 0.98 0.00 -1.61 0.00 0.00 39.48 40.41 1s1p n PHE 311 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1s1p h ALA 312 N 0.00 1.00 -0.05 1.98 0.00 -0.68 -1.17 119.26 120.34 1s1p h ALA 312 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1s1p h ALA 312 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1s1p h ALA 312 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.12 1s1p n SER 313 N -3.06 2.32 -4.75 0.00 3.41 -1.23 -4.91 113.62 105.40 1s1p n SER 313 Ca -0.01 -1.77 -0.41 0.00 -0.26 0.00 0.00 58.87 56.42 1s1p n SER 313 Cb 0.17 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.07 1s1p n SER 313 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1s1p s HIS 314 N -1.96 3.25 0.55 7.33 5.04 -0.44 -4.91 115.29 124.16 1s1p s HIS 314 Ca 0.33 1.41 0.28 0.00 -1.54 0.00 0.00 55.06 55.53 1s1p s HIS 314 Cb 0.20 -3.56 1.46 0.00 0.04 0.00 0.00 32.58 30.73 1s1p s HIS 314 CO 0.31 -1.56 1.96 -1.35 -2.34 0.00 0.00 174.74 171.77 1s1p h PRO 315 N 4.27 0.00 -0.44 2.88 0.11 -1.92 -1.45 132.00 135.44 1s1p h PRO 315 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1s1p h PRO 315 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1s1p h PRO 315 CO 0.70 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.58 1s1p n ASN 316 N -4.13 4.40 -4.67 -2.05 3.02 -1.26 -4.99 115.26 105.58 1s1p n ASN 316 Ca 0.10 -2.73 -0.49 0.00 -0.03 0.00 0.00 54.58 51.44 1s1p n ASN 316 Cb 0.65 -0.54 -0.05 0.00 -0.61 0.00 0.00 39.78 39.23 1s1p n ASN 316 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1s1p n TYR 317 N 0.28 2.20 0.43 3.10 9.36 -0.55 -4.57 117.16 127.41 1s1p n TYR 317 Ca 0.23 0.21 0.13 0.00 3.32 0.00 0.00 57.90 61.79 1s1p n TYR 317 Cb 0.90 -2.57 0.39 0.00 -0.63 0.00 0.00 39.34 37.43 1s1p n TYR 317 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1s1p h PRO 318 N 7.34 0.00 -6.36 2.98 0.13 -1.91 -3.46 132.00 130.72 1s1p h PRO 318 Ca -0.47 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.12 1s1p h PRO 318 Cb 1.28 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 1s1p h PRO 318 CO 0.91 0.00 -0.21 0.71 -0.23 0.00 0.00 178.00 179.18 1s1p s TYR 319 N -3.24 3.47 0.00 1.56 2.02 -1.26 -4.70 117.35 115.20 1s1p s TYR 319 Ca 0.07 0.62 0.00 0.00 -0.37 0.00 0.00 57.07 57.39 1s1p s TYR 319 Cb 0.09 -2.07 0.00 0.00 -0.40 0.00 0.00 41.96 39.58 1s1p s TYR 319 CO 0.58 0.28 0.04 -1.13 -1.57 0.00 0.00 175.55 173.75