#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r1d s PRO 6 N 0.00 1.75 0.06 0.54 0.04 -1.26 -5.06 135.00 131.06 1r1d s PRO 6 Ca 0.00 1.69 -0.00 0.00 0.04 0.00 0.00 61.00 62.72 1r1d s PRO 6 Cb 0.00 -1.80 -0.04 0.00 0.04 0.00 0.00 34.50 32.71 1r1d s PRO 6 CO 0.00 -2.12 -0.04 0.15 0.04 0.00 0.00 177.00 175.04 1r1d s LYS 7 N -4.19 0.62 0.94 4.56 1.02 -1.26 -4.96 119.74 116.47 1r1d s LYS 7 Ca 0.72 -1.18 -0.10 0.00 0.02 0.00 0.00 55.97 55.42 1r1d s LYS 7 Cb -0.27 0.12 0.16 0.00 -0.52 0.00 0.00 37.83 37.32 1r1d s LYS 7 CO 0.50 -0.09 1.13 -2.14 -0.92 0.00 0.00 175.35 173.84 1r1d s PRO 8 N -3.67 0.83 0.05 -1.68 0.02 -1.26 -4.76 135.00 124.53 1r1d s PRO 8 Ca 0.06 1.46 0.01 0.00 0.02 0.00 0.00 61.00 62.54 1r1d s PRO 8 Cb 0.06 -1.71 -0.03 0.00 0.02 0.00 0.00 34.50 32.83 1r1d s PRO 8 CO -0.08 -2.73 -0.05 -0.59 -0.33 0.00 0.00 177.00 173.21 1r1d s PHE 9 N -2.64 0.61 -0.20 6.54 -0.12 -0.78 -4.98 117.98 116.41 1r1d s PHE 9 Ca 0.67 -0.74 -0.04 0.00 -0.05 0.00 0.00 56.93 56.76 1r1d s PHE 9 Cb -0.23 -0.38 0.08 0.00 -0.63 0.00 0.00 43.02 41.86 1r1d s PHE 9 CO 0.59 -0.19 0.17 0.12 -0.05 0.00 0.00 175.22 175.85 1r1d s PHE 10 N -2.56 -0.06 -0.44 3.49 5.36 -1.26 -1.24 117.98 121.27 1r1d s PHE 10 Ca -0.02 -0.07 -0.09 0.00 -0.96 0.00 0.00 56.93 55.79 1r1d s PHE 10 Cb -0.02 -0.53 0.09 0.00 -0.34 0.00 0.00 43.02 42.23 1r1d s PHE 10 CO -0.04 -0.59 0.29 -0.06 -1.46 0.00 0.00 175.22 173.36 1r1d s PHE 11 N 2.24 3.38 -0.07 10.12 2.99 0.13 -4.97 117.98 131.79 1r1d s PHE 11 Ca 0.05 -1.69 -0.29 0.00 0.00 0.00 0.00 56.93 55.00 1r1d s PHE 11 Cb -0.16 -3.16 -0.02 0.00 0.00 0.00 0.00 43.02 39.68 1r1d s PHE 11 CO -0.13 -0.91 0.98 -1.21 -0.00 0.00 0.00 175.22 173.95 1r1d s GLU 12 N 1.39 4.46 0.00 0.44 2.02 -1.26 -0.61 118.70 125.15 1r1d s GLU 12 Ca 0.04 1.37 0.00 0.00 0.02 0.00 0.00 54.97 56.41 1r1d s GLU 12 Cb -0.24 -3.51 0.00 0.00 0.10 0.00 0.00 34.13 30.48 1r1d s GLU 12 CO 0.01 -0.22 0.00 0.00 0.02 0.00 0.00 175.26 175.07 1r1d n ALA 13 N 4.61 0.00 -1.51 5.21 0.00 -1.26 -4.93 120.51 122.62 1r1d n ALA 13 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1r1d n ALA 13 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1r1d n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1r1d n GLY 14 N 0.58 -0.16 0.22 0.00 0.00 -0.45 -4.82 105.19 100.56 1r1d n GLY 14 Ca 0.00 -1.79 0.11 0.00 0.00 0.00 0.00 46.02 44.34 1r1d n GLY 14 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1r1d h GLU 15 N 0.00 0.00 -6.17 1.61 4.11 -2.00 -3.36 114.58 108.77 1r1d h GLU 15 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.86 1r1d h GLU 15 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1r1d h GLU 15 CO 0.00 0.16 0.90 1.03 0.07 0.00 0.00 179.01 181.17 1r1d s ARG 16 N -3.44 4.18 0.06 1.06 0.52 -1.26 -4.64 118.95 115.43 1r1d s ARG 16 Ca 0.03 1.54 0.05 0.00 -0.52 0.00 0.00 55.73 56.83 1r1d s ARG 16 Cb 0.08 -3.76 -0.04 0.00 0.52 0.00 0.00 34.95 31.75 1r1d s ARG 16 CO 0.64 -0.77 -0.06 0.00 0.02 0.00 0.00 175.30 175.13 1r1d s ALA 17 N 3.60 3.06 -0.07 2.13 0.00 -1.20 -1.03 121.76 128.26 1r1d s ALA 17 Ca 0.53 -1.12 -0.00 0.00 0.00 0.00 0.00 51.96 51.37 1r1d s ALA 17 Cb -0.20 -1.06 0.02 0.00 0.00 0.00 0.00 23.12 21.88 1r1d s ALA 17 CO 0.15 0.64 -0.03 0.08 0.00 0.00 0.00 175.76 176.60 1r1d s VAL 18 N -1.14 0.60 -0.11 0.00 1.01 0.03 -1.11 120.40 119.69 1r1d s VAL 18 Ca 0.20 -0.07 -0.21 0.00 0.00 0.00 0.00 61.98 61.91 1r1d s VAL 18 Cb -0.11 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.55 1r1d s VAL 18 CO 0.12 0.28 0.61 -0.22 0.00 0.00 0.00 175.10 175.89 1r1d s LEU 19 N 1.55 4.26 -0.23 3.92 2.96 0.14 -2.18 118.68 129.10 1r1d s LEU 19 Ca -0.00 0.99 -0.05 0.00 -0.22 0.00 0.00 54.13 54.84 1r1d s LEU 19 Cb -0.13 -2.91 -0.01 0.00 0.50 0.00 0.00 46.19 43.64 1r1d s LEU 19 CO -0.04 -0.11 -0.01 -0.76 -1.32 0.00 0.00 176.35 174.11 1r1d s LEU 20 N 0.99 3.09 -0.17 -0.68 1.43 0.17 -1.43 118.68 122.09 1r1d s LEU 20 Ca 0.32 -0.38 -0.02 0.00 -1.03 0.00 0.00 54.13 53.01 1r1d s LEU 20 Cb -0.16 -1.79 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 1r1d s LEU 20 CO 0.14 -0.04 -0.08 -0.76 0.23 0.00 0.00 176.35 175.84 1r1d s LEU 21 N 1.51 2.90 0.88 1.79 1.43 -0.16 -4.04 118.68 122.99 1r1d s LEU 21 Ca 0.06 -0.30 -0.09 0.00 -1.03 0.00 0.00 54.13 52.76 1r1d s LEU 21 Cb -0.15 -1.69 0.18 0.00 0.03 0.00 0.00 46.19 44.57 1r1d s LEU 21 CO -0.01 0.11 1.20 -1.38 0.23 0.00 0.00 176.35 176.49 1r1d s HIS 22 N 0.72 1.36 0.58 0.29 -3.43 -1.26 -1.17 115.29 112.38 1r1d s HIS 22 Ca -0.04 -0.02 0.09 0.00 -0.80 0.00 0.00 55.06 54.29 1r1d s HIS 22 Cb -0.15 -3.67 0.09 0.00 -1.43 0.00 0.00 32.58 27.42 1r1d s HIS 22 CO 0.02 -2.36 0.76 0.41 -2.00 0.00 0.00 174.74 171.57 1r1d n GLY 23 N -3.41 2.07 3.70 -1.38 0.00 -1.12 -2.72 105.19 102.32 1r1d n GLY 23 Ca 0.16 -2.24 -0.42 0.00 0.00 0.00 0.00 46.02 43.52 1r1d n GLY 23 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1r1d s PHE 24 N -2.65 2.71 0.00 1.61 5.36 -1.26 -1.02 117.98 122.73 1r1d s PHE 24 Ca 0.57 0.48 0.00 0.00 -0.96 0.00 0.00 56.93 57.02 1r1d s PHE 24 Cb -0.05 -3.93 0.00 0.00 -0.34 0.00 0.00 43.02 38.71 1r1d s PHE 24 CO 0.36 -3.58 0.00 0.25 -1.46 0.00 0.00 175.22 170.79 1r1d n THR 25 N 4.42 0.00 -2.18 0.12 -2.24 -1.26 -4.99 114.28 108.15 1r1d n THR 25 Ca 0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.93 1r1d n THR 25 Cb 0.40 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 1r1d n THR 25 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r1d n GLY 26 N -2.00 1.31 1.69 3.38 0.00 -0.19 -4.88 105.19 104.50 1r1d n GLY 26 Ca 0.00 -2.00 -0.04 0.00 0.00 0.00 0.00 46.02 43.98 1r1d n GLY 26 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1r1d n ASN 27 N -1.80 -1.02 0.28 1.61 0.23 -1.26 -4.23 115.26 109.07 1r1d n ASN 27 Ca 0.00 -1.69 0.12 0.00 -0.53 0.00 0.00 54.58 52.48 1r1d n ASN 27 Cb 0.00 1.69 0.81 0.00 -2.08 0.00 0.00 39.78 40.20 1r1d n ASN 27 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1r1d h SER 28 N 0.89 0.00 -0.63 0.53 4.64 -1.86 -1.89 113.55 115.23 1r1d h SER 28 Ca -0.15 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.30 1r1d h SER 28 Cb 0.55 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.61 1r1d h SER 28 CO 0.19 0.01 0.43 0.00 -0.87 0.00 0.00 176.83 176.59 1r1d h ALA 29 N 1.99 2.19 0.00 5.18 0.00 -1.96 -1.47 119.26 125.18 1r1d h ALA 29 Ca -0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1r1d h ALA 29 Cb 0.03 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1r1d h ALA 29 CO 0.00 -0.35 -0.06 -0.44 0.00 0.00 0.00 179.25 178.41 1r1d h ASP 30 N 0.29 0.00 -0.02 0.00 3.32 -1.76 -2.72 116.42 115.54 1r1d h ASP 30 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 1r1d h ASP 30 Cb 0.77 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.32 1r1d h ASP 30 CO -0.07 0.06 0.00 1.33 -1.72 0.00 0.00 179.24 178.84 1r1d n VAL 31 N -3.39 1.19 0.35 -1.35 0.24 -0.62 -4.70 118.33 110.06 1r1d n VAL 31 Ca -0.02 -1.26 0.00 0.00 -2.04 0.00 0.00 64.34 61.02 1r1d n VAL 31 Cb 0.20 0.34 0.00 0.00 -1.47 0.00 0.00 33.84 32.91 1r1d n VAL 31 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 1r1d n ARG 32 N -0.65 0.35 0.00 7.34 0.63 -0.83 -1.74 116.66 121.77 1r1d n ARG 32 Ca 0.04 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 1r1d n ARG 32 Cb 0.34 -1.28 0.00 0.00 0.45 0.00 0.00 32.46 31.98 1r1d n ARG 32 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1r1d n LEU 34 N 0.66 0.00 -0.02 6.15 7.94 -1.26 -0.77 117.00 129.71 1r1d n LEU 34 Ca 0.00 0.00 -0.11 0.00 -1.11 0.00 0.00 56.01 54.79 1r1d n LEU 34 Cb 0.15 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.05 1r1d n LEU 34 CO 0.00 0.00 0.93 1.23 -1.11 0.00 0.00 177.39 178.44 1r1d h GLY 35 N 0.00 0.19 0.94 -3.96 0.00 -1.76 -0.10 103.07 98.37 1r1d h GLY 35 Ca 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.28 1r1d h GLY 35 CO 0.00 0.07 0.54 3.21 0.00 0.00 0.00 176.54 180.36 1r1d h ARG 36 N 0.18 1.04 -0.21 4.80 2.47 -1.24 0.99 114.38 122.42 1r1d h ARG 36 Ca 0.05 -0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 58.69 1r1d h ARG 36 Cb -0.02 -0.23 -0.01 0.00 -1.65 0.00 0.00 29.97 28.06 1r1d h ARG 36 CO -0.01 0.69 0.06 0.35 0.56 0.00 0.00 179.97 181.62 1r1d h PHE 37 N 1.07 0.34 -0.65 3.04 3.57 -1.72 0.31 116.94 122.90 1r1d h PHE 37 Ca 0.32 -0.04 -0.07 0.00 3.53 0.00 0.00 57.97 61.71 1r1d h PHE 37 Cb -0.05 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 1r1d h PHE 37 CO -0.02 0.42 0.12 -0.07 -2.23 0.00 0.00 178.31 176.53 1r1d h LEU 38 N 0.17 1.00 -0.34 0.59 3.38 -0.68 -2.33 115.31 117.09 1r1d h LEU 38 Ca 0.07 -0.22 0.01 0.00 0.09 0.00 0.00 57.88 57.83 1r1d h LEU 38 Cb 0.24 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1r1d h LEU 38 CO -0.00 0.99 0.20 -0.08 0.09 0.00 0.00 178.44 179.64 1r1d h GLU 39 N 0.99 0.40 0.00 1.13 4.81 -0.61 -0.21 114.58 121.10 1r1d h GLU 39 Ca 0.20 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1r1d h GLU 39 Cb 0.40 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1r1d h GLU 39 CO 0.01 0.26 0.00 0.66 -0.73 0.00 0.00 179.01 179.21 1r1d h SER 40 N 0.41 0.00 -0.30 1.04 4.64 -0.42 0.12 113.55 119.04 1r1d h SER 40 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1r1d h SER 40 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1r1d h SER 40 CO -0.06 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.19 1r1d n LYS 41 N -2.45 2.24 -0.04 4.77 4.76 -0.25 -4.97 118.16 122.22 1r1d n LYS 41 Ca -0.02 -2.07 0.00 0.00 -2.87 0.00 0.00 58.31 53.36 1r1d n LYS 41 Cb 0.04 -1.43 0.00 0.00 -1.84 0.00 0.00 35.03 31.80 1r1d n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1r1d n GLY 42 N 1.23 0.68 3.73 0.72 0.00 0.43 -5.06 105.19 106.92 1r1d n GLY 42 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1r1d n GLY 42 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1r1d s TYR 43 N -2.05 3.47 0.18 1.61 2.02 -0.27 -1.35 117.35 120.95 1r1d s TYR 43 Ca 0.00 0.64 -0.30 0.00 -0.37 0.00 0.00 57.07 57.04 1r1d s TYR 43 Cb 0.00 -2.37 -0.08 0.00 -0.40 0.00 0.00 41.96 39.11 1r1d s TYR 43 CO 0.00 0.23 1.13 0.99 -1.57 0.00 0.00 175.55 176.33 1r1d s THR 44 N 0.49 3.78 0.00 -0.71 2.01 -0.19 -3.17 115.64 117.85 1r1d s THR 44 Ca 0.18 1.52 0.04 0.00 0.31 0.00 0.00 61.69 63.74 1r1d s THR 44 Cb -0.13 -3.97 -0.01 0.00 0.01 0.00 0.00 72.50 68.40 1r1d s THR 44 CO 0.05 0.25 -0.13 0.00 -0.69 0.00 0.00 174.62 174.10 1r1d s HIS 46 N -0.42 0.62 -0.18 0.00 5.65 -0.93 0.18 115.29 120.22 1r1d s HIS 46 Ca 0.04 -0.14 -0.01 0.00 0.25 0.00 0.00 55.06 55.20 1r1d s HIS 46 Cb -0.05 -0.52 0.05 0.00 -1.18 0.00 0.00 32.58 30.87 1r1d s HIS 46 CO -0.00 -0.12 -0.03 0.00 -0.65 0.00 0.00 174.74 173.94 1r1d s ALA 47 N 0.57 1.43 0.87 1.58 0.00 -0.38 -0.66 121.76 125.18 1r1d s ALA 47 Ca -0.07 -0.86 -0.09 0.00 0.00 0.00 0.00 51.96 50.95 1r1d s ALA 47 Cb -0.10 -1.17 0.18 0.00 0.00 0.00 0.00 23.12 22.03 1r1d s ALA 47 CO -0.00 -0.92 1.12 -0.35 0.00 0.00 0.00 175.76 175.61 1r1d n PRO 48 N 4.89 -0.71 -4.62 0.00 -0.04 -1.26 -1.87 135.00 131.39 1r1d n PRO 48 Ca -0.11 -2.25 -0.26 0.00 -0.04 0.00 0.00 63.50 60.83 1r1d n PRO 48 Cb 0.47 -1.00 -0.17 0.00 -0.04 0.00 0.00 33.50 32.77 1r1d n PRO 48 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1r1d s ILE 49 N -3.39 1.32 0.50 0.52 1.01 -1.26 -4.47 121.20 115.43 1r1d s ILE 49 Ca 0.68 -0.57 -0.22 0.00 0.00 0.00 0.00 60.65 60.54 1r1d s ILE 49 Cb -0.03 -1.19 -0.06 0.00 0.01 0.00 0.00 42.46 41.19 1r1d s ILE 49 CO 0.46 0.40 1.25 -0.31 0.00 0.00 0.00 174.94 176.74 1r1d s TYR 50 N 0.72 2.60 0.47 3.97 2.02 -1.26 -4.94 117.35 120.92 1r1d s TYR 50 Ca -0.13 1.46 -0.24 0.00 -0.37 0.00 0.00 57.07 57.79 1r1d s TYR 50 Cb -0.16 -3.57 -0.08 0.00 -0.40 0.00 0.00 41.96 37.75 1r1d s TYR 50 CO 0.03 -2.15 1.28 1.17 -1.57 0.00 0.00 175.55 174.31 1r1d n LYS 51 N -0.77 1.81 -0.65 -0.62 4.81 -1.26 -1.12 118.16 120.35 1r1d n LYS 51 Ca 0.09 0.65 0.00 0.00 -0.87 0.00 0.00 58.31 58.18 1r1d n LYS 51 Cb 0.47 -2.43 0.00 0.00 0.02 0.00 0.00 35.03 33.09 1r1d n LYS 51 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1r1d n GLY 52 N 0.82 1.42 3.57 3.14 0.00 -1.26 -4.79 105.19 108.09 1r1d n GLY 52 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 1r1d n GLY 52 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1r1d s HIS 53 N -3.55 2.55 -0.44 1.61 3.76 -0.28 -3.24 115.29 115.70 1r1d s HIS 53 Ca 0.00 -0.26 0.00 0.00 -0.15 0.00 0.00 55.06 54.65 1r1d s HIS 53 Cb 0.00 -1.16 0.00 0.00 1.11 0.00 0.00 32.58 32.53 1r1d s HIS 53 CO 0.00 0.61 0.00 0.41 -0.85 0.00 0.00 174.74 174.91 1r1d n GLY 54 N -0.50 0.64 3.28 -2.22 0.00 -1.26 -4.80 105.19 100.34 1r1d n GLY 54 Ca -0.08 -0.27 -0.18 0.00 0.00 0.00 0.00 46.02 45.50 1r1d n GLY 54 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1r1d s VAL 55 N -1.91 0.09 0.55 1.61 -7.23 -1.26 -4.42 120.40 107.83 1r1d s VAL 55 Ca 0.00 -2.00 -0.20 0.00 -1.81 0.00 0.00 61.98 57.97 1r1d s VAL 55 Cb 0.00 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.38 1r1d s VAL 55 CO 0.00 0.00 1.07 -2.65 -0.31 0.00 0.00 175.10 173.21 1r1d n PRO 56 N -0.53 1.19 0.05 4.82 -0.02 -1.26 -4.88 135.00 134.36 1r1d n PRO 56 Ca 0.04 0.44 0.21 0.00 -2.02 0.00 0.00 63.50 62.17 1r1d n PRO 56 Cb 0.64 -2.23 0.73 0.00 -0.02 0.00 0.00 33.50 32.62 1r1d n PRO 56 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1r1d h PRO 57 N 0.95 0.00 -0.02 0.52 0.13 -1.92 -1.15 132.00 130.51 1r1d h PRO 57 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1r1d h PRO 57 Cb 1.34 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.47 1r1d h PRO 57 CO 0.54 0.00 0.01 0.93 -0.23 0.00 0.00 178.00 179.25 1r1d h GLU 58 N 0.00 0.00 -0.06 0.86 3.07 -1.95 -2.15 114.58 114.35 1r1d h GLU 58 Ca 0.22 0.00 -0.19 0.00 -0.50 0.00 0.00 59.36 58.90 1r1d h GLU 58 Cb 1.05 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.95 1r1d h GLU 58 CO -0.00 0.00 -0.76 0.93 -1.40 0.00 0.00 179.01 177.78 1r1d h GLU 59 N 0.00 0.36 -0.70 2.33 4.39 -1.52 -3.33 114.58 116.12 1r1d h GLU 59 Ca 0.01 -0.31 0.06 0.00 0.34 0.00 0.00 59.36 59.45 1r1d h GLU 59 Cb 0.03 0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 28.69 1r1d h GLU 59 CO -0.00 0.96 0.40 1.25 -1.16 0.00 0.00 179.01 180.46 1r1d h LEU 60 N 0.24 0.60 -0.64 1.33 5.85 -1.36 -2.95 115.31 118.39 1r1d h LEU 60 Ca -0.04 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.71 1r1d h LEU 60 Cb 1.34 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.28 1r1d h LEU 60 CO 0.13 0.38 0.00 1.33 -0.34 0.00 0.00 178.44 179.94 1r1d n VAL 61 N -4.76 1.29 0.32 1.05 0.24 -1.23 -1.10 118.33 114.14 1r1d n VAL 61 Ca 0.09 0.50 0.12 0.00 -2.04 0.00 0.00 64.34 63.01 1r1d n VAL 61 Cb 0.18 -1.44 0.22 0.00 -1.47 0.00 0.00 33.84 31.32 1r1d n VAL 61 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 1r1d n HIS 62 N -1.90 0.50 -4.39 6.34 8.25 -1.11 -4.36 115.22 118.54 1r1d n HIS 62 Ca 0.00 -0.25 -0.24 0.00 -0.26 0.00 0.00 57.72 56.97 1r1d n HIS 62 Cb 0.08 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.10 1r1d n HIS 62 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1r1d s THR 63 N -1.50 2.67 0.33 1.59 -4.23 -0.26 -5.07 115.64 109.17 1r1d s THR 63 Ca 0.39 -2.09 -0.06 0.00 -1.18 0.00 0.00 61.69 58.75 1r1d s THR 63 Cb 0.23 -2.68 0.01 0.00 1.34 0.00 0.00 72.50 71.40 1r1d s THR 63 CO 0.32 -0.27 0.50 -0.83 -0.54 0.00 0.00 174.62 173.80 1r1d s GLY 64 N -3.65 1.20 0.52 3.99 0.00 -1.26 -4.70 107.32 103.41 1r1d s GLY 64 Ca 0.33 -1.33 0.25 0.00 0.00 0.00 0.00 44.72 43.98 1r1d s GLY 64 CO 0.18 -0.87 1.96 -0.56 0.00 0.00 0.00 173.10 173.81 1r1d h PRO 65 N 2.13 0.06 0.00 2.90 0.13 -1.88 0.32 132.00 135.66 1r1d h PRO 65 Ca -0.29 -0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.81 1r1d h PRO 65 Cb 1.24 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1r1d h PRO 65 CO 0.39 0.04 -0.16 -0.44 -0.23 0.00 0.00 178.00 177.59 1r1d h ASP 66 N 0.06 0.00 0.00 1.44 3.32 -1.96 0.46 116.42 119.74 1r1d h ASP 66 Ca 0.32 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.36 1r1d h ASP 66 Cb 1.17 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.72 1r1d h ASP 66 CO -0.02 0.16 -0.03 0.44 -1.72 0.00 0.00 179.24 178.07 1r1d h ASP 67 N 0.00 0.00 -1.00 6.45 3.32 -0.80 -3.32 116.42 121.07 1r1d h ASP 67 Ca -0.00 -0.57 0.10 0.00 0.02 0.00 0.00 57.03 56.58 1r1d h ASP 67 Cb 0.38 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.85 1r1d h ASP 67 CO 0.02 0.80 0.64 -0.50 -1.72 0.00 0.00 179.24 178.48 1r1d h TRP 68 N -1.00 1.16 -0.42 4.55 6.55 -1.20 -1.14 115.95 124.45 1r1d h TRP 68 Ca -0.01 0.03 0.01 0.00 0.95 0.00 0.00 58.89 59.88 1r1d h TRP 68 Cb 0.59 -0.37 -0.02 0.00 -0.86 0.00 0.00 29.16 28.49 1r1d h TRP 68 CO 0.15 0.51 0.28 2.35 -1.05 0.00 0.00 178.44 180.69 1r1d h TRP 69 N 1.06 0.50 -0.22 0.49 2.91 -1.06 0.03 115.95 119.67 1r1d h TRP 69 Ca 0.47 0.01 -0.08 0.00 1.13 0.00 0.00 58.89 60.43 1r1d h TRP 69 Cb 0.37 -0.17 -0.01 0.00 -0.51 0.00 0.00 29.16 28.83 1r1d h TRP 69 CO -0.00 0.31 -0.19 1.96 -1.03 0.00 0.00 178.44 179.49 1r1d h GLN 70 N 0.54 0.38 -0.05 2.65 4.20 -1.30 -2.35 115.11 119.18 1r1d h GLN 70 Ca 0.16 -0.12 -0.16 0.00 0.06 0.00 0.00 58.65 58.59 1r1d h GLN 70 Cb -0.01 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 1r1d h GLN 70 CO -0.04 0.57 -0.66 -0.44 -0.67 0.00 0.00 178.83 177.59 1r1d h ASP 71 N 0.35 0.27 0.00 1.46 3.32 -0.91 -0.51 116.42 120.40 1r1d h ASP 71 Ca 0.06 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1r1d h ASP 71 Cb 0.54 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1r1d h ASP 71 CO 0.04 0.86 0.00 0.52 -1.72 0.00 0.00 179.24 178.93 1r1d n VAL 72 N -3.83 0.00 0.00 -1.35 0.31 -0.61 -1.08 118.33 111.77 1r1d n VAL 72 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1r1d n VAL 72 Cb 0.66 -0.15 0.00 0.00 -0.91 0.00 0.00 33.84 33.44 1r1d n VAL 72 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1r1d n ASN 74 N 0.33 0.00 -0.08 4.52 3.02 -0.20 -1.37 115.26 121.47 1r1d n ASN 74 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.41 1r1d n ASN 74 Cb 0.07 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.19 1r1d n ASN 74 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1r1d h GLY 75 N 0.00 0.70 0.92 7.41 0.00 -1.34 0.36 103.07 111.12 1r1d h GLY 75 Ca 0.00 -0.75 -0.02 0.00 0.00 0.00 0.00 47.33 46.57 1r1d h GLY 75 CO 0.00 0.67 0.12 -1.82 0.00 0.00 0.00 176.54 175.52 1r1d h TYR 76 N 0.36 0.44 -0.63 5.60 3.20 -1.49 -2.75 116.97 121.70 1r1d h TYR 76 Ca 0.03 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1r1d h TYR 76 Cb 0.87 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.98 1r1d h TYR 76 CO 0.08 0.42 0.31 1.96 -1.64 0.00 0.00 178.16 179.29 1r1d h GLN 77 N 0.32 0.88 -0.45 1.82 1.08 -1.81 -1.81 115.11 115.14 1r1d h GLN 77 Ca 0.10 -0.11 0.08 0.00 -1.45 0.00 0.00 58.65 57.27 1r1d h GLN 77 Cb 0.17 -0.17 -0.07 0.00 -0.05 0.00 0.00 27.48 27.36 1r1d h GLN 77 CO -0.01 0.68 0.02 0.35 -0.95 0.00 0.00 178.83 178.92 1r1d h PHE 78 N 0.88 0.01 -0.45 2.96 3.57 -0.63 0.23 116.94 123.51 1r1d h PHE 78 Ca 0.22 0.03 -0.14 0.00 3.53 0.00 0.00 57.97 61.61 1r1d h PHE 78 Cb 0.08 0.06 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 1r1d h PHE 78 CO 0.01 -0.07 -0.27 -0.07 -2.23 0.00 0.00 178.31 175.67 1r1d h LEU 79 N 0.14 1.03 -0.00 0.59 3.38 -1.32 -2.88 115.31 116.25 1r1d h LEU 79 Ca 0.23 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 1r1d h LEU 79 Cb 0.32 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1r1d h LEU 79 CO -0.36 1.22 0.00 0.11 0.09 0.00 0.00 178.44 179.51 1r1d h LYS 80 N 0.84 0.00 0.00 1.13 1.79 -0.52 -1.97 116.57 117.84 1r1d h LYS 80 Ca 0.09 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 1r1d h LYS 80 Cb 0.86 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.51 1r1d h LYS 80 CO 0.08 0.05 0.07 -0.91 -1.08 0.00 0.00 179.45 177.65 1r1d h ASN 81 N -0.05 0.00 -0.48 0.86 2.35 -0.56 0.50 115.58 118.20 1r1d h ASN 81 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1r1d h ASN 81 Cb 0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1r1d h ASN 81 CO -0.00 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 176.07 1r1d n LYS 82 N -2.67 2.29 -0.09 0.81 5.02 -0.77 -4.94 118.16 117.81 1r1d n LYS 82 Ca -0.02 -1.99 0.00 0.00 -2.02 0.00 0.00 58.31 54.28 1r1d n LYS 82 Cb 0.12 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 1r1d n LYS 82 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1r1d n GLY 83 N 1.40 0.62 3.65 0.72 0.00 0.17 -5.04 105.19 106.70 1r1d n GLY 83 Ca 0.19 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.78 1r1d n GLY 83 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1r1d s TYR 84 N -2.30 2.24 -0.00 1.61 1.51 -1.03 -4.90 117.35 114.48 1r1d s TYR 84 Ca 0.00 0.53 -0.20 0.00 -1.01 0.00 0.00 57.07 56.39 1r1d s TYR 84 Cb 0.00 -3.85 -0.23 0.00 -0.11 0.00 0.00 41.96 37.77 1r1d s TYR 84 CO 0.00 -2.95 1.09 1.49 -1.11 0.00 0.00 175.55 174.07 1r1d h GLU 85 N 9.69 0.38 -5.70 -0.62 4.81 -1.89 -3.40 114.58 117.85 1r1d h GLU 85 Ca -0.34 -0.40 -0.67 0.00 -0.13 0.00 0.00 59.36 57.82 1r1d h GLU 85 Cb 1.15 0.11 -0.26 0.00 0.63 0.00 0.00 28.75 30.38 1r1d h GLU 85 CO 0.98 1.08 -0.77 0.15 -0.73 0.00 0.00 179.01 179.71 1r1d s LYS 86 N -3.20 3.04 -0.05 1.92 1.02 -1.26 -5.08 119.74 116.12 1r1d s LYS 86 Ca -0.14 -0.70 0.02 0.00 0.02 0.00 0.00 55.97 55.17 1r1d s LYS 86 Cb 0.03 -2.52 0.02 0.00 -0.52 0.00 0.00 37.83 34.84 1r1d s LYS 86 CO 0.81 0.37 -0.08 0.42 -0.92 0.00 0.00 175.35 175.94 1r1d s ILE 87 N -0.06 0.83 0.31 2.17 1.01 -1.26 -3.21 121.20 121.00 1r1d s ILE 87 Ca -0.03 -0.30 0.07 0.00 0.00 0.00 0.00 60.65 60.39 1r1d s ILE 87 Cb -0.14 -0.79 -0.03 0.00 0.01 0.00 0.00 42.46 41.51 1r1d s ILE 87 CO 0.04 0.29 0.25 0.00 0.00 0.00 0.00 174.94 175.52 1r1d s ALA 88 N 0.76 3.73 -0.00 9.38 0.00 -0.26 -0.33 121.76 135.04 1r1d s ALA 88 Ca -0.13 -1.58 0.01 0.00 0.00 0.00 0.00 51.96 50.25 1r1d s ALA 88 Cb -0.15 -1.19 -0.00 0.00 0.00 0.00 0.00 23.12 21.78 1r1d s ALA 88 CO 0.02 0.09 -0.02 0.54 0.00 0.00 0.00 175.76 176.40 1r1d s VAL 89 N -2.26 0.15 -0.07 0.00 0.11 0.02 -0.69 120.40 117.67 1r1d s VAL 89 Ca 0.38 -0.07 0.01 0.00 -2.93 0.00 0.00 61.98 59.37 1r1d s VAL 89 Cb -0.06 -0.14 0.02 0.00 -1.53 0.00 0.00 36.38 34.67 1r1d s VAL 89 CO 0.26 0.05 -0.08 0.00 -3.33 0.00 0.00 175.10 172.00 1r1d s ALA 90 N 0.00 1.02 0.02 1.54 0.00 -0.52 -0.47 121.76 123.36 1r1d s ALA 90 Ca 0.00 -0.29 0.06 0.00 0.00 0.00 0.00 51.96 51.73 1r1d s ALA 90 Cb -0.01 -0.59 -0.02 0.00 0.00 0.00 0.00 23.12 22.50 1r1d s ALA 90 CO -0.00 -0.07 -0.17 0.20 0.00 0.00 0.00 175.76 175.72 1r1d s GLY 91 N 1.04 0.87 -0.24 0.00 0.00 -0.18 -0.99 107.32 107.83 1r1d s GLY 91 Ca -0.08 -0.82 -0.10 0.00 0.00 0.00 0.00 44.72 43.71 1r1d s GLY 91 CO -0.00 -0.74 0.14 -2.27 0.00 0.00 0.00 173.10 170.23 1r1d s LEU 92 N -0.80 4.04 0.00 0.66 2.96 -0.32 -3.38 118.68 121.84 1r1d s LEU 92 Ca 0.05 0.08 0.00 0.00 -0.22 0.00 0.00 54.13 54.05 1r1d s LEU 92 Cb -0.07 -2.08 0.00 0.00 0.50 0.00 0.00 46.19 44.54 1r1d s LEU 92 CO 0.01 0.07 0.00 -0.24 -1.32 0.00 0.00 176.35 174.86 1r1d n SER 93 N 4.27 0.00 0.08 3.68 2.88 -1.25 -0.30 113.62 122.98 1r1d n SER 93 Ca -0.15 0.00 0.18 0.00 -1.33 0.00 0.00 58.87 57.57 1r1d n SER 93 Cb 0.52 0.00 0.72 0.00 -0.75 0.00 0.00 64.21 64.70 1r1d n SER 93 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1r1d h LEU 94 N 0.00 0.00 -2.12 2.46 5.85 -1.84 0.39 115.31 120.05 1r1d h LEU 94 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1r1d h LEU 94 Cb 0.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 1r1d h LEU 94 CO 0.00 0.00 -0.02 1.23 -0.34 0.00 0.00 178.44 179.31 1r1d h GLY 95 N 0.00 0.00 1.52 3.75 0.00 -0.45 -1.35 103.07 106.55 1r1d h GLY 95 Ca 0.18 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.35 1r1d h GLY 95 CO -0.00 0.00 -0.62 -1.33 0.00 0.00 0.00 176.54 174.59 1r1d h GLY 96 N 0.06 0.54 0.93 4.60 0.00 -0.23 0.51 103.07 109.48 1r1d h GLY 96 Ca -0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 47.33 46.62 1r1d h GLY 96 CO 0.00 0.60 0.06 -2.08 0.00 0.00 0.00 176.54 175.12 1r1d h VAL 97 N 0.36 1.24 -0.00 4.60 2.07 -1.20 -0.44 116.25 122.88 1r1d h VAL 97 Ca -0.01 -0.86 -0.08 0.00 0.82 0.00 0.00 66.70 66.57 1r1d h VAL 97 Cb 1.17 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.97 1r1d h VAL 97 CO 0.11 0.29 -0.39 -0.26 0.02 0.00 0.00 177.57 177.34 1r1d h PHE 98 N 0.49 0.00 -0.34 1.57 0.04 -1.25 -1.13 116.94 116.33 1r1d h PHE 98 Ca 0.12 -0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.83 1r1d h PHE 98 Cb 0.36 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.50 1r1d h PHE 98 CO 0.02 0.39 -0.03 0.77 -0.60 0.00 0.00 178.31 178.87 1r1d h SER 99 N 0.00 0.61 -0.36 2.17 0.02 -0.35 0.12 113.55 115.76 1r1d h SER 99 Ca -0.00 -0.33 -0.02 0.00 -0.84 0.00 0.00 61.79 60.59 1r1d h SER 99 Cb 0.69 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.05 1r1d h SER 99 CO 0.05 0.79 0.13 -0.07 -1.14 0.00 0.00 176.83 176.59 1r1d h LEU 100 N 0.41 0.50 -0.53 5.07 3.38 -0.78 -0.39 115.31 122.97 1r1d h LEU 100 Ca 0.09 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1r1d h LEU 100 Cb 0.50 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1r1d h LEU 100 CO 0.02 0.55 0.34 0.50 0.09 0.00 0.00 178.44 179.94 1r1d h LYS 101 N 0.43 0.70 -0.64 1.13 3.64 -1.02 -1.27 116.57 119.53 1r1d h LYS 101 Ca 0.12 -0.05 0.01 0.00 -1.27 0.00 0.00 60.65 59.46 1r1d h LYS 101 Cb 0.21 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 31.85 1r1d h LYS 101 CO -0.01 0.47 0.42 1.25 -2.27 0.00 0.00 179.45 179.32 1r1d h LEU 102 N 0.71 0.74 -2.31 5.20 5.85 -0.58 -1.69 115.31 123.23 1r1d h LEU 102 Ca 0.19 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.93 1r1d h LEU 102 Cb -0.07 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 1r1d h LEU 102 CO -0.04 0.53 0.17 1.23 -0.34 0.00 0.00 178.44 179.99 1r1d h GLY 103 N 0.87 0.00 -0.32 3.75 0.00 0.16 -1.22 103.07 106.30 1r1d h GLY 103 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1r1d h GLY 103 CO -0.05 0.00 0.00 1.58 0.00 0.00 0.00 176.54 178.07 1r1d n TYR 104 N -3.69 0.18 -0.07 5.60 0.18 -0.67 -4.68 117.16 114.02 1r1d n TYR 104 Ca 0.00 -0.85 -0.11 0.00 1.88 0.00 0.00 57.90 58.83 1r1d n TYR 104 Cb 0.28 -0.15 -0.05 0.00 -0.38 0.00 0.00 39.34 39.03 1r1d n TYR 104 CO 0.00 0.00 0.00 2.41 -2.08 0.00 0.00 176.86 177.19 1r1d n THR 105 N -0.98 0.74 -4.33 -3.48 -1.04 -0.53 -5.06 114.28 99.60 1r1d n THR 105 Ca 0.13 -0.24 -0.17 0.00 -2.04 0.00 0.00 64.05 61.73 1r1d n THR 105 Cb 0.59 -1.24 -0.10 0.00 -1.82 0.00 0.00 70.33 67.75 1r1d n THR 105 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1r1d s VAL 106 N -2.25 0.86 0.08 12.58 -7.23 -0.81 -5.10 120.40 118.53 1r1d s VAL 106 Ca -0.18 -2.01 -0.31 0.00 -1.81 0.00 0.00 61.98 57.67 1r1d s VAL 106 Cb 0.06 -2.45 -0.09 0.00 0.56 0.00 0.00 36.38 34.46 1r1d s VAL 106 CO 0.27 -0.21 1.69 -2.84 -0.31 0.00 0.00 175.10 173.69 1r1d s PRO 107 N -3.92 4.19 -0.05 4.82 0.02 -1.26 -4.64 135.00 134.14 1r1d s PRO 107 Ca 0.31 2.38 0.01 0.00 0.02 0.00 0.00 61.00 63.72 1r1d s PRO 107 Cb 0.07 -3.61 0.02 0.00 0.02 0.00 0.00 34.50 31.00 1r1d s PRO 107 CO 0.10 -0.76 -0.05 0.42 -0.33 0.00 0.00 177.00 176.39 1r1d s ILE 108 N 2.69 0.58 0.22 2.83 -1.09 -1.26 -4.66 121.20 120.51 1r1d s ILE 108 Ca 0.75 -0.12 0.00 0.00 -2.23 0.00 0.00 60.65 59.05 1r1d s ILE 108 Cb -0.41 -0.62 -0.02 0.00 -1.58 0.00 0.00 42.46 39.83 1r1d s ILE 108 CO 0.33 0.25 1.57 -0.08 -1.23 0.00 0.00 174.94 175.77 1r1d h GLU 109 N 7.36 0.45 -2.00 2.79 4.57 -1.05 -3.46 114.58 123.25 1r1d h GLU 109 Ca -0.35 -0.26 0.08 0.00 -1.18 0.00 0.00 59.36 57.66 1r1d h GLU 109 Cb 1.15 0.02 -0.18 0.00 -0.16 0.00 0.00 28.75 29.58 1r1d h GLU 109 CO 0.44 0.85 0.48 0.20 -1.18 0.00 0.00 179.01 179.80 1r1d s GLY 110 N -4.16 -0.40 -0.04 1.92 0.00 -1.26 -4.32 107.32 99.05 1r1d s GLY 110 Ca -0.06 1.41 0.03 0.00 0.00 0.00 0.00 44.72 46.10 1r1d s GLY 110 CO 0.82 0.64 -0.14 -0.42 0.00 0.00 0.00 173.10 174.00 1r1d s ILE 111 N -2.22 1.21 -0.19 0.90 1.01 0.05 -0.80 121.20 121.17 1r1d s ILE 111 Ca 0.01 -0.58 0.01 0.00 0.00 0.00 0.00 60.65 60.09 1r1d s ILE 111 Cb -0.01 -1.06 0.03 0.00 0.01 0.00 0.00 42.46 41.43 1r1d s ILE 111 CO -0.03 0.36 -0.14 -0.69 0.00 0.00 0.00 174.94 174.44 1r1d s VAL 112 N 0.22 1.78 0.13 2.92 1.01 0.38 -0.96 120.40 125.88 1r1d s VAL 112 Ca -0.06 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 60.99 1r1d s VAL 112 Cb -0.12 -1.74 0.02 0.00 0.00 0.00 0.00 36.38 34.54 1r1d s VAL 112 CO 0.02 0.33 0.13 0.35 0.00 0.00 0.00 175.10 175.93 1r1d n THR 113 N 4.67 0.00 0.00 3.92 -2.24 -0.70 -1.02 114.28 118.91 1r1d n THR 113 Ca -0.17 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 1r1d n THR 113 Cb 0.48 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 1r1d n THR 113 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1r1d s ALA 116 N 0.00 3.24 0.91 0.00 0.00 -1.26 -3.80 121.76 120.85 1r1d s ALA 116 Ca 0.00 0.59 -0.14 0.00 0.00 0.00 0.00 51.96 52.41 1r1d s ALA 116 Cb 0.00 -3.30 0.16 0.00 0.00 0.00 0.00 23.12 19.98 1r1d s ALA 116 CO 0.00 -0.08 1.27 -1.25 0.00 0.00 0.00 175.76 175.70 1r1d s PRO 117 N 0.16 1.08 0.00 0.00 0.04 -1.26 -4.61 135.00 130.40 1r1d s PRO 117 Ca 0.48 -0.26 0.00 0.00 0.04 0.00 0.00 61.00 61.26 1r1d s PRO 117 Cb -0.23 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1r1d s PRO 117 CO 0.30 -2.14 0.00 0.66 0.04 0.00 0.00 177.00 175.86 1r1d n TYR 119 N -3.61 0.00 -3.19 0.56 4.01 -1.26 -4.90 117.16 108.77 1r1d n TYR 119 Ca 0.13 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.46 1r1d n TYR 119 Cb 0.60 -0.03 -0.07 0.00 -0.31 0.00 0.00 39.34 39.53 1r1d n TYR 119 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1r1d s ILE 120 N -0.96 4.98 0.41 -0.72 1.01 -1.26 -5.00 121.20 119.65 1r1d s ILE 120 Ca 0.00 0.55 -0.14 0.00 0.00 0.00 0.00 60.65 61.06 1r1d s ILE 120 Cb 0.00 -3.98 -0.08 0.00 0.01 0.00 0.00 42.46 38.42 1r1d s ILE 120 CO 0.00 -0.19 0.82 -0.54 0.00 0.00 0.00 174.94 175.03 1r1d s LYS 121 N 2.49 3.91 0.70 2.79 1.02 -1.26 -5.04 119.74 124.35 1r1d s LYS 121 Ca 0.21 0.67 -0.14 0.00 0.02 0.00 0.00 55.97 56.74 1r1d s LYS 121 Cb -0.15 -2.34 0.02 0.00 -0.52 0.00 0.00 37.83 34.84 1r1d s LYS 121 CO 0.13 -0.03 1.11 -1.54 -0.92 0.00 0.00 175.35 174.10 1r1d s SER 122 N -2.82 4.88 0.38 2.83 1.04 -1.26 -4.92 113.70 113.82 1r1d s SER 122 Ca 0.54 1.96 0.05 0.00 0.48 0.00 0.00 55.95 58.98 1r1d s SER 122 Cb -0.10 -2.54 0.74 0.00 0.10 0.00 0.00 66.02 64.21 1r1d s SER 122 CO 0.26 -1.79 2.02 -0.08 0.98 0.00 0.00 173.24 174.64 1r1d h GLU 123 N -0.35 0.68 -0.21 4.02 4.81 -1.96 -2.73 114.58 118.84 1r1d h GLU 123 Ca -0.46 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.71 1r1d h GLU 123 Cb 1.24 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.46 1r1d h GLU 123 CO 0.53 0.46 0.07 0.93 -0.73 0.00 0.00 179.01 180.28 1r1d h GLU 124 N 0.70 0.32 -1.17 1.92 3.07 -2.01 -0.78 114.58 116.61 1r1d h GLU 124 Ca 0.19 -0.06 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 1r1d h GLU 124 Cb -0.05 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 27.81 1r1d h GLU 124 CO -0.04 0.40 0.00 2.41 -1.40 0.00 0.00 179.01 180.38 1r1d n THR 125 N -4.80 0.05 0.00 1.13 -1.04 -1.03 -0.96 114.28 107.62 1r1d n THR 125 Ca -0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 1r1d n THR 125 Cb 0.14 -0.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.31 1r1d n THR 125 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1r1d n TYR 127 N 0.76 0.00 -0.36 -1.42 9.36 -0.30 -1.76 117.16 123.44 1r1d n TYR 127 Ca 0.00 0.00 0.02 0.00 3.32 0.00 0.00 57.90 61.24 1r1d n TYR 127 Cb 0.03 0.00 0.18 0.00 -0.63 0.00 0.00 39.34 38.92 1r1d n TYR 127 CO 0.00 0.00 0.00 0.93 0.22 0.00 0.00 176.86 178.01 1r1d h GLU 128 N 0.00 1.14 -0.55 2.98 5.08 -1.31 0.03 114.58 121.95 1r1d h GLU 128 Ca 0.00 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1r1d h GLU 128 Cb 0.00 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 28.97 1r1d h GLU 128 CO 0.00 0.75 0.35 0.78 -1.00 0.00 0.00 179.01 179.89 1r1d h GLY 129 N 1.17 0.79 1.22 -3.84 0.00 -1.61 -1.26 103.07 99.54 1r1d h GLY 129 Ca 0.41 -0.32 -0.05 0.00 0.00 0.00 0.00 47.33 47.38 1r1d h GLY 129 CO -0.15 0.31 0.21 -2.08 0.00 0.00 0.00 176.54 174.82 1r1d h VAL 130 N 0.74 1.24 -0.31 4.60 2.07 -1.48 -1.64 116.25 121.47 1r1d h VAL 130 Ca 0.20 -0.82 -0.03 0.00 0.82 0.00 0.00 66.70 66.87 1r1d h VAL 130 Cb -0.04 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1r1d h VAL 130 CO -0.04 0.32 0.07 -0.07 0.02 0.00 0.00 177.57 177.87 1r1d h LEU 131 N 0.95 0.48 -0.77 2.57 3.38 -0.61 -0.66 115.31 120.65 1r1d h LEU 131 Ca 0.21 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.99 1r1d h LEU 131 Cb 0.27 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.84 1r1d h LEU 131 CO -0.01 0.59 0.49 -0.33 0.09 0.00 0.00 178.44 179.26 1r1d h GLU 132 N 0.34 0.90 -0.56 1.13 5.08 -0.95 -0.76 114.58 119.77 1r1d h GLU 132 Ca 0.10 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1r1d h GLU 132 Cb 0.30 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 1r1d h GLU 132 CO 0.00 0.60 0.26 -0.92 -1.00 0.00 0.00 179.01 177.95 1r1d h TYR 133 N 0.93 0.82 -0.55 4.33 3.20 -1.02 -1.61 116.97 123.07 1r1d h TYR 133 Ca 0.32 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 62.10 1r1d h TYR 133 Cb 0.05 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.05 1r1d h TYR 133 CO -0.04 0.64 0.19 0.00 -1.64 0.00 0.00 178.16 177.31 1r1d h ALA 134 N 1.10 0.72 -0.10 1.82 0.00 -0.54 -1.51 119.26 120.76 1r1d h ALA 134 Ca 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1r1d h ALA 134 Cb 0.13 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 1r1d h ALA 134 CO -0.02 0.37 0.03 -0.09 0.00 0.00 0.00 179.25 179.54 1r1d h ARG 135 N 0.77 0.16 -0.85 0.00 2.43 -0.97 -1.68 114.38 114.24 1r1d h ARG 135 Ca 0.18 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1r1d h ARG 135 Cb 0.26 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 1r1d h ARG 135 CO -0.01 0.32 0.56 1.49 -1.51 0.00 0.00 179.97 180.82 1r1d h GLU 136 N -0.03 1.10 -0.45 0.20 4.57 -1.24 0.10 114.58 118.84 1r1d h GLU 136 Ca 0.03 -0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 58.14 1r1d h GLU 136 Cb 0.22 -0.25 -0.02 0.00 -0.16 0.00 0.00 28.75 28.54 1r1d h GLU 136 CO -0.00 0.73 0.26 -0.92 -1.18 0.00 0.00 179.01 177.90 1r1d h TYR 137 N 1.13 0.60 -0.34 0.92 3.20 -1.14 0.18 116.97 121.52 1r1d h TYR 137 Ca 0.32 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 62.10 1r1d h TYR 137 Cb -0.11 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 37.95 1r1d h TYR 137 CO -0.01 0.43 -0.10 0.87 -1.64 0.00 0.00 178.16 177.71 1r1d h LYS 138 N 0.59 0.59 -0.47 1.82 1.57 -0.73 -2.04 116.57 117.90 1r1d h LYS 138 Ca 0.16 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.74 1r1d h LYS 138 Cb 0.02 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1r1d h LYS 138 CO -0.03 0.68 0.20 -0.22 -0.57 0.00 0.00 179.45 179.51 1r1d h LYS 139 N 0.54 0.70 0.00 3.15 3.64 -0.20 -1.60 116.57 122.80 1r1d h LYS 139 Ca 0.10 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1r1d h LYS 139 Cb 0.50 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1r1d h LYS 139 CO 0.03 0.62 0.00 0.00 -2.27 0.00 0.00 179.45 177.83 1r1d h ARG 140 N 0.62 0.00 -0.00 1.90 3.08 -0.49 -0.53 114.38 118.96 1r1d h ARG 140 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 1r1d h ARG 140 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1r1d h ARG 140 CO -0.01 0.00 -0.07 0.39 -1.07 0.00 0.00 179.97 179.20 1r1d n GLU 141 N -2.37 0.50 -1.51 0.04 1.02 -0.61 -4.91 120.64 112.80 1r1d n GLU 141 Ca 0.01 -0.11 -0.02 0.00 -0.02 0.00 0.00 57.16 57.02 1r1d n GLU 141 Cb 0.17 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1r1d n GLU 141 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1r1d n GLY 142 N 1.30 0.41 3.82 0.62 0.00 -0.21 -5.03 105.19 106.11 1r1d n GLY 142 Ca 0.14 -0.92 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 1r1d n GLY 142 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r1d s LYS 143 N -3.06 4.21 0.83 1.61 1.02 -1.19 -5.05 119.74 118.11 1r1d s LYS 143 Ca 0.00 0.83 -0.10 0.00 0.02 0.00 0.00 55.97 56.72 1r1d s LYS 143 Cb 0.00 -2.79 0.09 0.00 -0.52 0.00 0.00 37.83 34.61 1r1d s LYS 143 CO 0.00 0.35 1.11 -1.54 -0.92 0.00 0.00 175.35 174.35 1r1d s SER 144 N -1.77 3.84 0.24 2.83 1.04 -1.26 -4.75 113.70 113.87 1r1d s SER 144 Ca 0.45 1.95 -0.06 0.00 0.48 0.00 0.00 55.95 58.78 1r1d s SER 144 Cb -0.15 -2.53 0.31 0.00 0.10 0.00 0.00 66.02 63.75 1r1d s SER 144 CO 0.20 -2.48 1.86 -0.08 0.98 0.00 0.00 173.24 173.72 1r1d h GLU 145 N -1.44 0.99 -0.46 4.02 4.57 -1.99 0.07 114.58 120.34 1r1d h GLU 145 Ca -0.44 -0.06 -0.01 0.00 -1.18 0.00 0.00 59.36 57.67 1r1d h GLU 145 Cb 1.25 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.59 1r1d h GLU 145 CO 0.48 0.65 0.23 1.49 -1.18 0.00 0.00 179.01 180.68 1r1d h GLU 146 N 1.02 0.65 -0.32 1.92 4.81 -2.00 -0.73 114.58 119.93 1r1d h GLU 146 Ca 0.37 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.47 1r1d h GLU 146 Cb 0.11 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 1r1d h GLU 146 CO -0.15 0.54 0.04 0.37 -0.73 0.00 0.00 179.01 179.08 1r1d h GLN 147 N 0.60 0.54 -0.34 1.92 4.15 -1.75 -2.34 115.11 117.89 1r1d h GLN 147 Ca 0.16 -0.15 0.07 0.00 0.77 0.00 0.00 58.65 59.50 1r1d h GLN 147 Cb 0.09 -0.06 -0.06 0.00 0.21 0.00 0.00 27.48 27.66 1r1d h GLN 147 CO -0.02 0.64 -0.07 0.82 -1.93 0.00 0.00 178.83 178.26 1r1d h ILE 148 N 0.36 0.68 -0.86 2.39 2.04 -0.77 0.01 117.51 121.35 1r1d h ILE 148 Ca 0.10 -0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.02 1r1d h ILE 148 Cb 0.37 0.66 -0.06 0.00 -0.74 0.00 0.00 36.82 37.04 1r1d h ILE 148 CO 0.01 0.00 0.53 -0.33 0.00 0.00 0.00 178.15 178.36 1r1d h GLU 149 N 0.01 0.91 -0.46 2.37 4.39 -0.99 -2.06 114.58 118.76 1r1d h GLU 149 Ca 0.16 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.76 1r1d h GLU 149 Cb 0.24 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 1r1d h GLU 149 CO -0.34 0.60 0.08 1.96 -1.16 0.00 0.00 179.01 180.16 1r1d h GLN 150 N 0.94 0.75 -1.76 2.33 4.20 -0.74 -1.67 115.11 119.16 1r1d h GLN 150 Ca 0.39 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 58.90 1r1d h GLN 150 Cb 0.22 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1r1d h GLN 150 CO -0.19 0.76 0.00 0.39 -0.67 0.00 0.00 178.83 179.12 1r1d n GLU 151 N -4.47 0.47 0.00 1.46 1.02 -0.11 -2.56 120.64 116.46 1r1d n GLU 151 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 1r1d n GLU 151 Cb 0.24 -1.26 0.00 0.00 -0.02 0.00 0.00 31.44 30.39 1r1d n GLU 151 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1r1d n GLU 153 N 1.26 0.00 0.33 3.49 4.07 -0.63 -0.97 120.64 128.19 1r1d n GLU 153 Ca 0.00 0.00 -0.17 0.00 -0.06 0.00 0.00 57.16 56.93 1r1d n GLU 153 Cb 0.24 0.00 -0.09 0.00 -0.06 0.00 0.00 31.44 31.53 1r1d n GLU 153 CO 0.00 0.00 0.00 -0.09 -0.06 0.00 0.00 177.13 176.98 1r1d h ARG 154 N 0.00 -0.76 -0.85 5.31 2.43 -1.77 -2.95 114.38 115.78 1r1d h ARG 154 Ca 0.00 0.05 0.20 0.00 -0.81 0.00 0.00 59.98 59.42 1r1d h ARG 154 Cb 0.00 0.17 -0.16 0.00 -0.42 0.00 0.00 29.97 29.57 1r1d h ARG 154 CO 0.00 -0.51 -0.06 0.35 -1.51 0.00 0.00 179.97 178.24 1r1d h PHE 155 N -0.80 -0.19 0.00 2.20 3.57 -1.34 0.35 116.94 120.73 1r1d h PHE 155 Ca -0.08 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.49 1r1d h PHE 155 Cb 0.61 0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.57 1r1d h PHE 155 CO -0.03 -0.33 0.00 0.87 -2.23 0.00 0.00 178.31 176.58 1r1d h LYS 156 N 0.05 0.00 0.00 1.11 1.57 -1.79 -2.45 116.57 115.05 1r1d h LYS 156 Ca 0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.24 1r1d h LYS 156 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1r1d h LYS 156 CO -0.81 0.00 0.00 1.04 -0.57 0.00 0.00 179.45 179.11 1r1d n GLN 157 N -2.32 0.12 -3.85 3.15 6.02 0.12 -4.51 117.38 116.11 1r1d n GLN 157 Ca -0.01 0.24 -0.35 0.00 -0.01 0.00 0.00 57.00 56.86 1r1d n GLN 157 Cb 0.08 -1.68 -0.13 0.00 1.02 0.00 0.00 30.24 29.54 1r1d n GLN 157 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1r1d s THR 158 N -3.11 3.14 0.00 5.09 2.01 -0.93 -5.16 115.64 116.69 1r1d s THR 158 Ca 0.09 -1.62 0.00 0.00 0.31 0.00 0.00 61.69 60.46 1r1d s THR 158 Cb 0.12 -2.94 0.00 0.00 0.01 0.00 0.00 72.50 69.69 1r1d s THR 158 CO 0.44 -0.33 0.00 -0.81 -0.69 0.00 0.00 174.62 173.23 1r1d n PRO 159 N 4.62 0.61 0.00 4.92 -0.04 -1.26 -5.05 135.00 138.80 1r1d n PRO 159 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1r1d n PRO 159 Cb 0.43 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.89 1r1d n PRO 159 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1r1d n LYS 161 N 0.00 0.00 -0.03 0.54 5.02 -1.26 -4.95 118.16 117.48 1r1d n LYS 161 Ca 0.00 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 1r1d n LYS 161 Cb 0.00 -0.02 0.36 0.00 -0.02 0.00 0.00 35.03 35.35 1r1d n LYS 161 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1r1d n THR 162 N 0.00 0.07 0.23 -0.18 -2.24 -1.26 -4.10 114.28 106.79 1r1d n THR 162 Ca 0.00 -0.37 0.08 0.00 -2.27 0.00 0.00 64.05 61.48 1r1d n THR 162 Cb 0.04 0.80 0.54 0.00 -2.10 0.00 0.00 70.33 69.61 1r1d n THR 162 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1r1d h LEU 163 N 3.16 0.00 -0.69 3.22 3.38 -1.96 -0.97 115.31 121.45 1r1d h LEU 163 Ca 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1r1d h LEU 163 Cb 0.68 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1r1d h LEU 163 CO 0.00 0.22 -0.23 0.11 0.09 0.00 0.00 178.44 178.63 1r1d h LYS 164 N 0.00 0.77 0.00 1.13 1.57 -1.99 -1.73 116.57 116.31 1r1d h LYS 164 Ca -0.00 -0.31 -0.09 0.00 -1.87 0.00 0.00 60.65 58.38 1r1d h LYS 164 Cb 0.48 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 1r1d h LYS 164 CO 0.03 0.92 -0.41 0.00 -0.57 0.00 0.00 179.45 179.43 1r1d h ALA 165 N 1.07 1.10 -0.25 3.86 0.00 -1.53 -1.62 119.26 121.90 1r1d h ALA 165 Ca 0.09 -0.37 -0.14 0.00 0.00 0.00 0.00 54.91 54.50 1r1d h ALA 165 Cb 0.74 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1r1d h ALA 165 CO 0.06 0.51 -0.41 1.25 0.00 0.00 0.00 179.25 180.66 1r1d h LEU 166 N 0.00 0.63 -0.70 0.00 5.85 -0.72 -0.90 115.31 119.48 1r1d h LEU 166 Ca -0.00 -0.28 -0.09 0.00 0.84 0.00 0.00 57.88 58.35 1r1d h LEU 166 Cb 0.84 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 1r1d h LEU 166 CO 0.05 0.97 0.06 1.56 -0.34 0.00 0.00 178.44 180.74 1r1d h GLN 167 N 0.49 1.06 -0.75 1.25 4.20 -0.89 -2.64 115.11 117.84 1r1d h GLN 167 Ca 0.04 -0.30 -0.02 0.00 0.06 0.00 0.00 58.65 58.43 1r1d h GLN 167 Cb 0.92 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 28.55 1r1d h GLN 167 CO 0.08 1.00 0.40 0.93 -0.67 0.00 0.00 178.83 180.58 1r1d h GLU 168 N 0.98 1.05 0.06 1.46 5.08 -0.85 -1.26 114.58 121.11 1r1d h GLU 168 Ca 0.19 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1r1d h GLU 168 Cb 0.49 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1r1d h GLU 168 CO 0.02 0.79 -0.03 1.25 -1.00 0.00 0.00 179.01 180.04 1r1d h LEU 169 N 1.04 -0.07 -0.59 1.33 5.85 -1.00 0.17 115.31 122.04 1r1d h LEU 169 Ca 0.26 -0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.93 1r1d h LEU 169 Cb 0.05 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 1r1d h LEU 169 CO -0.04 -0.04 0.21 0.40 -0.34 0.00 0.00 178.44 178.63 1r1d h ILE 170 N -0.09 1.24 -0.41 4.05 2.04 -1.31 -1.06 117.51 121.96 1r1d h ILE 170 Ca -0.01 -0.77 -0.02 0.00 1.00 0.00 0.00 64.86 65.06 1r1d h ILE 170 Cb 0.07 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.76 1r1d h ILE 170 CO 0.01 0.29 0.17 0.00 0.00 0.00 0.00 178.15 178.62 1r1d h ALA 171 N 1.07 0.53 -0.32 1.87 0.00 -1.09 -0.39 119.26 120.93 1r1d h ALA 171 Ca 0.19 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1r1d h ALA 171 Cb 0.25 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1r1d h ALA 171 CO -0.01 0.13 0.15 0.22 0.00 0.00 0.00 179.25 179.74 1r1d h ASP 172 N 0.52 0.42 -0.21 0.00 3.58 -0.41 0.15 116.42 120.46 1r1d h ASP 172 Ca 0.14 -0.13 -0.14 0.00 0.42 0.00 0.00 57.03 57.32 1r1d h ASP 172 Cb 0.18 -0.11 -0.01 0.00 1.72 0.00 0.00 39.33 41.12 1r1d h ASP 172 CO -0.01 0.43 -0.36 0.58 -2.88 0.00 0.00 179.24 177.00 1r1d h VAL 173 N 0.38 1.28 -0.61 2.25 2.07 -1.15 -2.14 116.25 118.33 1r1d h VAL 173 Ca 0.11 -1.52 -0.04 0.00 0.82 0.00 0.00 66.70 66.07 1r1d h VAL 173 Cb 0.13 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 1r1d h VAL 173 CO -0.01 0.49 0.23 -0.09 0.02 0.00 0.00 177.57 178.21 1r1d h ARG 174 N 0.61 0.92 0.00 1.57 2.43 -0.81 -2.04 114.38 117.06 1r1d h ARG 174 Ca 0.06 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 59.04 1r1d h ARG 174 Cb 0.89 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.29 1r1d h ARG 174 CO 0.08 0.79 -0.09 0.00 -1.51 0.00 0.00 179.97 179.25 1r1d h ALA 175 N 1.08 1.46 -0.36 2.80 0.00 -0.41 -3.02 119.26 120.82 1r1d h ALA 175 Ca 0.20 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1r1d h ALA 175 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1r1d h ALA 175 CO -0.01 0.11 0.00 0.72 0.00 0.00 0.00 179.25 180.06 1r1d n HIS 176 N -3.86 1.22 0.08 0.00 8.25 -0.82 -4.62 115.22 115.46 1r1d n HIS 176 Ca -0.02 -0.80 0.10 0.00 -0.26 0.00 0.00 57.72 56.74 1r1d n HIS 176 Cb 0.18 -0.34 0.57 0.00 1.12 0.00 0.00 29.99 31.52 1r1d n HIS 176 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1r1d h LEU 177 N 2.48 0.19 0.00 2.41 3.38 -1.27 -0.38 115.31 122.11 1r1d h LEU 177 Ca 0.00 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1r1d h LEU 177 Cb 1.53 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.24 1r1d h LEU 177 CO 0.27 0.12 0.00 -0.90 0.09 0.00 0.00 178.44 178.03 1r1d n ASP 178 N -4.48 0.00 0.01 -0.43 5.75 -1.22 -1.31 116.55 114.87 1r1d n ASP 178 Ca 0.03 -0.16 0.11 0.00 -0.01 0.00 0.00 54.79 54.77 1r1d n ASP 178 Cb 0.24 -0.08 0.08 0.00 -1.03 0.00 0.00 41.12 40.33 1r1d n ASP 178 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1r1d n LEU 179 N -1.08 0.66 -4.68 -2.12 4.77 -0.15 -4.46 117.00 109.93 1r1d n LEU 179 Ca 0.06 -0.11 -0.43 0.00 -0.03 0.00 0.00 56.01 55.50 1r1d n LEU 179 Cb 0.04 -0.14 -0.02 0.00 -2.33 0.00 0.00 43.42 40.97 1r1d n LEU 179 CO 0.06 0.12 0.84 -0.69 -1.33 0.00 0.00 177.39 176.38 1r1d s VAL 180 N -3.07 4.73 0.00 4.08 1.01 -0.43 -4.74 120.40 121.97 1r1d s VAL 180 Ca 0.08 2.02 0.00 0.00 0.00 0.00 0.00 61.98 64.07 1r1d s VAL 180 Cb 0.16 -4.30 0.00 0.00 0.00 0.00 0.00 36.38 32.24 1r1d s VAL 180 CO 0.77 -0.05 0.00 -1.22 0.00 0.00 0.00 175.10 174.61 1r1d n TYR 181 N 5.40 0.00 -1.73 5.22 4.01 -1.26 -0.89 117.16 127.91 1r1d n TYR 181 Ca 0.10 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.46 1r1d n TYR 181 Cb 0.48 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.56 1r1d n TYR 181 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r1d n ALA 182 N -1.39 1.36 -1.61 -0.72 0.00 -1.26 -4.12 120.51 112.77 1r1d n ALA 182 Ca 0.00 0.08 -0.50 0.00 0.00 0.00 0.00 53.44 53.03 1r1d n ALA 182 Cb 0.19 -2.33 -0.05 0.00 0.00 0.00 0.00 19.45 17.26 1r1d n ALA 182 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1r1d n PRO 183 N -1.26 1.44 -4.33 0.00 -0.02 -1.26 -4.70 135.00 124.86 1r1d n PRO 183 Ca 0.12 0.52 -0.19 0.00 -2.02 0.00 0.00 63.50 61.93 1r1d n PRO 183 Cb 0.46 -2.16 -0.15 0.00 -0.02 0.00 0.00 33.50 31.63 1r1d n PRO 183 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1r1d s THR 184 N 0.41 0.68 -0.25 3.45 2.01 -0.60 -0.77 115.64 120.56 1r1d s THR 184 Ca 0.80 -0.33 0.03 0.00 0.31 0.00 0.00 61.69 62.49 1r1d s THR 184 Cb -0.85 -0.59 0.06 0.00 0.01 0.00 0.00 72.50 71.12 1r1d s THR 184 CO 0.46 0.21 -0.11 0.12 -0.69 0.00 0.00 174.62 174.60 1r1d s PHE 185 N 0.02 3.23 -0.25 4.92 5.36 -0.14 -0.51 117.98 130.60 1r1d s PHE 185 Ca -0.00 -2.25 -0.18 0.00 -0.96 0.00 0.00 56.93 53.54 1r1d s PHE 185 Cb -0.06 -1.94 -0.03 0.00 -0.34 0.00 0.00 43.02 40.66 1r1d s PHE 185 CO -0.00 -0.87 0.52 0.08 -1.46 0.00 0.00 175.22 173.49 1r1d s VAL 186 N 1.12 5.07 -0.10 3.12 1.01 0.56 -1.73 120.40 129.46 1r1d s VAL 186 Ca -0.08 0.90 -0.01 0.00 0.00 0.00 0.00 61.98 62.79 1r1d s VAL 186 Cb -0.19 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 1r1d s VAL 186 CO -0.06 0.09 -0.04 -0.69 0.00 0.00 0.00 175.10 174.41 1r1d s VAL 187 N 2.25 3.96 -0.20 2.92 1.01 0.13 -0.65 120.40 129.83 1r1d s VAL 187 Ca 0.22 -0.37 -0.15 0.00 0.00 0.00 0.00 61.98 61.67 1r1d s VAL 187 Cb -0.16 -2.66 0.06 0.00 0.00 0.00 0.00 36.38 33.62 1r1d s VAL 187 CO 0.09 0.57 0.51 -1.58 0.00 0.00 0.00 175.10 174.70 1r1d s GLN 188 N -0.54 0.56 -0.15 2.72 2.00 -0.82 -0.85 119.66 122.59 1r1d s GLN 188 Ca 0.08 0.82 -0.29 0.00 -2.00 0.00 0.00 55.36 53.97 1r1d s GLN 188 Cb -0.12 0.18 -0.01 0.00 0.80 0.00 0.00 33.01 33.87 1r1d s GLN 188 CO 0.02 -0.11 1.07 0.00 -0.50 0.00 0.00 175.29 175.78 1r1d s ALA 189 N 0.79 3.55 0.27 1.58 0.00 -1.26 -1.04 121.76 125.66 1r1d s ALA 189 Ca -0.04 0.34 -0.00 0.00 0.00 0.00 0.00 51.96 52.26 1r1d s ALA 189 Cb -0.05 -3.51 0.51 0.00 0.00 0.00 0.00 23.12 20.07 1r1d s ALA 189 CO -0.06 -0.86 1.82 -0.09 0.00 0.00 0.00 175.76 176.57 1r1d h ARG 190 N 7.41 0.87 -1.69 0.00 2.43 -1.52 -2.85 114.38 119.03 1r1d h ARG 190 Ca -0.26 -0.05 -0.69 0.00 -0.81 0.00 0.00 59.98 58.16 1r1d h ARG 190 Cb 1.11 -0.20 -0.33 0.00 -0.42 0.00 0.00 29.97 30.13 1r1d h ARG 190 CO 0.92 0.58 0.36 0.72 -1.51 0.00 0.00 179.97 181.04 1r1d n HIS 191 N -4.68 3.13 -1.93 2.20 8.25 -1.26 -4.87 115.22 116.06 1r1d n HIS 191 Ca 0.17 -2.64 -0.42 0.00 -0.26 0.00 0.00 57.72 54.57 1r1d n HIS 191 Cb 0.35 -0.80 -0.03 0.00 1.12 0.00 0.00 29.99 30.62 1r1d n HIS 191 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1r1d s ASP 192 N -2.09 6.59 -0.49 0.41 -1.08 -1.08 -4.79 116.67 114.14 1r1d s ASP 192 Ca 0.52 2.59 0.02 0.00 -0.52 0.00 0.00 52.55 55.16 1r1d s ASP 192 Cb 0.43 -2.59 0.57 0.00 -1.46 0.00 0.00 42.92 39.87 1r1d s ASP 192 CO -0.28 -0.84 1.92 -1.84 0.52 0.00 0.00 175.17 174.65 1r1d n GLU 193 N 4.30 2.30 -0.95 4.34 0.00 -1.26 -4.65 120.64 124.72 1r1d n GLU 193 Ca 0.14 -2.91 -0.38 0.00 0.00 0.00 0.00 57.16 54.02 1r1d n GLU 193 Cb 0.39 -2.14 0.05 0.00 0.00 0.00 0.00 31.44 29.74 1r1d n GLU 193 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 1r1d n ILE 195 N -0.96 0.00 -2.55 3.84 -5.35 -1.26 -5.10 119.36 107.98 1r1d n ILE 195 Ca 0.57 -0.11 -0.43 0.00 -0.27 0.00 0.00 62.75 62.51 1r1d n ILE 195 Cb 1.31 -0.09 -0.02 0.00 -1.74 0.00 0.00 39.64 39.10 1r1d n ILE 195 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 1r1d s ASN 196 N -1.13 6.79 0.63 7.28 3.84 -1.26 -4.89 114.94 126.20 1r1d s ASN 196 Ca 0.39 1.03 0.38 0.00 0.21 0.00 0.00 52.86 54.87 1r1d s ASN 196 Cb 0.04 -2.54 2.11 0.00 -0.55 0.00 0.00 41.25 40.30 1r1d s ASN 196 CO 0.68 -1.01 2.30 1.55 -2.79 0.00 0.00 177.10 177.83 1r1d h PRO 197 N 8.72 0.00 0.00 0.43 0.13 -1.88 -1.06 132.00 138.33 1r1d h PRO 197 Ca -0.23 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1r1d h PRO 197 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1r1d h PRO 197 CO 1.05 0.01 0.00 -3.47 -0.23 0.00 0.00 178.00 175.36 1r1d n ASP 198 N -3.40 0.37 -0.24 1.44 2.03 -1.26 -1.44 116.55 114.05 1r1d n ASP 198 Ca -0.03 0.66 0.17 0.00 0.52 0.00 0.00 54.79 56.11 1r1d n ASP 198 Cb 0.10 -0.71 0.48 0.00 -0.72 0.00 0.00 41.12 40.26 1r1d n ASP 198 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1r1d h SER 199 N 0.00 0.46 -0.78 1.67 0.02 -1.50 -0.87 113.55 112.55 1r1d h SER 199 Ca 0.00 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1r1d h SER 199 Cb 0.05 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.51 1r1d h SER 199 CO 0.00 0.20 0.40 0.00 -1.14 0.00 0.00 176.83 176.29 1r1d h ALA 200 N 1.62 1.22 -0.17 3.77 0.00 -1.49 -2.21 119.26 121.98 1r1d h ALA 200 Ca 0.45 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 55.10 1r1d h ALA 200 Cb 1.03 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1r1d h ALA 200 CO -0.18 0.61 -0.43 -0.91 0.00 0.00 0.00 179.25 178.34 1r1d h ASN 201 N 1.11 0.44 -0.42 0.00 2.35 -1.35 -1.70 115.58 116.02 1r1d h ASN 201 Ca 0.27 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.80 1r1d h ASN 201 Cb 0.08 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.30 1r1d h ASN 201 CO -0.04 0.82 0.16 0.40 -1.65 0.00 0.00 177.43 177.13 1r1d h ILE 202 N 0.34 1.20 0.21 2.81 2.04 -1.17 -1.19 117.51 121.76 1r1d h ILE 202 Ca 0.03 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 1r1d h ILE 202 Cb 0.90 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 37.82 1r1d h ILE 202 CO 0.08 0.23 -0.10 0.40 0.00 0.00 0.00 178.15 178.75 1r1d h ILE 203 N 0.53 0.86 -0.61 -0.67 2.04 -1.28 -0.90 117.51 117.48 1r1d h ILE 203 Ca 0.14 -0.39 0.06 0.00 1.00 0.00 0.00 64.86 65.67 1r1d h ILE 203 Cb 0.20 1.09 -0.05 0.00 -0.74 0.00 0.00 36.82 37.32 1r1d h ILE 203 CO -0.01 0.09 0.31 0.22 0.00 0.00 0.00 178.15 178.76 1r1d h TYR 204 N -0.47 0.57 0.02 1.37 3.20 -1.29 -2.31 116.97 118.06 1r1d h TYR 204 Ca -0.03 0.02 -0.22 0.00 3.14 0.00 0.00 58.73 61.65 1r1d h TYR 204 Cb 0.36 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 1r1d h TYR 204 CO -0.01 0.26 -1.03 -0.91 -1.64 0.00 0.00 178.16 174.83 1r1d h ASN 205 N 0.59 0.08 0.67 -2.11 2.35 -1.19 -3.37 115.58 112.60 1r1d h ASN 205 Ca 0.28 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1r1d h ASN 205 Cb 0.20 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.54 1r1d h ASN 205 CO -0.19 1.06 -1.07 -0.62 -1.65 0.00 0.00 177.43 174.95 1r1d n GLU 206 N -3.40 0.46 -1.36 0.81 1.02 -0.35 -4.91 120.64 112.92 1r1d n GLU 206 Ca -0.02 0.04 -0.31 0.00 -0.02 0.00 0.00 57.16 56.85 1r1d n GLU 206 Cb 0.94 -1.69 0.08 0.00 -0.02 0.00 0.00 31.44 30.75 1r1d n GLU 206 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 1r1d s ILE 207 N -3.30 3.51 -1.06 -3.67 -4.36 -0.88 -3.38 121.20 108.06 1r1d s ILE 207 Ca 0.01 0.49 0.22 0.00 -0.26 0.00 0.00 60.65 61.11 1r1d s ILE 207 Cb 0.12 -3.06 -0.14 0.00 1.25 0.00 0.00 42.46 40.63 1r1d s ILE 207 CO 0.80 -0.64 1.08 -0.62 0.24 0.00 0.00 174.94 175.80 1r1d n GLU 208 N -3.42 0.06 -1.64 0.37 -0.58 -0.07 -4.92 120.64 110.45 1r1d n GLU 208 Ca 0.08 -0.05 -0.61 0.00 -0.42 0.00 0.00 57.16 56.17 1r1d n GLU 208 Cb 0.53 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.82 1r1d n GLU 208 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1r1d n SER 209 N -1.42 1.12 0.16 1.62 7.64 -0.90 -4.84 113.62 117.00 1r1d n SER 209 Ca 0.05 1.15 0.03 0.00 1.01 0.00 0.00 58.87 61.11 1r1d n SER 209 Cb 0.34 -0.99 0.41 0.00 -1.01 0.00 0.00 64.21 62.96 1r1d n SER 209 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1r1d h PRO 210 N 4.73 0.14 -4.60 1.43 0.11 -1.91 -3.35 132.00 128.55 1r1d h PRO 210 Ca -0.47 -0.03 -0.70 0.00 0.11 0.00 0.00 66.00 64.91 1r1d h PRO 210 Cb 1.37 -0.02 -0.31 0.00 0.11 0.00 0.00 31.00 32.16 1r1d h PRO 210 CO 0.84 0.33 -0.58 0.08 -0.21 0.00 0.00 178.00 178.46 1r1d s VAL 211 N -4.61 3.58 0.01 3.15 1.01 -1.26 -5.06 120.40 117.21 1r1d s VAL 211 Ca -0.05 -1.49 0.00 0.00 0.00 0.00 0.00 61.98 60.45 1r1d s VAL 211 Cb 0.15 -3.18 -0.01 0.00 0.00 0.00 0.00 36.38 33.35 1r1d s VAL 211 CO 0.72 -0.37 -0.02 -1.59 0.00 0.00 0.00 175.10 173.84 1r1d s LYS 212 N 1.31 0.16 0.05 2.72 -2.85 -1.26 -1.56 119.74 118.31 1r1d s LYS 212 Ca 0.01 -0.25 0.01 0.00 -1.00 0.00 0.00 55.97 54.74 1r1d s LYS 212 Cb -0.21 -0.02 -0.03 0.00 -2.06 0.00 0.00 37.83 35.51 1r1d s LYS 212 CO -0.00 -0.00 -0.05 -0.65 0.10 0.00 0.00 175.35 174.75 1r1d s GLN 213 N -0.55 0.57 -0.00 1.78 -1.52 0.33 -4.98 119.66 115.29 1r1d s GLN 213 Ca -0.05 -0.99 0.00 0.00 -1.95 0.00 0.00 55.36 52.37 1r1d s GLN 213 Cb -0.04 -0.03 -0.00 0.00 -0.22 0.00 0.00 33.01 32.72 1r1d s GLN 213 CO -0.00 -0.04 -0.00 -1.50 -0.25 0.00 0.00 175.29 173.50 1r1d s ILE 214 N -2.64 0.00 -0.03 1.08 2.07 -1.26 -0.32 121.20 120.10 1r1d s ILE 214 Ca -0.02 -0.00 -0.01 0.00 -1.41 0.00 0.00 60.65 59.21 1r1d s ILE 214 Cb -0.01 -0.01 0.03 0.00 0.13 0.00 0.00 42.46 42.59 1r1d s ILE 214 CO -0.04 0.00 0.06 -0.75 -1.91 0.00 0.00 174.94 172.30 1r1d s LYS 215 N -0.00 0.01 0.00 3.50 2.20 0.18 -4.93 119.74 120.71 1r1d s LYS 215 Ca 0.00 0.20 -0.04 0.00 -0.36 0.00 0.00 55.97 55.77 1r1d s LYS 215 Cb -0.00 -0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.11 1r1d s LYS 215 CO -0.00 -0.13 0.22 -1.58 -0.36 0.00 0.00 175.35 173.50 1r1d s TRP 216 N 0.84 3.55 -0.22 4.03 0.52 -1.26 -1.94 118.94 124.46 1r1d s TRP 216 Ca -0.07 0.43 0.01 0.00 0.02 0.00 0.00 56.10 56.49 1r1d s TRP 216 Cb -0.09 -1.88 0.04 0.00 -1.15 0.00 0.00 33.47 30.38 1r1d s TRP 216 CO -0.03 0.63 -0.14 0.71 0.02 0.00 0.00 176.95 178.14 1r1d s TYR 217 N -1.34 3.02 -0.31 -1.98 2.02 -0.20 -4.93 117.35 113.62 1r1d s TYR 217 Ca 0.28 -1.87 0.27 0.00 -0.37 0.00 0.00 57.07 55.39 1r1d s TYR 217 Cb -0.13 -1.95 0.95 0.00 -0.40 0.00 0.00 41.96 40.43 1r1d s TYR 217 CO 0.18 -0.82 1.80 0.93 -1.57 0.00 0.00 175.55 176.07 1r1d h GLU 218 N 7.90 0.00 -0.14 -0.62 4.39 -1.96 -1.53 114.58 122.61 1r1d h GLU 218 Ca -0.34 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.23 1r1d h GLU 218 Cb 1.10 0.00 -0.18 0.00 -0.10 0.00 0.00 28.75 29.56 1r1d h GLU 218 CO 0.56 0.00 -0.72 1.04 -1.16 0.00 0.00 179.01 178.73 1r1d n GLN 219 N -2.73 1.50 -4.40 2.33 6.02 -1.26 -4.79 117.38 114.06 1r1d n GLN 219 Ca 0.03 -3.13 -0.27 0.00 -0.01 0.00 0.00 57.00 53.62 1r1d n GLN 219 Cb 0.36 -1.32 -0.12 0.00 1.02 0.00 0.00 30.24 30.18 1r1d n GLN 219 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1r1d s SER 220 N -3.02 3.28 0.37 1.08 0.01 -1.25 -4.68 113.70 109.49 1r1d s SER 220 Ca 0.38 -0.82 0.00 0.00 1.31 0.00 0.00 55.95 56.82 1r1d s SER 220 Cb 0.38 -0.23 0.01 0.00 0.21 0.00 0.00 66.02 66.39 1r1d s SER 220 CO -0.08 0.12 0.06 0.61 0.41 0.00 0.00 173.24 174.36 1r1d n GLY 221 N 0.51 0.86 0.16 3.44 0.00 -1.26 -4.46 105.19 104.44 1r1d n GLY 221 Ca -0.15 -1.97 -0.05 0.00 0.00 0.00 0.00 46.02 43.85 1r1d n GLY 221 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1r1d h HIS 222 N -0.36 0.07 -0.41 1.61 2.76 -1.94 -3.20 115.15 113.68 1r1d h HIS 222 Ca -0.02 0.02 -0.72 0.00 -2.20 0.00 0.00 60.37 57.45 1r1d h HIS 222 Cb 0.07 0.02 -0.07 0.00 1.55 0.00 0.00 27.41 28.98 1r1d h HIS 222 CO 0.00 -0.01 2.82 0.28 -1.30 0.00 0.00 177.93 179.72 1r1d n VAL 223 N -5.13 3.73 0.22 5.26 0.31 -1.26 -4.76 118.33 116.71 1r1d n VAL 223 Ca 0.02 -3.42 0.14 0.00 -0.01 0.00 0.00 64.34 61.07 1r1d n VAL 223 Cb 0.17 -2.53 0.77 0.00 -0.91 0.00 0.00 33.84 31.34 1r1d n VAL 223 CO 0.00 0.00 0.00 -0.29 -1.32 0.00 0.00 176.83 175.22 1r1d h ILE 224 N 3.90 0.71 0.00 2.52 2.10 -1.95 -1.77 117.51 123.02 1r1d h ILE 224 Ca 0.52 0.00 -0.03 0.00 1.08 0.00 0.00 64.86 66.43 1r1d h ILE 224 Cb 0.63 0.92 -0.00 0.00 -1.09 0.00 0.00 36.82 37.28 1r1d h ILE 224 CO 1.81 0.00 -0.17 0.71 -1.08 0.00 0.00 178.15 179.43 1r1d h THR 225 N 0.00 0.60 -0.02 2.19 1.35 -1.86 -3.04 112.91 112.13 1r1d h THR 225 Ca 0.06 -0.74 0.00 0.00 -0.55 0.00 0.00 66.41 65.17 1r1d h THR 225 Cb 0.27 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1r1d h THR 225 CO -0.00 0.16 -0.01 0.18 -0.25 0.00 0.00 175.52 175.60 1r1d n LEU 226 N -3.59 2.40 0.00 3.87 4.77 -0.67 -4.80 117.00 118.98 1r1d n LEU 226 Ca -0.01 -0.99 -0.18 0.00 -0.03 0.00 0.00 56.01 54.79 1r1d n LEU 226 Cb 0.30 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.48 1r1d n LEU 226 CO 0.31 0.42 0.42 -0.67 -1.33 0.00 0.00 177.39 176.55 1r1d n ASP 227 N 0.92 1.24 0.04 -1.43 4.64 -1.15 -5.00 116.55 115.81 1r1d n ASP 227 Ca 0.10 -2.00 0.04 0.00 -1.38 0.00 0.00 54.79 51.55 1r1d n ASP 227 Cb 0.43 -0.49 0.18 0.00 -1.04 0.00 0.00 41.12 40.20 1r1d n ASP 227 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1r1d n GLN 228 N -2.40 0.04 -0.38 -0.67 10.64 -1.26 -2.44 117.38 120.90 1r1d n GLN 228 Ca 0.13 0.49 0.08 0.00 -1.83 0.00 0.00 57.00 55.87 1r1d n GLN 228 Cb 0.48 -1.61 0.24 0.00 -0.86 0.00 0.00 30.24 28.50 1r1d n GLN 228 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1r1d n GLU 229 N -1.68 3.10 -0.12 2.61 1.02 -1.26 -4.69 120.64 119.62 1r1d n GLU 229 Ca 0.00 -2.56 0.08 0.00 -0.02 0.00 0.00 57.16 54.67 1r1d n GLU 229 Cb 0.04 -1.64 0.42 0.00 -0.02 0.00 0.00 31.44 30.23 1r1d n GLU 229 CO 0.00 0.00 0.00 1.57 1.18 0.00 0.00 177.13 179.88 1r1d h LYS 230 N 2.33 0.58 -0.53 3.49 2.10 -1.67 -0.10 116.57 122.76 1r1d h LYS 230 Ca 0.00 -0.03 -0.04 0.00 -2.00 0.00 0.00 60.65 58.57 1r1d h LYS 230 Cb 1.19 -0.13 -0.02 0.00 -0.90 0.00 0.00 32.23 32.37 1r1d h LYS 230 CO 0.15 0.38 0.17 -0.44 -2.00 0.00 0.00 179.45 177.71 1r1d h ASP 231 N 0.60 0.76 -0.54 7.07 3.32 -1.86 0.21 116.42 125.98 1r1d h ASP 231 Ca 0.28 -0.20 -0.11 0.00 0.02 0.00 0.00 57.03 57.01 1r1d h ASP 231 Cb 0.32 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1r1d h ASP 231 CO -0.08 0.76 -0.08 -0.61 -1.72 0.00 0.00 179.24 177.51 1r1d h GLN 232 N 0.72 1.03 -0.31 3.56 5.75 -1.62 -2.20 115.11 122.04 1r1d h GLN 232 Ca 0.17 -0.36 0.04 0.00 -0.15 0.00 0.00 58.65 58.34 1r1d h GLN 232 Cb 0.27 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 28.71 1r1d h GLN 232 CO -0.01 1.05 0.11 1.25 -2.65 0.00 0.00 178.83 178.58 1r1d h LEU 233 N 0.92 0.11 -0.21 -2.39 5.85 -0.64 -0.69 115.31 118.26 1r1d h LEU 233 Ca 0.15 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.95 1r1d h LEU 233 Cb 0.64 0.02 -0.05 0.00 0.37 0.00 0.00 40.66 41.65 1r1d h LEU 233 CO 0.04 0.10 -0.09 0.45 -0.34 0.00 0.00 178.44 178.60 1r1d h HIS 234 N 0.24 -0.22 -0.92 1.25 3.86 -0.39 -1.08 115.15 117.89 1r1d h HIS 234 Ca 0.14 0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.38 1r1d h HIS 234 Cb 0.11 0.13 -0.05 0.00 1.06 0.00 0.00 27.41 28.67 1r1d h HIS 234 CO -0.14 -0.15 0.60 0.93 0.86 0.00 0.00 177.93 180.04 1r1d h GLU 235 N -0.07 1.22 -0.63 2.45 4.39 -1.05 -1.28 114.58 119.61 1r1d h GLU 235 Ca 0.11 -0.08 -0.09 0.00 0.34 0.00 0.00 59.36 59.64 1r1d h GLU 235 Cb 0.23 -0.27 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 1r1d h GLU 235 CO -0.25 0.81 0.05 -0.44 -1.16 0.00 0.00 179.01 178.02 1r1d h ASP 236 N 1.25 1.05 -0.43 1.42 3.32 -0.47 -0.54 116.42 122.01 1r1d h ASP 236 Ca 0.34 -0.28 -0.14 0.00 0.02 0.00 0.00 57.03 56.96 1r1d h ASP 236 Cb -0.13 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.13 1r1d h ASP 236 CO -0.07 1.07 -0.29 0.40 -1.72 0.00 0.00 179.24 178.62 1r1d h ILE 237 N 0.99 1.27 -0.01 0.35 2.04 -0.96 -0.34 117.51 120.85 1r1d h ILE 237 Ca 0.18 -1.46 -0.00 0.00 1.00 0.00 0.00 64.86 64.58 1r1d h ILE 237 Cb 0.50 1.26 -0.00 0.00 -0.74 0.00 0.00 36.82 37.84 1r1d h ILE 237 CO 0.02 0.50 0.00 0.22 0.00 0.00 0.00 178.15 178.89 1r1d h TYR 238 N 0.80 0.01 -0.82 1.37 3.20 -1.13 0.46 116.97 120.86 1r1d h TYR 238 Ca 0.09 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.97 1r1d h TYR 238 Cb 0.88 -0.00 -0.04 0.00 1.54 0.00 0.00 36.73 39.11 1r1d h TYR 238 CO 0.06 0.12 0.54 0.00 -1.64 0.00 0.00 178.16 177.24 1r1d h ALA 239 N 0.89 1.45 -0.20 1.82 0.00 -0.96 0.56 119.26 122.82 1r1d h ALA 239 Ca 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1r1d h ALA 239 Cb 0.11 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1r1d h ALA 239 CO -0.00 0.49 -0.02 0.35 0.00 0.00 0.00 179.25 180.08 1r1d h PHE 240 N 1.07 0.40 -0.80 0.00 3.57 -0.71 -2.10 116.94 118.38 1r1d h PHE 240 Ca 0.31 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1r1d h PHE 240 Cb -0.06 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 38.53 1r1d h PHE 240 CO -0.00 0.58 0.52 -0.07 -2.23 0.00 0.00 178.31 177.11 1r1d h LEU 241 N 0.11 0.93 -2.01 0.59 3.38 -0.19 -1.66 115.31 116.46 1r1d h LEU 241 Ca 0.05 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1r1d h LEU 241 Cb 0.43 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1r1d h LEU 241 CO 0.01 0.69 -0.09 -0.33 0.09 0.00 0.00 178.44 178.82 1r1d h GLU 242 N 1.09 0.00 0.00 1.13 4.39 -0.80 -1.91 114.58 118.48 1r1d h GLU 242 Ca 0.29 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.99 1r1d h GLU 242 Cb -0.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.55 1r1d h GLU 242 CO -0.06 0.09 0.00 -1.13 -1.16 0.00 0.00 179.01 176.75 1r1d n SER 243 N -3.99 0.00 -4.88 1.42 3.41 -0.63 -4.85 113.62 104.09 1r1d n SER 243 Ca -0.02 -0.51 -0.29 0.00 -0.26 0.00 0.00 58.87 57.78 1r1d n SER 243 Cb 0.18 -0.15 -0.02 0.00 -0.26 0.00 0.00 64.21 63.95 1r1d n SER 243 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1r1d s LEU 244 N -2.30 3.76 0.09 1.04 1.43 -0.72 -5.02 118.68 116.96 1r1d s LEU 244 Ca 0.36 1.07 -0.29 0.00 -1.03 0.00 0.00 54.13 54.24 1r1d s LEU 244 Cb 0.20 -3.97 -0.15 0.00 0.03 0.00 0.00 46.19 42.30 1r1d s LEU 244 CO 0.40 -0.46 1.66 0.44 0.23 0.00 0.00 176.35 178.62 1r1d h ASP 245 N 0.92 -0.55 0.00 2.29 3.32 -1.88 -3.51 116.42 117.01 1r1d h ASP 245 Ca -0.47 0.04 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1r1d h ASP 245 Cb 1.19 0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.91 1r1d h ASP 245 CO 0.63 -0.35 0.00 0.79 -1.72 0.00 0.00 179.24 178.60