#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h0p n GLN 3 N 0.00 2.73 -4.38 -0.78 1.13 -1.26 -4.51 117.38 110.32 3h0p n GLN 3 Ca 0.00 -2.60 -0.24 0.00 -1.94 0.00 0.00 57.00 52.22 3h0p n GLN 3 Cb 0.00 -1.54 -0.11 0.00 0.11 0.00 0.00 30.24 28.70 3h0p n GLN 3 CO 0.00 0.00 0.00 -0.59 -1.44 0.00 0.00 177.06 175.03 3h0p s PHE 4 N -1.02 2.04 0.20 1.08 -0.12 -1.26 0.08 117.98 118.99 3h0p s PHE 4 Ca 0.46 -0.42 0.10 0.00 -0.05 0.00 0.00 56.93 57.03 3h0p s PHE 4 Cb 0.24 -1.00 -0.04 0.00 -0.63 0.00 0.00 43.02 41.58 3h0p s PHE 4 CO 0.32 0.43 -0.20 0.00 -0.05 0.00 0.00 175.22 175.72 3h0p s ALA 5 N -1.95 2.32 -0.18 1.99 0.00 -0.75 -0.20 121.76 122.99 3h0p s ALA 5 Ca 0.19 -1.64 -0.06 0.00 0.00 0.00 0.00 51.96 50.45 3h0p s ALA 5 Cb -0.06 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.79 3h0p s ALA 5 CO 0.09 0.28 0.02 -0.06 0.00 0.00 0.00 175.76 176.08 3h0p s PHE 6 N -2.15 3.14 -0.05 0.00 0.08 -0.37 -1.28 117.98 117.35 3h0p s PHE 6 Ca 0.21 -0.14 0.05 0.00 0.12 0.00 0.00 56.93 57.18 3h0p s PHE 6 Cb -0.06 -2.04 -0.02 0.00 -0.57 0.00 0.00 43.02 40.33 3h0p s PHE 6 CO 0.09 0.02 -0.21 0.14 -0.10 0.00 0.00 175.22 175.17 3h0p s VAL 7 N 0.48 2.49 -0.20 -0.44 -7.23 -0.28 -1.69 120.40 113.54 3h0p s VAL 7 Ca 0.00 -0.93 -0.02 0.00 -1.81 0.00 0.00 61.98 59.22 3h0p s VAL 7 Cb -0.13 -1.93 0.00 0.00 0.56 0.00 0.00 36.38 34.88 3h0p s VAL 7 CO 0.02 0.58 -0.10 -0.36 -0.31 0.00 0.00 175.10 174.92 3h0p s PHE 8 N -0.49 2.88 0.76 2.82 0.08 -0.14 -0.86 117.98 123.04 3h0p s PHE 8 Ca 0.06 -1.14 -0.12 0.00 0.12 0.00 0.00 56.93 55.85 3h0p s PHE 8 Cb -0.11 -2.02 0.05 0.00 -0.57 0.00 0.00 43.02 40.37 3h0p s PHE 8 CO 0.01 -0.60 1.11 -1.25 -0.10 0.00 0.00 175.22 174.39 3h0p s PRO 9 N 1.30 2.39 0.00 0.24 0.04 -1.26 -0.92 135.00 136.78 3h0p s PRO 9 Ca 0.04 0.44 0.00 0.00 0.04 0.00 0.00 61.00 61.52 3h0p s PRO 9 Cb -0.14 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.43 3h0p s PRO 9 CO -0.05 -1.36 0.00 0.41 0.04 0.00 0.00 177.00 176.03 3h0p n GLY 10 N -2.76 6.09 3.57 0.56 0.00 -1.22 -3.70 105.19 107.73 3h0p n GLY 10 Ca 0.07 -1.91 -0.50 0.00 0.00 0.00 0.00 46.02 43.68 3h0p n GLY 10 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3h0p n GLN 11 N 0.00 1.08 0.00 1.61 -0.06 -1.26 -2.33 117.38 116.41 3h0p n GLN 11 Ca 0.00 0.38 0.00 0.00 -2.00 0.00 0.00 57.00 55.38 3h0p n GLN 11 Cb 0.00 -1.92 0.00 0.00 -4.06 0.00 0.00 30.24 24.26 3h0p n GLN 11 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 3h0p n GLY 12 N 2.14 2.56 0.00 1.69 0.00 -1.26 -4.92 105.19 105.40 3h0p n GLY 12 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 3h0p n GLY 12 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h0p n SER 13 N 0.00 0.42 -4.82 1.61 7.64 -0.98 -4.92 113.62 112.56 3h0p n SER 13 Ca 0.00 -0.13 -0.32 0.00 1.01 0.00 0.00 58.87 59.44 3h0p n SER 13 Cb 0.00 0.12 0.02 0.00 -1.01 0.00 0.00 64.21 63.35 3h0p n SER 13 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h0p s GLN 14 N -3.00 3.25 -0.10 1.43 0.00 -1.26 -3.92 119.66 116.06 3h0p s GLN 14 Ca 0.12 1.03 -0.30 0.00 -0.00 0.00 0.00 55.36 56.20 3h0p s GLN 14 Cb 0.18 -2.03 0.08 0.00 0.00 0.00 0.00 33.01 31.24 3h0p s GLN 14 CO 0.67 -0.85 0.75 -1.54 0.00 0.00 0.00 175.29 174.32 3h0p s SER 15 N -3.37 -0.61 0.04 12.60 1.04 -1.26 -5.04 113.70 117.09 3h0p s SER 15 Ca 0.60 0.75 -0.30 0.00 0.48 0.00 0.00 55.95 57.48 3h0p s SER 15 Cb -0.14 0.61 -0.07 0.00 0.10 0.00 0.00 66.02 66.52 3h0p s SER 15 CO 0.45 -0.51 1.57 -0.69 0.98 0.00 0.00 173.24 175.04 3h0p s VAL 16 N -0.95 3.29 0.00 5.02 1.01 -1.26 -4.90 120.40 122.60 3h0p s VAL 16 Ca -0.08 0.70 0.00 0.00 0.00 0.00 0.00 61.98 62.60 3h0p s VAL 16 Cb -0.01 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 32.92 3h0p s VAL 16 CO 0.07 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.78 3h0p n GLY 17 N 3.88 0.28 0.00 4.51 0.00 0.90 -4.98 105.19 109.78 3h0p n GLY 17 Ca 0.15 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.44 3h0p n GLY 17 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3h0p n LEU 19 N 0.00 0.00 -0.14 0.99 4.32 -1.26 -4.70 117.00 116.21 3h0p n LEU 19 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 56.01 55.93 3h0p n LEU 19 Cb 0.00 0.00 0.03 0.00 -1.62 0.00 0.00 43.42 41.83 3h0p n LEU 19 CO 0.00 0.00 1.00 0.00 -1.22 0.00 0.00 177.39 177.17 3h0p h ALA 20 N 0.00 0.55 0.00 -1.18 0.00 -1.98 -0.21 119.26 116.44 3h0p h ALA 20 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3h0p h ALA 20 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3h0p h ALA 20 CO 0.00 -0.14 0.00 0.39 0.00 0.00 0.00 179.25 179.50 3h0p n GLU 21 N -4.92 0.46 0.00 0.00 -0.58 -1.26 -2.07 120.64 112.27 3h0p n GLU 21 Ca 0.03 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.77 3h0p n GLU 21 Cb 0.11 -1.26 0.00 0.00 -0.57 0.00 0.00 31.44 29.72 3h0p n GLU 21 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3h0p n ALA 23 N 0.67 0.00 0.22 0.62 0.00 -0.09 -1.68 120.51 120.25 3h0p n ALA 23 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.53 3h0p n ALA 23 Cb 0.21 0.00 0.46 0.00 0.00 0.00 0.00 19.45 20.11 3h0p n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h0p h ALA 24 N 0.00 1.06 0.21 0.00 0.00 -1.67 -3.17 119.26 115.69 3h0p h ALA 24 Ca 0.00 -0.24 -0.30 0.00 0.00 0.00 0.00 54.91 54.37 3h0p h ALA 24 Cb 0.00 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 17.78 3h0p h ALA 24 CO 0.00 0.32 -1.37 -0.97 0.00 0.00 0.00 179.25 177.23 3h0p h ASN 25 N 0.00 0.70 -3.25 0.00 -0.00 -1.61 -3.45 115.58 107.97 3h0p h ASN 25 Ca -0.00 -0.93 -0.45 0.00 -0.00 0.00 0.00 56.30 54.92 3h0p h ASN 25 Cb 0.73 -0.23 -0.39 0.00 -0.00 0.00 0.00 38.32 38.44 3h0p h ASN 25 CO 0.03 1.65 -0.77 -0.31 -0.00 0.00 0.00 177.43 178.04 3h0p s TYR 26 N -2.55 0.71 0.61 0.67 2.02 -1.20 -5.01 117.35 112.60 3h0p s TYR 26 Ca -0.12 -0.29 0.43 0.00 -0.37 0.00 0.00 57.07 56.72 3h0p s TYR 26 Cb 0.04 -0.84 2.29 0.00 -0.40 0.00 0.00 41.96 43.05 3h0p s TYR 26 CO 0.90 -0.38 2.33 -1.35 -1.57 0.00 0.00 175.55 175.47 3h0p h PRO 27 N 8.32 0.00 0.00 -1.71 0.11 -1.89 -2.00 132.00 134.83 3h0p h PRO 27 Ca -0.19 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.92 3h0p h PRO 27 Cb 1.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3h0p h PRO 27 CO 0.27 0.00 -0.01 0.97 -0.21 0.00 0.00 178.00 179.03 3h0p h ILE 28 N 0.00 0.03 0.59 4.15 2.10 -1.95 -2.33 117.51 120.09 3h0p h ILE 28 Ca -0.00 -0.28 -0.03 0.00 1.08 0.00 0.00 64.86 65.63 3h0p h ILE 28 Cb 0.05 1.27 0.01 0.00 -1.09 0.00 0.00 36.82 37.06 3h0p h ILE 28 CO 0.00 0.01 -0.28 0.58 -1.08 0.00 0.00 178.15 177.37 3h0p h VAL 29 N 0.00 0.35 0.00 2.19 2.07 -1.67 -1.63 116.25 117.57 3h0p h VAL 29 Ca -0.00 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.25 3h0p h VAL 29 Cb 0.27 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 3h0p h VAL 29 CO 0.00 0.03 -0.20 -0.33 0.02 0.00 0.00 177.57 177.09 3h0p h GLU 30 N -0.95 0.00 -0.04 1.57 5.08 -1.72 -1.33 114.58 117.19 3h0p h GLU 30 Ca -0.08 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.15 3h0p h GLU 30 Cb 0.66 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.89 3h0p h GLU 30 CO 0.13 0.20 -0.57 0.93 -1.00 0.00 0.00 179.01 178.70 3h0p h GLU 31 N 0.00 0.13 -0.21 2.33 5.08 -1.33 -0.07 114.58 120.51 3h0p h GLU 31 Ca -0.00 -0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 58.18 3h0p h GLU 31 Cb 0.51 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 3h0p h GLU 31 CO 0.03 0.67 -0.23 1.15 -1.00 0.00 0.00 179.01 179.62 3h0p h THR 32 N 0.10 1.33 -0.28 1.13 2.02 -0.49 -2.63 112.91 114.09 3h0p h THR 32 Ca -0.00 -1.40 -0.03 0.00 0.77 0.00 0.00 66.41 65.74 3h0p h THR 32 Cb 1.04 1.75 -0.02 0.00 -1.74 0.00 0.00 68.15 69.18 3h0p h THR 32 CO 0.08 0.43 0.03 -0.26 0.37 0.00 0.00 175.52 176.18 3h0p h PHE 33 N 0.21 0.41 -0.64 3.16 0.04 -1.10 -2.36 116.94 116.67 3h0p h PHE 33 Ca 0.03 -0.02 -0.07 0.00 2.80 0.00 0.00 57.97 60.70 3h0p h PHE 33 Cb 0.78 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 38.78 3h0p h PHE 33 CO 0.08 0.39 0.11 0.00 -0.60 0.00 0.00 178.31 178.29 3h0p h ALA 34 N 1.64 0.98 -0.57 2.45 0.00 -0.88 0.32 119.26 123.21 3h0p h ALA 34 Ca 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 3h0p h ALA 34 Cb 0.22 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3h0p h ALA 34 CO 0.00 0.64 0.28 0.93 0.00 0.00 0.00 179.25 181.10 3h0p h GLU 35 N 0.97 0.81 -0.54 0.00 5.08 -1.08 -1.44 114.58 118.39 3h0p h GLU 35 Ca 0.20 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.39 3h0p h GLU 35 Cb 0.42 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 3h0p h GLU 35 CO 0.01 0.65 0.11 0.00 -1.00 0.00 0.00 179.01 178.79 3h0p h ALA 36 N 1.11 0.71 -0.81 3.43 0.00 -0.87 -2.62 119.26 120.22 3h0p h ALA 36 Ca 0.20 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.88 3h0p h ALA 36 Cb 0.10 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3h0p h ALA 36 CO -0.03 0.43 0.53 0.77 0.00 0.00 0.00 179.25 180.95 3h0p h SER 37 N 0.77 0.94 -0.23 0.00 0.02 -0.14 -0.16 113.55 114.74 3h0p h SER 37 Ca 0.17 -0.03 -0.11 0.00 -0.84 0.00 0.00 61.79 60.98 3h0p h SER 37 Cb 0.37 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.66 3h0p h SER 37 CO 0.01 0.68 -0.23 0.00 -1.14 0.00 0.00 176.83 176.15 3h0p h ALA 38 N 1.48 0.94 -0.28 3.77 0.00 -1.07 0.98 119.26 125.08 3h0p h ALA 38 Ca 0.30 -0.36 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 3h0p h ALA 38 Cb -0.12 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3h0p h ALA 38 CO -0.06 0.61 -0.46 0.00 0.00 0.00 0.00 179.25 179.33 3h0p h ALA 39 N 1.14 0.65 0.04 0.00 0.00 -1.00 -3.32 119.26 116.77 3h0p h ALA 39 Ca 0.09 -0.48 -0.26 0.00 0.00 0.00 0.00 54.91 54.25 3h0p h ALA 39 Cb 0.71 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 3h0p h ALA 39 CO 0.05 0.67 -1.37 -0.07 0.00 0.00 0.00 179.25 178.54 3h0p h LEU 40 N 0.59 0.12 0.00 0.00 3.38 -0.89 -3.48 115.31 115.03 3h0p h LEU 40 Ca 0.03 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3h0p h LEU 40 Cb 1.03 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.74 3h0p h LEU 40 CO 0.10 1.13 0.00 0.61 0.09 0.00 0.00 178.44 180.37 3h0p n GLY 41 N 1.51 0.83 3.45 0.83 0.00 0.32 -5.07 105.19 107.06 3h0p n GLY 41 Ca -0.10 -0.10 -0.10 0.00 0.00 0.00 0.00 46.02 45.72 3h0p n GLY 41 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3h0p s TYR 42 N -2.00 -0.01 -0.84 1.61 -0.85 -1.14 -5.06 117.35 109.06 3h0p s TYR 42 Ca 0.00 -0.34 -0.25 0.00 -0.52 0.00 0.00 57.07 55.96 3h0p s TYR 42 Cb 0.00 0.27 0.05 0.00 0.38 0.00 0.00 41.96 42.66 3h0p s TYR 42 CO 0.00 -0.84 1.30 0.34 -1.52 0.00 0.00 175.55 174.82 3h0p s ASP 43 N -2.89 6.31 0.20 -0.18 -1.08 -1.26 -4.38 116.67 113.40 3h0p s ASP 43 Ca 0.10 -0.97 -0.08 0.00 -0.52 0.00 0.00 52.55 51.08 3h0p s ASP 43 Cb 0.00 -2.54 0.11 0.00 -1.46 0.00 0.00 42.92 39.04 3h0p s ASP 43 CO -0.03 -1.63 1.69 0.25 0.52 0.00 0.00 175.17 175.97 3h0p h LEU 44 N 12.59 1.06 -0.66 -1.34 5.85 -1.90 -2.58 115.31 128.32 3h0p h LEU 44 Ca -0.08 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.41 3h0p h LEU 44 Cb 1.04 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.74 3h0p h LEU 44 CO 1.31 1.06 0.40 -0.25 -0.34 0.00 0.00 178.44 180.62 3h0p h TRP 45 N 1.02 0.75 -0.65 1.25 2.91 -1.88 -1.49 115.95 117.86 3h0p h TRP 45 Ca 0.20 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.24 3h0p h TRP 45 Cb 0.46 -0.24 -0.03 0.00 -0.51 0.00 0.00 29.16 28.84 3h0p h TRP 45 CO 0.03 0.41 0.39 0.00 -1.03 0.00 0.00 178.44 178.24 3h0p h ALA 46 N 1.30 0.83 -0.18 2.65 0.00 -1.90 -1.31 119.26 120.64 3h0p h ALA 46 Ca 0.27 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 55.14 3h0p h ALA 46 Cb 0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3h0p h ALA 46 CO -0.12 0.31 -0.04 1.25 0.00 0.00 0.00 179.25 180.65 3h0p h LEU 47 N 0.88 -0.16 -1.55 0.00 5.85 -1.07 0.26 115.31 119.52 3h0p h LEU 47 Ca 0.23 0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.97 3h0p h LEU 47 Cb -0.01 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 3h0p h LEU 47 CO -0.04 -0.05 -0.13 0.71 -0.34 0.00 0.00 178.44 178.59 3h0p h THR 48 N 0.01 1.14 0.04 1.05 1.35 -0.71 0.29 112.91 116.07 3h0p h THR 48 Ca 0.09 -0.64 -0.33 0.00 -0.55 0.00 0.00 66.41 64.98 3h0p h THR 48 Cb 0.13 1.22 -0.05 0.00 -1.73 0.00 0.00 68.15 67.73 3h0p h THR 48 CO -0.18 0.19 -1.95 0.00 -0.25 0.00 0.00 175.52 173.33 3h0p n GLN 49 N -4.32 0.68 -0.01 4.72 1.13 -0.54 -0.07 117.38 118.96 3h0p n GLN 49 Ca -0.01 0.23 0.08 0.00 -1.94 0.00 0.00 57.00 55.36 3h0p n GLN 49 Cb 0.24 -1.71 -0.13 0.00 0.11 0.00 0.00 30.24 28.75 3h0p n GLN 49 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3h0p n GLN 50 N -3.14 0.55 0.00 -1.09 6.02 0.89 -4.14 117.38 116.46 3h0p n GLN 50 Ca -0.26 -0.15 0.00 0.00 -0.01 0.00 0.00 57.00 56.59 3h0p n GLN 50 Cb 1.06 -1.39 0.00 0.00 1.02 0.00 0.00 30.24 30.93 3h0p n GLN 50 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3h0p n GLY 51 N 1.54 2.28 3.66 1.08 0.00 0.10 -4.80 105.19 109.06 3h0p n GLY 51 Ca -0.03 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.25 3h0p n GLY 51 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h0p s PRO 52 N 0.00 0.28 0.29 1.61 0.05 -1.26 -4.76 135.00 131.22 3h0p s PRO 52 Ca 0.00 0.54 0.04 0.00 0.05 0.00 0.00 61.00 61.62 3h0p s PRO 52 Cb 0.00 -1.72 0.65 0.00 0.05 0.00 0.00 34.50 33.48 3h0p s PRO 52 CO 0.00 -2.83 1.81 0.00 0.05 0.00 0.00 177.00 176.02 3h0p h ALA 53 N -1.97 1.60 -0.71 8.56 0.00 -1.94 -1.39 119.26 123.41 3h0p h ALA 53 Ca -0.55 0.05 0.14 0.00 0.00 0.00 0.00 54.91 54.55 3h0p h ALA 53 Cb 1.33 -0.15 -0.10 0.00 0.00 0.00 0.00 17.79 18.88 3h0p h ALA 53 CO 0.57 0.09 0.21 1.05 0.00 0.00 0.00 179.25 181.16 3h0p h GLU 54 N 0.88 0.31 -0.08 0.00 4.11 -1.97 0.15 114.58 117.99 3h0p h GLU 54 Ca 0.54 -0.02 -0.07 0.00 0.07 0.00 0.00 59.36 59.88 3h0p h GLU 54 Cb 0.70 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.88 3h0p h GLU 54 CO -0.33 0.21 -0.21 0.93 0.07 0.00 0.00 179.01 179.68 3h0p h GLU 55 N 0.32 0.28 0.00 1.06 4.39 -1.61 -3.14 114.58 115.89 3h0p h GLU 55 Ca 0.39 -0.20 -0.02 0.00 0.34 0.00 0.00 59.36 59.87 3h0p h GLU 55 Cb 0.62 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 29.30 3h0p h GLU 55 CO -0.45 0.81 -0.10 1.25 -1.16 0.00 0.00 179.01 179.37 3h0p h LEU 56 N -0.20 0.00 -0.03 1.33 5.85 -0.91 -1.89 115.31 119.46 3h0p h LEU 56 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3h0p h LEU 56 Cb 0.83 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.86 3h0p h LEU 56 CO 0.05 0.10 -0.18 0.59 -0.34 0.00 0.00 178.44 178.65 3h0p n ASN 57 N -3.97 0.23 -4.66 1.25 3.02 0.49 -3.34 115.26 108.28 3h0p n ASN 57 Ca -0.02 0.08 -0.43 0.00 -0.03 0.00 0.00 54.58 54.18 3h0p n ASN 57 Cb 0.18 -0.19 -0.02 0.00 -0.61 0.00 0.00 39.78 39.14 3h0p n ASN 57 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3h0p s LYS 58 N -2.91 4.16 0.46 3.52 1.02 -0.71 -4.79 119.74 120.49 3h0p s LYS 58 Ca 0.16 1.85 0.19 0.00 0.02 0.00 0.00 55.97 58.18 3h0p s LYS 58 Cb 0.19 -3.88 1.16 0.00 -0.52 0.00 0.00 37.83 34.78 3h0p s LYS 58 CO 0.58 -0.83 1.95 0.00 -0.92 0.00 0.00 175.35 176.12 3h0p h THR 59 N 5.60 0.78 0.00 2.17 1.03 -1.88 0.35 112.91 120.96 3h0p h THR 59 Ca -0.32 -0.10 0.00 0.00 -0.01 0.00 0.00 66.41 65.98 3h0p h THR 59 Cb 1.14 0.48 0.00 0.00 -1.07 0.00 0.00 68.15 68.69 3h0p h THR 59 CO 0.97 0.05 0.00 -2.67 -0.01 0.00 0.00 175.52 173.86 3h0p n TRP 60 N -4.44 0.00 -0.05 0.00 2.14 -1.26 -1.20 117.44 112.63 3h0p n TRP 60 Ca 0.13 0.00 -0.06 0.00 2.07 0.00 0.00 57.50 59.63 3h0p n TRP 60 Cb 0.54 -0.31 -0.06 0.00 -0.81 0.00 0.00 31.31 30.68 3h0p n TRP 60 CO 0.00 0.00 0.00 1.04 2.07 0.00 0.00 177.69 180.80 3h0p n GLN 61 N -1.31 1.26 -0.30 -2.67 6.02 0.93 -4.46 117.38 116.86 3h0p n GLN 61 Ca 0.09 0.03 -0.05 0.00 -0.01 0.00 0.00 57.00 57.07 3h0p n GLN 61 Cb 0.17 -1.22 0.07 0.00 1.02 0.00 0.00 30.24 30.28 3h0p n GLN 61 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 177.06 177.20 3h0p h THR 62 N 0.00 1.25 -0.11 5.09 2.02 -0.55 -2.13 112.91 118.48 3h0p h THR 62 Ca -0.24 -0.67 -0.01 0.00 0.77 0.00 0.00 66.41 66.25 3h0p h THR 62 Cb 1.44 0.19 -0.00 0.00 -1.74 0.00 0.00 68.15 68.04 3h0p h THR 62 CO -0.02 0.29 0.01 1.56 0.37 0.00 0.00 175.52 177.74 3h0p h GLN 63 N 1.16 0.18 -0.05 6.66 4.20 -1.40 -0.79 115.11 125.07 3h0p h GLN 63 Ca 0.28 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.85 3h0p h GLN 63 Cb 0.09 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 3h0p h GLN 63 CO -0.04 0.40 -0.41 -1.00 -0.67 0.00 0.00 178.83 177.11 3h0p h PRO 64 N -0.07 0.10 -0.44 1.46 0.13 -1.77 -1.77 132.00 129.64 3h0p h PRO 64 Ca 0.03 -0.05 0.02 0.00 -0.87 0.00 0.00 66.00 65.14 3h0p h PRO 64 Cb 0.31 -0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.41 3h0p h PRO 64 CO 0.00 0.50 0.25 0.00 -0.23 0.00 0.00 178.00 178.52 3h0p h ALA 65 N 1.50 0.55 -0.13 -0.56 0.00 -1.13 -1.01 119.26 118.48 3h0p h ALA 65 Ca 0.01 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 3h0p h ALA 65 Cb 0.77 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3h0p h ALA 65 CO 0.06 -0.08 -0.36 -0.07 0.00 0.00 0.00 179.25 178.80 3h0p h LEU 66 N 0.50 0.53 -0.35 0.00 3.38 -1.04 -1.19 115.31 117.14 3h0p h LEU 66 Ca 0.18 -0.59 0.03 0.00 0.09 0.00 0.00 57.88 57.58 3h0p h LEU 66 Cb 0.03 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 3h0p h LEU 66 CO -0.09 1.03 0.16 0.25 0.09 0.00 0.00 178.44 179.88 3h0p h LEU 67 N 0.06 0.22 -0.65 1.67 5.85 -1.29 -1.31 115.31 119.87 3h0p h LEU 67 Ca -0.01 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.70 3h0p h LEU 67 Cb 0.98 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.96 3h0p h LEU 67 CO 0.08 0.17 0.27 0.74 -0.34 0.00 0.00 178.44 179.35 3h0p h THR 68 N 0.34 1.24 -0.49 1.05 2.02 -1.19 0.09 112.91 115.96 3h0p h THR 68 Ca 0.15 -0.72 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 3h0p h THR 68 Cb 0.08 0.50 -0.02 0.00 -1.74 0.00 0.00 68.15 66.97 3h0p h THR 68 CO -0.12 0.29 0.30 0.00 0.37 0.00 0.00 175.52 176.36 3h0p h ALA 69 N 1.11 0.62 -0.48 6.16 0.00 -0.83 0.73 119.26 126.57 3h0p h ALA 69 Ca 0.22 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.95 3h0p h ALA 69 Cb 0.19 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3h0p h ALA 69 CO -0.02 0.09 -0.19 0.77 0.00 0.00 0.00 179.25 179.91 3h0p h SER 70 N 0.65 1.00 -0.26 0.00 0.02 -1.07 -1.84 113.55 112.05 3h0p h SER 70 Ca 0.18 -0.39 -0.09 0.00 -0.84 0.00 0.00 61.79 60.65 3h0p h SER 70 Cb -0.03 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.22 3h0p h SER 70 CO -0.03 1.16 -0.13 0.58 -1.14 0.00 0.00 176.83 177.27 3h0p h VAL 71 N 0.83 1.25 -0.50 2.27 2.07 -0.74 -1.39 116.25 120.03 3h0p h VAL 71 Ca 0.11 -1.14 -0.02 0.00 0.82 0.00 0.00 66.70 66.47 3h0p h VAL 71 Cb 0.76 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 3h0p h VAL 71 CO 0.06 0.38 0.23 0.00 0.02 0.00 0.00 177.57 178.27 3h0p h ALA 72 N 1.25 0.64 -0.77 1.67 0.00 -0.66 -0.11 119.26 121.28 3h0p h ALA 72 Ca 0.11 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3h0p h ALA 72 Cb 0.57 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3h0p h ALA 72 CO 0.04 0.21 0.35 -0.07 0.00 0.00 0.00 179.25 179.78 3h0p h LEU 73 N 0.66 1.03 -0.86 0.00 3.38 -1.07 -1.11 115.31 117.33 3h0p h LEU 73 Ca 0.17 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3h0p h LEU 73 Cb 0.13 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 3h0p h LEU 73 CO -0.02 0.89 0.54 -0.25 0.09 0.00 0.00 178.44 179.69 3h0p h TRP 74 N 1.09 1.11 -0.41 1.13 2.91 -0.87 -1.24 115.95 119.68 3h0p h TRP 74 Ca 0.26 0.01 -0.10 0.00 1.13 0.00 0.00 58.89 60.19 3h0p h TRP 74 Cb 0.15 -0.37 -0.02 0.00 -0.51 0.00 0.00 29.16 28.42 3h0p h TRP 74 CO 0.01 0.73 -0.16 0.00 -1.03 0.00 0.00 178.44 177.99 3h0p h ARG 75 N 1.18 0.77 -0.23 2.65 3.08 -0.57 -2.15 114.38 119.10 3h0p h ARG 75 Ca 0.31 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 3h0p h ARG 75 Cb -0.09 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 29.90 3h0p h ARG 75 CO -0.06 0.89 0.10 0.28 -1.07 0.00 0.00 179.97 180.11 3h0p h VAL 76 N 0.69 1.16 -0.36 2.04 2.07 -0.81 -1.33 116.25 119.71 3h0p h VAL 76 Ca 0.11 -0.47 0.07 0.00 0.82 0.00 0.00 66.70 67.22 3h0p h VAL 76 Cb 0.66 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 31.41 3h0p h VAL 76 CO 0.05 0.16 -0.02 -0.25 0.02 0.00 0.00 177.57 177.52 3h0p h TRP 77 N 0.23 -0.07 -0.20 1.57 2.91 -1.07 -2.14 115.95 117.18 3h0p h TRP 77 Ca 0.08 0.03 -0.09 0.00 1.13 0.00 0.00 58.89 60.03 3h0p h TRP 77 Cb 0.16 0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 28.88 3h0p h TRP 77 CO -0.01 -0.09 -0.28 1.96 -1.03 0.00 0.00 178.44 178.98 3h0p h GLN 78 N 0.07 0.38 -0.43 2.65 4.20 -1.28 -0.07 115.11 120.63 3h0p h GLN 78 Ca 0.18 -0.15 -0.05 0.00 0.06 0.00 0.00 58.65 58.69 3h0p h GLN 78 Cb 0.26 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.99 3h0p h GLN 78 CO -0.32 0.64 0.07 0.37 -0.67 0.00 0.00 178.83 178.92 3h0p h GLN 79 N 0.34 0.66 -0.64 1.46 4.15 -0.66 -1.56 115.11 118.86 3h0p h GLN 79 Ca 0.05 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.34 3h0p h GLN 79 Cb 0.68 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.26 3h0p h GLN 79 CO 0.05 0.63 0.00 1.04 -1.93 0.00 0.00 178.83 178.62 3h0p n GLN 80 N -4.29 2.78 -1.84 1.69 1.13 -0.86 -4.90 117.38 111.09 3h0p n GLN 80 Ca 0.03 -1.69 -0.12 0.00 -1.94 0.00 0.00 57.00 53.27 3h0p n GLN 80 Cb 0.22 -1.72 -0.03 0.00 0.11 0.00 0.00 30.24 28.82 3h0p n GLN 80 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3h0p n GLY 81 N 0.64 0.51 3.77 1.08 0.00 -0.59 -4.99 105.19 105.62 3h0p n GLY 81 Ca 0.15 -0.41 -0.40 0.00 0.00 0.00 0.00 46.02 45.36 3h0p n GLY 81 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h0p s GLY 82 N -2.64 2.93 0.00 -0.02 0.00 -0.06 -4.99 107.32 102.54 3h0p s GLY 82 Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 44.72 46.26 3h0p s GLY 82 CO 0.00 2.18 0.00 0.28 0.00 0.00 0.00 173.10 175.56 3h0p n LYS 83 N 0.06 0.00 -4.42 2.90 5.02 -1.26 -4.72 118.16 115.74 3h0p n LYS 83 Ca 0.03 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.07 3h0p n LYS 83 Cb 0.40 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.30 3h0p n LYS 83 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3h0p s PRO 85 N 0.00 1.51 0.37 1.97 0.04 -1.26 -5.04 135.00 132.59 3h0p s PRO 85 Ca 0.00 -1.58 0.15 0.00 0.04 0.00 0.00 61.00 59.61 3h0p s PRO 85 Cb 0.00 -1.71 0.70 0.00 0.04 0.00 0.00 34.50 33.53 3h0p s PRO 85 CO 0.00 0.35 1.79 0.00 0.04 0.00 0.00 177.00 179.18 3h0p h ALA 86 N 2.93 1.21 -3.00 8.56 0.00 -0.81 -3.47 119.26 124.69 3h0p h ALA 86 Ca -0.44 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.11 3h0p h ALA 86 Cb 1.22 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3h0p h ALA 86 CO 0.52 0.50 0.00 1.28 0.00 0.00 0.00 179.25 181.55 3h0p n LEU 87 N -3.88 0.00 0.00 0.00 4.77 -1.26 -4.45 117.00 112.18 3h0p n LEU 87 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 3h0p n LEU 87 Cb 0.45 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 3h0p n LEU 87 CO 0.38 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.44 3h0p n ALA 89 N -3.00 0.00 -2.33 -1.18 0.00 -0.68 -1.24 120.51 112.08 3h0p n ALA 89 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 3h0p n ALA 89 Cb 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 3h0p n ALA 89 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3h0p s GLY 90 N 0.00 0.45 -0.43 0.00 0.00 -1.26 -0.96 107.32 105.11 3h0p s GLY 90 Ca 0.00 -1.06 -0.12 0.00 0.00 0.00 0.00 44.72 43.54 3h0p s GLY 90 CO 0.00 -1.16 0.30 -1.58 0.00 0.00 0.00 173.10 170.66 3h0p s HIS 91 N -3.23 3.29 0.00 1.90 2.46 -0.10 -4.21 115.29 115.39 3h0p s HIS 91 Ca 0.02 -1.21 0.00 0.00 0.47 0.00 0.00 55.06 54.34 3h0p s HIS 91 Cb 0.03 -2.95 0.00 0.00 -0.13 0.00 0.00 32.58 29.53 3h0p s HIS 91 CO -0.07 -0.79 0.00 0.45 -2.47 0.00 0.00 174.74 171.85 3h0p n SER 92 N 5.04 0.00 -0.15 9.88 2.88 -1.26 -0.65 113.62 129.36 3h0p n SER 92 Ca -0.11 0.00 0.11 0.00 -1.33 0.00 0.00 58.87 57.54 3h0p n SER 92 Cb 0.44 0.00 0.45 0.00 -0.75 0.00 0.00 64.21 64.35 3h0p n SER 92 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3h0p h LEU 93 N 0.00 0.48 -2.34 2.46 5.85 -1.93 -1.93 115.31 117.90 3h0p h LEU 93 Ca 0.00 0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.77 3h0p h LEU 93 Cb 0.00 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 40.94 3h0p h LEU 93 CO 0.00 0.28 0.13 1.23 -0.34 0.00 0.00 178.44 179.74 3h0p h GLY 94 N 0.53 0.00 1.84 3.75 0.00 -0.96 -1.62 103.07 106.61 3h0p h GLY 94 Ca 0.33 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.60 3h0p h GLY 94 CO -0.11 0.00 -0.18 0.83 0.00 0.00 0.00 176.54 177.08 3h0p h GLU 95 N 0.00 0.19 -0.37 4.80 5.08 -1.52 -1.63 114.58 121.13 3h0p h GLU 95 Ca 0.05 -0.05 -0.13 0.00 -1.00 0.00 0.00 59.36 58.23 3h0p h GLU 95 Cb 0.31 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 3h0p h GLU 95 CO -0.00 0.38 -0.27 1.88 -1.00 0.00 0.00 179.01 180.00 3h0p h TYR 96 N 0.18 0.98 -0.30 4.33 0.05 -1.45 -1.46 116.97 119.30 3h0p h TYR 96 Ca 0.03 -0.27 0.00 0.00 0.05 0.00 0.00 58.73 58.55 3h0p h TYR 96 Cb 0.44 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.95 3h0p h TYR 96 CO 0.01 1.05 0.19 0.77 -1.05 0.00 0.00 178.16 179.13 3h0p h SER 97 N 0.63 0.36 -0.36 3.88 0.02 -1.41 -1.68 113.55 115.00 3h0p h SER 97 Ca 0.07 -0.03 0.03 0.00 -0.84 0.00 0.00 61.79 61.02 3h0p h SER 97 Cb 0.84 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 63.26 3h0p h SER 97 CO 0.07 0.29 0.17 0.00 -1.14 0.00 0.00 176.83 176.22 3h0p h ALA 98 N 1.09 0.43 -0.16 3.77 0.00 -1.21 -1.04 119.26 122.14 3h0p h ALA 98 Ca 0.11 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3h0p h ALA 98 Cb -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3h0p h ALA 98 CO -0.02 -0.21 0.04 -0.07 0.00 0.00 0.00 179.25 178.99 3h0p h LEU 99 N 0.35 0.20 -0.07 0.00 3.38 -0.91 0.31 115.31 118.56 3h0p h LEU 99 Ca 0.15 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 58.03 3h0p h LEU 99 Cb 0.07 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.77 3h0p h LEU 99 CO -0.11 0.21 -0.24 0.58 0.09 0.00 0.00 178.44 178.97 3h0p h VAL 100 N 0.22 1.42 -0.55 1.22 2.07 -0.57 0.45 116.25 120.51 3h0p h VAL 100 Ca 0.06 -1.61 -0.07 0.00 0.82 0.00 0.00 66.70 65.90 3h0p h VAL 100 Cb 0.09 2.27 -0.02 0.00 -1.52 0.00 0.00 31.29 32.10 3h0p h VAL 100 CO -0.00 0.46 0.07 0.00 0.02 0.00 0.00 177.57 178.12 3h0p n ALA 102 N -2.47 1.99 -1.20 0.00 0.00 0.10 -4.88 120.51 114.05 3h0p n ALA 102 Ca 0.04 -0.09 -0.03 0.00 0.00 0.00 0.00 53.44 53.36 3h0p n ALA 102 Cb 0.27 -1.28 -0.01 0.00 0.00 0.00 0.00 19.45 18.43 3h0p n ALA 102 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0p n GLY 103 N 0.16 0.53 0.13 0.00 0.00 -0.49 -1.09 105.19 104.44 3h0p n GLY 103 Ca 0.09 -0.94 -0.22 0.00 0.00 0.00 0.00 46.02 44.95 3h0p n GLY 103 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3h0p h VAL 104 N 0.00 1.00 -4.20 1.61 2.07 -1.09 -3.41 116.25 112.23 3h0p h VAL 104 Ca -0.05 -2.43 -0.69 0.00 0.82 0.00 0.00 66.70 64.34 3h0p h VAL 104 Cb 0.28 2.73 -0.27 0.00 -1.52 0.00 0.00 31.29 32.51 3h0p h VAL 104 CO 0.07 0.75 -0.83 -0.63 0.02 0.00 0.00 177.57 176.96 3h0p s ILE 105 N -2.51 2.57 0.26 4.57 1.01 -1.08 -0.79 121.20 125.23 3h0p s ILE 105 Ca -0.19 -0.90 -0.30 0.00 0.00 0.00 0.00 60.65 59.26 3h0p s ILE 105 Cb 0.05 -1.97 -0.10 0.00 0.01 0.00 0.00 42.46 40.45 3h0p s ILE 105 CO 0.79 0.58 1.49 0.21 0.00 0.00 0.00 174.94 178.01 3h0p s ASN 106 N -0.56 6.56 0.10 3.58 3.84 -1.26 -4.36 114.94 122.85 3h0p s ASN 106 Ca 0.08 2.75 -0.35 0.00 0.21 0.00 0.00 52.86 55.55 3h0p s ASN 106 Cb -0.11 -2.63 -0.15 0.00 -0.55 0.00 0.00 41.25 37.82 3h0p s ASN 106 CO 0.01 -0.77 1.56 0.15 -2.79 0.00 0.00 177.10 175.25 3h0p h PHE 107 N 5.04 -1.52 -0.64 0.43 3.57 -1.98 0.57 116.94 122.41 3h0p h PHE 107 Ca -0.46 0.04 0.09 0.00 3.53 0.00 0.00 57.97 61.17 3h0p h PHE 107 Cb 1.22 0.64 -0.07 0.00 2.79 0.00 0.00 35.95 40.53 3h0p h PHE 107 CO 0.60 -0.61 0.28 0.00 -2.23 0.00 0.00 178.31 176.35 3h0p h ALA 108 N -0.56 0.86 -0.86 2.41 0.00 -1.93 -0.34 119.26 118.83 3h0p h ALA 108 Ca -0.01 0.07 0.08 0.00 0.00 0.00 0.00 54.91 55.05 3h0p h ALA 108 Cb 0.77 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.51 3h0p h ALA 108 CO -0.26 -0.13 0.52 -0.44 0.00 0.00 0.00 179.25 178.93 3h0p h ASP 109 N 0.49 0.79 -0.26 0.00 3.32 -1.83 -2.09 116.42 116.84 3h0p h ASP 109 Ca 0.32 0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.31 3h0p h ASP 109 Cb 0.36 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 3h0p h ASP 109 CO -0.28 0.48 -0.14 0.00 -1.72 0.00 0.00 179.24 177.57 3h0p h ALA 110 N 1.44 1.04 -0.41 3.45 0.00 0.68 0.22 119.26 125.68 3h0p h ALA 110 Ca 0.39 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 3h0p h ALA 110 Cb 0.27 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3h0p h ALA 110 CO -0.21 0.58 -0.02 0.28 0.00 0.00 0.00 179.25 179.88 3h0p h VAL 111 N 0.62 1.26 -0.34 0.00 2.07 -0.54 -1.22 116.25 118.11 3h0p h VAL 111 Ca 0.10 -1.05 -0.12 0.00 0.82 0.00 0.00 66.70 66.46 3h0p h VAL 111 Cb 0.60 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.49 3h0p h VAL 111 CO 0.04 0.35 -0.27 0.03 0.02 0.00 0.00 177.57 177.74 3h0p h ARG 112 N 0.56 0.69 -0.13 1.57 3.08 -1.20 -2.82 114.38 116.12 3h0p h ARG 112 Ca 0.11 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 3h0p h ARG 112 Cb 0.50 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 3h0p h ARG 112 CO 0.02 0.88 0.04 1.25 -1.07 0.00 0.00 179.97 181.10 3h0p h LEU 113 N 0.59 0.19 -0.89 3.04 5.85 -0.66 -3.19 115.31 120.24 3h0p h LEU 113 Ca 0.08 -0.19 -0.08 0.00 0.84 0.00 0.00 57.88 58.53 3h0p h LEU 113 Cb 0.76 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 3h0p h LEU 113 CO 0.06 0.33 -0.37 -0.37 -0.34 0.00 0.00 178.44 177.75 3h0p h VAL 114 N 0.04 0.85 0.00 1.05 -1.51 -1.20 0.73 116.25 116.20 3h0p h VAL 114 Ca 0.04 -1.53 0.00 0.00 -1.23 0.00 0.00 66.70 63.99 3h0p h VAL 114 Cb 0.21 1.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.31 3h0p h VAL 114 CO -0.00 0.36 0.00 1.21 -1.23 0.00 0.00 177.57 177.91 3h0p n GLU 115 N -3.50 0.14 0.00 5.19 2.13 -1.07 -1.21 120.64 122.32 3h0p n GLU 115 Ca -0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3h0p n GLU 115 Cb 0.52 -1.08 0.00 0.00 0.27 0.00 0.00 31.44 31.15 3h0p n GLU 115 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 3h0p n ARG 117 N 0.44 0.00 -0.21 5.31 0.63 0.25 -1.12 116.66 121.97 3h0p n ARG 117 Ca 0.00 0.00 -0.08 0.00 -0.92 0.00 0.00 57.85 56.85 3h0p n ARG 117 Cb 0.03 0.00 0.03 0.00 0.45 0.00 0.00 32.46 32.97 3h0p n ARG 117 CO 0.00 0.00 0.00 0.78 -2.51 0.00 0.00 177.63 175.90 3h0p h GLY 118 N 0.00 0.97 0.96 5.14 0.00 -1.42 -2.91 103.07 105.80 3h0p h GLY 118 Ca 0.00 -0.57 -0.01 0.00 0.00 0.00 0.00 47.33 46.75 3h0p h GLY 118 CO 0.00 0.53 0.19 0.50 0.00 0.00 0.00 176.54 177.77 3h0p h LYS 119 N 0.82 0.56 -1.42 4.80 1.57 -1.38 -1.79 116.57 119.73 3h0p h LYS 119 Ca 0.19 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3h0p h LYS 119 Cb 0.27 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.48 3h0p h LYS 119 CO -0.01 0.48 0.00 1.19 -0.57 0.00 0.00 179.45 180.55 3h0p n PHE 120 N -4.71 0.00 0.00 -1.35 3.72 -1.10 -2.72 117.46 111.30 3h0p n PHE 120 Ca -0.00 -0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.26 3h0p n PHE 120 Cb 0.10 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.51 3h0p n PHE 120 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 3h0p n GLN 122 N 0.74 0.00 0.00 -1.08 -0.06 -0.67 -1.89 117.38 114.42 3h0p n GLN 122 Ca 0.00 0.00 0.12 0.00 -2.00 0.00 0.00 57.00 55.12 3h0p n GLN 122 Cb 0.16 0.00 0.17 0.00 -4.06 0.00 0.00 30.24 26.51 3h0p n GLN 122 CO 0.00 0.00 0.00 -0.85 -0.20 0.00 0.00 177.06 176.01 3h0p n GLU 123 N 0.00 1.83 -0.16 3.69 0.28 -1.10 -4.52 120.64 120.66 3h0p n GLU 123 Ca 0.00 -1.42 -0.03 0.00 -0.16 0.00 0.00 57.16 55.54 3h0p n GLU 123 Cb 0.00 -1.47 0.03 0.00 1.43 0.00 0.00 31.44 31.43 3h0p n GLU 123 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 3h0p h ALA 124 N 4.37 0.28 -2.78 -1.84 0.00 -1.68 -3.42 119.26 114.19 3h0p h ALA 124 Ca 0.00 0.19 -0.45 0.00 0.00 0.00 0.00 54.91 54.65 3h0p h ALA 124 Cb 0.82 0.43 -0.17 0.00 0.00 0.00 0.00 17.79 18.86 3h0p h ALA 124 CO 0.00 -0.47 -0.76 0.14 0.00 0.00 0.00 179.25 178.16 3h0p s VAL 125 N -6.20 1.53 0.49 0.00 -7.23 -1.26 -4.92 120.40 102.80 3h0p s VAL 125 Ca -0.14 -1.87 -0.22 0.00 -1.81 0.00 0.00 61.98 57.95 3h0p s VAL 125 Cb 0.16 -1.72 -0.09 0.00 0.56 0.00 0.00 36.38 35.30 3h0p s VAL 125 CO 0.72 -0.43 0.89 -2.65 -0.31 0.00 0.00 175.10 173.32 3h0p n PRO 126 N 0.30 1.05 -1.60 4.82 -0.02 -1.26 -4.83 135.00 133.45 3h0p n PRO 126 Ca -0.13 0.39 -0.46 0.00 -2.02 0.00 0.00 63.50 61.28 3h0p n PRO 126 Cb 0.58 -1.98 -0.02 0.00 -0.02 0.00 0.00 33.50 32.05 3h0p n PRO 126 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3h0p n GLU 127 N -0.14 1.43 -0.72 -0.52 -0.58 -1.26 -2.36 120.64 116.49 3h0p n GLU 127 Ca 0.11 0.50 0.00 0.00 -0.42 0.00 0.00 57.16 57.35 3h0p n GLU 127 Cb 0.42 -1.96 0.00 0.00 -0.57 0.00 0.00 31.44 29.34 3h0p n GLU 127 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3h0p n GLY 128 N 1.55 0.94 0.05 0.62 0.00 -1.26 -4.87 105.19 102.22 3h0p n GLY 128 Ca 0.11 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.26 3h0p n GLY 128 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h0p n THR 129 N -2.00 0.00 -4.16 2.61 -2.24 -0.99 -4.86 114.28 102.64 3h0p n THR 129 Ca 0.00 -0.03 -0.25 0.00 -2.27 0.00 0.00 64.05 61.51 3h0p n THR 129 Cb 0.00 0.07 -0.08 0.00 -2.10 0.00 0.00 70.33 68.23 3h0p n THR 129 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3h0p s GLY 130 N -2.86 2.32 0.00 3.38 0.00 -1.26 -1.24 107.32 107.66 3h0p s GLY 130 Ca 0.16 -2.11 0.00 0.00 0.00 0.00 0.00 44.72 42.77 3h0p s GLY 130 CO 0.61 -1.92 0.00 0.61 0.00 0.00 0.00 173.10 172.40 3h0p n GLY 131 N -1.21 3.38 0.00 0.20 0.00 -0.03 -4.38 105.19 103.15 3h0p n GLY 131 Ca -0.01 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.12 3h0p n GLY 131 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3h0p n SER 133 N -0.04 0.00 -4.68 1.61 2.88 -0.03 -2.10 113.62 111.26 3h0p n SER 133 Ca 0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 3h0p n SER 133 Cb 0.00 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.41 3h0p n SER 133 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3h0p s ALA 134 N -0.58 3.49 -0.28 -1.46 0.00 -0.24 0.46 121.76 123.16 3h0p s ALA 134 Ca 0.00 -0.04 -0.10 0.00 0.00 0.00 0.00 51.96 51.82 3h0p s ALA 134 Cb 0.00 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 3h0p s ALA 134 CO 0.00 -0.52 0.16 0.42 0.00 0.00 0.00 175.76 175.82 3h0p s ILE 135 N 1.81 4.96 -0.13 0.00 -1.09 0.16 -0.61 121.20 126.31 3h0p s ILE 135 Ca 0.35 -0.01 -0.03 0.00 -2.23 0.00 0.00 60.65 58.72 3h0p s ILE 135 Cb -0.17 -3.39 -0.03 0.00 -1.58 0.00 0.00 42.46 37.30 3h0p s ILE 135 CO 0.13 0.23 -0.01 -0.63 -1.23 0.00 0.00 174.94 173.43 3h0p s ILE 136 N 1.70 4.16 -0.43 2.92 -1.09 0.27 -1.82 121.20 126.91 3h0p s ILE 136 Ca 0.07 -0.28 -0.01 0.00 -2.23 0.00 0.00 60.65 58.19 3h0p s ILE 136 Cb -0.16 -2.80 0.00 0.00 -1.58 0.00 0.00 42.46 37.92 3h0p s ILE 136 CO 0.08 0.53 0.19 0.61 -1.23 0.00 0.00 174.94 175.12 3h0p n GLY 137 N 3.01 0.37 2.88 6.18 0.00 0.18 -0.22 105.19 117.58 3h0p n GLY 137 Ca -0.18 -0.52 -0.12 0.00 0.00 0.00 0.00 46.02 45.21 3h0p n GLY 137 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3h0p s LEU 138 N -2.28 2.00 0.72 0.99 2.96 -1.26 -4.08 118.68 117.73 3h0p s LEU 138 Ca 0.09 -0.02 -0.14 0.00 -0.22 0.00 0.00 54.13 53.84 3h0p s LEU 138 Cb -0.04 0.01 0.03 0.00 0.50 0.00 0.00 46.19 46.69 3h0p s LEU 138 CO 0.11 -0.01 1.15 1.51 -1.32 0.00 0.00 176.35 177.80 3h0p s ASP 139 N -0.05 4.47 0.28 3.68 -4.77 -1.26 -4.47 116.67 114.54 3h0p s ASP 139 Ca -0.01 2.16 -0.00 0.00 -3.30 0.00 0.00 52.55 51.40 3h0p s ASP 139 Cb -0.00 -2.57 0.49 0.00 -1.09 0.00 0.00 42.92 39.74 3h0p s ASP 139 CO -0.00 -2.07 1.86 0.44 0.70 0.00 0.00 175.17 176.10 3h0p h ASP 140 N -0.37 0.98 -0.19 2.11 3.32 -1.99 -2.47 116.42 117.81 3h0p h ASP 140 Ca -0.47 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 56.61 3h0p h ASP 140 Cb 1.27 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 3h0p h ASP 140 CO 0.51 0.58 0.11 0.00 -1.72 0.00 0.00 179.24 178.72 3h0p h ALA 141 N 1.50 0.24 -0.76 3.45 0.00 -2.00 -1.03 119.26 120.67 3h0p h ALA 141 Ca 0.46 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.28 3h0p h ALA 141 Cb 0.33 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 3h0p h ALA 141 CO -0.22 -0.25 0.27 0.77 0.00 0.00 0.00 179.25 179.82 3h0p h SER 142 N 0.22 1.07 -0.54 0.00 0.02 -1.87 -1.64 113.55 110.81 3h0p h SER 142 Ca 0.07 -0.19 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 3h0p h SER 142 Cb 0.03 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 3h0p h SER 142 CO -0.01 0.98 0.29 0.40 -1.14 0.00 0.00 176.83 177.34 3h0p h ILE 143 N 1.11 1.19 -0.76 3.27 2.04 -1.21 0.13 117.51 123.28 3h0p h ILE 143 Ca 0.25 -0.50 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 3h0p h ILE 143 Cb 0.26 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.83 3h0p h ILE 143 CO -0.01 0.21 0.38 0.00 0.00 0.00 0.00 178.15 178.72 3h0p h ALA 144 N 1.12 0.98 -0.43 1.87 0.00 -0.93 -0.48 119.26 121.39 3h0p h ALA 144 Ca 0.19 -0.14 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 3h0p h ALA 144 Cb 0.07 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3h0p h ALA 144 CO -0.03 0.53 -0.07 -0.22 0.00 0.00 0.00 179.25 179.46 3h0p h LYS 145 N 1.06 0.80 -0.62 0.00 3.64 -0.96 -1.68 116.57 118.82 3h0p h LYS 145 Ca 0.26 -0.29 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3h0p h LYS 145 Cb 0.09 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 3h0p h LYS 145 CO -0.04 0.91 0.39 0.00 -2.27 0.00 0.00 179.45 178.44 3h0p h ALA 146 N 0.87 0.79 -0.52 5.00 0.00 -0.48 -1.52 119.26 123.40 3h0p h ALA 146 Ca 0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3h0p h ALA 146 Cb 0.59 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3h0p h ALA 146 CO 0.04 0.25 0.27 0.00 0.00 0.00 0.00 179.25 179.81 3h0p h GLU 148 N 0.69 1.08 0.00 0.00 5.08 -0.98 -1.29 114.58 119.15 3h0p h GLU 148 Ca 0.18 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.27 3h0p h GLU 148 Cb 0.08 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 3h0p h GLU 148 CO -0.03 0.92 -0.24 0.93 -1.00 0.00 0.00 179.01 179.59 3h0p h GLU 149 N 1.02 0.00 0.00 2.33 5.08 -1.08 -3.23 114.58 118.70 3h0p h GLU 149 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3h0p h GLU 149 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3h0p h GLU 149 CO -0.01 0.24 -1.25 0.43 -1.00 0.00 0.00 179.01 177.41 3h0p n SER 150 N -3.62 0.58 -0.01 1.42 7.64 -0.63 -4.57 113.62 114.43 3h0p n SER 150 Ca -0.01 -0.39 -0.09 0.00 1.01 0.00 0.00 58.87 59.39 3h0p n SER 150 Cb 0.37 1.15 -0.03 0.00 -1.01 0.00 0.00 64.21 64.68 3h0p n SER 150 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h0p h ALA 151 N 2.55 0.01 -6.48 -0.43 0.00 -1.27 -3.44 119.26 110.19 3h0p h ALA 151 Ca 0.00 0.05 -0.50 0.00 0.00 0.00 0.00 54.91 54.46 3h0p h ALA 151 Cb 0.73 0.22 -0.09 0.00 0.00 0.00 0.00 17.79 18.64 3h0p h ALA 151 CO 0.00 -0.55 -0.83 0.39 0.00 0.00 0.00 179.25 178.26 3h0p n GLU 152 N -5.24 -4.05 0.00 0.00 1.02 -1.26 -1.00 120.64 110.11 3h0p n GLU 152 Ca -0.03 0.47 0.00 0.00 -0.02 0.00 0.00 57.16 57.58 3h0p n GLU 152 Cb 0.17 -5.05 0.00 0.00 -0.02 0.00 0.00 31.44 26.53 3h0p n GLU 152 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3h0p n GLY 153 N -1.67 2.42 3.40 0.62 0.00 -1.26 -5.04 105.19 103.66 3h0p n GLY 153 Ca -0.08 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.74 3h0p n GLY 153 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3h0p n GLN 154 N -2.00 0.01 -3.67 1.61 6.02 -0.17 -5.09 117.38 114.09 3h0p n GLN 154 Ca 0.00 -2.39 -0.36 0.00 -0.01 0.00 0.00 57.00 54.24 3h0p n GLN 154 Cb 0.00 -0.56 -0.08 0.00 1.02 0.00 0.00 30.24 30.62 3h0p n GLN 154 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3h0p s VAL 155 N -2.65 5.38 -0.29 5.09 1.01 -1.26 -4.81 120.40 122.87 3h0p s VAL 155 Ca 0.58 0.28 -0.13 0.00 0.00 0.00 0.00 61.98 62.70 3h0p s VAL 155 Cb -0.03 -3.51 0.11 0.00 0.00 0.00 0.00 36.38 32.95 3h0p s VAL 155 CO 0.38 0.41 0.71 0.54 0.00 0.00 0.00 175.10 177.14 3h0p s VAL 156 N 0.49 -0.51 0.21 2.92 0.11 -1.26 -0.79 120.40 121.58 3h0p s VAL 156 Ca 0.10 0.00 -0.22 0.00 -2.93 0.00 0.00 61.98 58.93 3h0p s VAL 156 Cb -0.12 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 33.78 3h0p s VAL 156 CO 0.00 0.00 0.65 -0.94 -3.33 0.00 0.00 175.10 171.48 3h0p s SER 157 N 2.28 -0.41 0.19 3.54 1.04 -0.71 -4.67 113.70 114.95 3h0p s SER 157 Ca -0.08 -0.30 -0.31 0.00 0.48 0.00 0.00 55.95 55.74 3h0p s SER 157 Cb -0.08 0.65 -0.10 0.00 0.10 0.00 0.00 66.02 66.59 3h0p s SER 157 CO -0.19 -1.14 1.58 -2.84 0.98 0.00 0.00 173.24 171.63 3h0p s PRO 158 N -3.83 4.20 0.00 4.02 0.02 -1.26 -1.61 135.00 136.54 3h0p s PRO 158 Ca 0.06 2.41 0.00 0.00 0.02 0.00 0.00 61.00 63.48 3h0p s PRO 158 Cb -0.03 -3.13 0.00 0.00 0.02 0.00 0.00 34.50 31.36 3h0p s PRO 158 CO -0.04 -0.61 0.00 1.33 -0.33 0.00 0.00 177.00 177.35 3h0p n VAL 159 N 3.73 0.00 -3.72 3.83 0.24 0.82 -4.69 118.33 118.55 3h0p n VAL 159 Ca 0.13 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.16 3h0p n VAL 159 Cb 0.38 -0.09 -0.17 0.00 -1.47 0.00 0.00 33.84 32.49 3h0p n VAL 159 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 3h0p s ASN 160 N -2.18 2.69 -0.88 -1.34 0.01 -0.93 -0.68 114.94 111.62 3h0p s ASN 160 Ca 0.00 -0.71 -0.18 0.00 -0.71 0.00 0.00 52.86 51.25 3h0p s ASN 160 Cb 0.00 -0.52 0.14 0.00 0.41 0.00 0.00 41.25 41.28 3h0p s ASN 160 CO 0.00 -0.30 1.04 -0.36 -1.51 0.00 0.00 177.10 175.96 3h0p s PHE 161 N 1.91 3.19 -0.07 2.20 0.08 -0.10 -0.83 117.98 124.36 3h0p s PHE 161 Ca 0.00 -1.41 -0.17 0.00 0.12 0.00 0.00 56.93 55.47 3h0p s PHE 161 Cb -0.16 -4.19 -0.30 0.00 -0.57 0.00 0.00 43.02 37.80 3h0p s PHE 161 CO -0.08 -1.41 0.71 -0.91 -0.10 0.00 0.00 175.22 173.43 3h0p h ASN 162 N 8.73 0.48 -5.02 1.36 2.35 -1.64 0.76 115.58 122.59 3h0p h ASN 162 Ca 0.10 -0.90 0.06 0.00 -0.55 0.00 0.00 56.30 55.01 3h0p h ASN 162 Cb 1.03 -0.16 -0.08 0.00 0.05 0.00 0.00 38.32 39.17 3h0p h ASN 162 CO 1.05 1.58 0.28 -0.94 -1.65 0.00 0.00 177.43 177.76 3h0p s SER 163 N -7.10 -0.34 0.17 5.81 1.04 -0.98 -4.20 113.70 108.10 3h0p s SER 163 Ca -0.17 -0.37 -0.32 0.00 0.48 0.00 0.00 55.95 55.58 3h0p s SER 163 Cb 0.03 0.64 -0.11 0.00 0.10 0.00 0.00 66.02 66.68 3h0p s SER 163 CO 0.81 -1.13 1.75 -2.84 0.98 0.00 0.00 173.24 172.81 3h0p s PRO 164 N -3.73 4.14 0.00 4.02 0.02 -1.26 -0.94 135.00 137.24 3h0p s PRO 164 Ca 0.08 2.58 0.00 0.00 0.02 0.00 0.00 61.00 63.68 3h0p s PRO 164 Cb -0.04 -3.27 0.00 0.00 0.02 0.00 0.00 34.50 31.21 3h0p s PRO 164 CO -0.00 -0.77 0.00 0.41 -0.33 0.00 0.00 177.00 176.30 3h0p n GLY 165 N 4.05 0.77 2.56 0.52 0.00 -1.26 -4.93 105.19 106.91 3h0p n GLY 165 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.90 3h0p n GLY 165 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h0p s GLN 166 N -0.51 0.23 -0.06 1.61 -0.21 -0.12 -0.65 119.66 119.95 3h0p s GLN 166 Ca 0.00 -0.55 0.01 0.00 0.02 0.00 0.00 55.36 54.85 3h0p s GLN 166 Cb 0.00 -1.28 0.02 0.00 1.00 0.00 0.00 33.01 32.75 3h0p s GLN 166 CO 0.00 -0.99 -0.08 0.08 -2.12 0.00 0.00 175.29 172.18 3h0p s VAL 167 N 2.06 0.82 -0.09 1.09 1.01 -0.76 -1.83 120.40 122.70 3h0p s VAL 167 Ca 0.09 -0.27 -0.15 0.00 0.00 0.00 0.00 61.98 61.64 3h0p s VAL 167 Cb -0.16 -0.80 -0.05 0.00 0.00 0.00 0.00 36.38 35.37 3h0p s VAL 167 CO -0.34 0.29 0.39 -0.69 0.00 0.00 0.00 175.10 174.76 3h0p s VAL 168 N 0.95 5.18 0.27 2.92 1.01 -0.01 0.40 120.40 131.11 3h0p s VAL 168 Ca -0.10 0.78 0.08 0.00 0.00 0.00 0.00 61.98 62.73 3h0p s VAL 168 Cb -0.15 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 3h0p s VAL 168 CO 0.00 0.43 0.15 0.27 0.00 0.00 0.00 175.10 175.95 3h0p s ILE 169 N 0.01 4.05 0.15 2.22 -4.36 0.17 -0.13 121.20 123.31 3h0p s ILE 169 Ca 0.22 -1.56 -0.17 0.00 -0.26 0.00 0.00 60.65 58.88 3h0p s ILE 169 Cb -0.15 -3.22 0.04 0.00 1.25 0.00 0.00 42.46 40.38 3h0p s ILE 169 CO 0.09 -0.34 0.47 0.00 0.24 0.00 0.00 174.94 175.40 3h0p s ALA 170 N -2.21 -1.02 0.00 2.27 0.00 -0.63 -0.85 121.76 119.31 3h0p s ALA 170 Ca 0.33 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.26 3h0p s ALA 170 Cb -0.07 0.78 0.00 0.00 0.00 0.00 0.00 23.12 23.83 3h0p s ALA 170 CO 0.24 -0.71 0.00 0.41 0.00 0.00 0.00 175.76 175.69 3h0p n GLY 171 N -0.28 -0.15 3.76 0.00 0.00 -0.89 -1.74 105.19 105.88 3h0p n GLY 171 Ca -0.14 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.32 3h0p n GLY 171 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3h0p n HIS 172 N 9.00 2.92 -0.22 1.61 8.25 0.03 -0.85 115.22 135.96 3h0p n HIS 172 Ca 0.00 0.40 0.03 0.00 -0.26 0.00 0.00 57.72 57.89 3h0p n HIS 172 Cb 0.00 -2.54 0.14 0.00 1.12 0.00 0.00 29.99 28.71 3h0p n HIS 172 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3h0p h LYS 173 N 3.40 0.28 -0.55 -0.41 1.63 -1.38 -0.03 116.57 119.51 3h0p h LYS 173 Ca -0.50 -0.02 -0.10 0.00 -0.85 0.00 0.00 60.65 59.19 3h0p h LYS 173 Cb 1.24 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.79 3h0p h LYS 173 CO 0.68 0.18 -0.04 0.93 -3.45 0.00 0.00 179.45 177.75 3h0p h GLU 174 N 0.28 1.00 -0.36 1.90 3.07 -1.90 -1.03 114.58 117.53 3h0p h GLU 174 Ca 0.36 -0.34 -0.07 0.00 -0.50 0.00 0.00 59.36 58.82 3h0p h GLU 174 Cb 0.57 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.39 3h0p h GLU 174 CO -0.45 1.01 -0.07 0.00 -1.40 0.00 0.00 179.01 178.11 3h0p h ALA 175 N 0.95 1.21 -0.31 3.43 0.00 -1.68 -0.72 119.26 122.14 3h0p h ALA 175 Ca 0.15 -0.26 -0.15 0.00 0.00 0.00 0.00 54.91 54.65 3h0p h ALA 175 Cb 0.59 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 3h0p h ALA 175 CO 0.04 0.52 -0.41 0.28 0.00 0.00 0.00 179.25 179.67 3h0p h VAL 176 N 0.56 1.29 -0.36 0.00 2.07 -0.64 -0.91 116.25 118.26 3h0p h VAL 176 Ca 0.11 -1.59 -0.04 0.00 0.82 0.00 0.00 66.70 65.99 3h0p h VAL 176 Cb 0.46 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 3h0p h VAL 176 CO 0.02 0.52 0.06 -0.33 0.02 0.00 0.00 177.57 177.86 3h0p h GLU 177 N 0.63 0.59 -0.77 1.57 4.39 -0.94 -0.60 114.58 119.45 3h0p h GLU 177 Ca 0.05 -0.16 -0.05 0.00 0.34 0.00 0.00 59.36 59.54 3h0p h GLU 177 Cb 0.97 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.52 3h0p h GLU 177 CO 0.09 0.66 0.28 0.00 -1.16 0.00 0.00 179.01 178.89 3h0p h ARG 178 N 0.43 1.16 -0.49 2.33 3.08 -1.04 -2.33 114.38 117.53 3h0p h ARG 178 Ca 0.11 -0.22 -0.13 0.00 0.07 0.00 0.00 59.98 59.81 3h0p h ARG 178 Cb 0.36 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.21 3h0p h ARG 178 CO 0.01 0.95 -0.19 0.00 -1.07 0.00 0.00 179.97 179.67 3h0p h ALA 179 N 1.18 0.68 -0.77 0.04 0.00 -0.98 -1.00 119.26 118.40 3h0p h ALA 179 Ca 0.25 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3h0p h ALA 179 Cb 0.25 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 3h0p h ALA 179 CO -0.02 0.65 0.47 0.78 0.00 0.00 0.00 179.25 181.14 3h0p h GLY 180 N 0.84 1.11 0.90 0.00 0.00 -1.00 0.02 103.07 104.95 3h0p h GLY 180 Ca 0.11 -0.45 -0.06 0.00 0.00 0.00 0.00 47.33 46.93 3h0p h GLY 180 CO 0.06 0.43 -0.06 0.00 0.00 0.00 0.00 176.54 176.98 3h0p h ALA 181 N 1.46 0.43 -0.25 3.60 0.00 -1.01 -2.28 119.26 121.20 3h0p h ALA 181 Ca 0.28 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3h0p h ALA 181 Cb -0.06 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3h0p h ALA 181 CO -0.05 0.24 -0.15 0.00 0.00 0.00 0.00 179.25 179.29 3h0p h ALA 182 N 0.81 1.27 -0.53 0.00 0.00 -0.86 -1.86 119.26 118.09 3h0p h ALA 182 Ca 0.08 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.61 3h0p h ALA 182 Cb 0.54 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 3h0p h ALA 182 CO 0.03 0.48 -0.10 0.00 0.00 0.00 0.00 179.25 179.66 3h0p h LYS 184 N 0.87 0.68 0.00 0.00 1.57 -1.11 0.15 116.57 118.72 3h0p h LYS 184 Ca 0.14 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.63 3h0p h LYS 184 Cb 0.66 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 3h0p h LYS 184 CO 0.05 0.80 -0.25 0.00 -0.57 0.00 0.00 179.45 179.47 3h0p h ALA 185 N 1.22 1.14 -0.08 3.86 0.00 -1.16 -2.66 119.26 121.58 3h0p h ALA 185 Ca 0.10 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3h0p h ALA 185 Cb 0.61 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3h0p h ALA 185 CO 0.04 0.32 0.00 0.00 0.00 0.00 0.00 179.25 179.61 3h0p n ALA 186 N -2.29 2.55 0.00 0.00 0.00 -0.56 -4.91 120.51 115.30 3h0p n ALA 186 Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.94 3h0p n ALA 186 Cb 0.39 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.72 3h0p n ALA 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h0p n GLY 187 N 1.16 0.90 3.77 0.00 0.00 -0.91 -5.05 105.19 105.06 3h0p n GLY 187 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 3h0p n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h0p s ALA 188 N -2.00 3.41 0.10 4.61 0.00 0.47 -4.78 121.76 123.57 3h0p s ALA 188 Ca 0.00 1.34 -0.13 0.00 0.00 0.00 0.00 51.96 53.17 3h0p s ALA 188 Cb 0.00 -3.52 -0.14 0.00 0.00 0.00 0.00 23.12 19.46 3h0p s ALA 188 CO 0.00 -0.85 1.33 -0.22 0.00 0.00 0.00 175.76 176.02 3h0p h LYS 189 N 2.96 0.78 -2.99 0.00 3.64 -0.75 -3.41 116.57 116.80 3h0p h LYS 189 Ca -0.50 -0.58 -0.09 0.00 -1.27 0.00 0.00 60.65 58.21 3h0p h LYS 189 Cb 1.24 0.10 -0.18 0.00 -0.41 0.00 0.00 32.23 32.99 3h0p h LYS 189 CO 0.64 1.20 -0.15 1.03 -2.27 0.00 0.00 179.45 179.89 3h0p s ARG 190 N -3.87 0.84 -0.30 1.90 1.81 -1.05 -5.00 118.95 113.28 3h0p s ARG 190 Ca -0.11 -0.28 0.01 0.00 -1.72 0.00 0.00 55.73 53.62 3h0p s ARG 190 Cb 0.08 0.38 0.09 0.00 -0.45 0.00 0.00 34.95 35.05 3h0p s ARG 190 CO 0.89 -0.27 0.06 0.00 -0.68 0.00 0.00 175.30 175.30 3h0p s ALA 191 N -2.06 1.92 -0.35 2.13 0.00 -1.26 -0.57 121.76 121.58 3h0p s ALA 191 Ca -0.08 -1.81 -0.09 0.00 0.00 0.00 0.00 51.96 49.98 3h0p s ALA 191 Cb -0.02 -1.67 0.02 0.00 0.00 0.00 0.00 23.12 21.46 3h0p s ALA 191 CO 0.00 -1.58 0.17 -0.51 0.00 0.00 0.00 175.76 173.84 3h0p s LEU 192 N 1.41 4.47 0.51 0.00 1.43 0.22 -4.92 118.68 121.79 3h0p s LEU 192 Ca 0.07 -0.94 -0.23 0.00 -1.03 0.00 0.00 54.13 52.01 3h0p s LEU 192 Cb -0.18 -1.97 -0.06 0.00 0.03 0.00 0.00 46.19 44.01 3h0p s LEU 192 CO -0.17 -0.33 1.36 -2.84 0.23 0.00 0.00 176.35 174.60 3h0p s PRO 193 N 1.52 3.38 0.17 1.29 0.02 -1.26 -1.08 135.00 139.04 3h0p s PRO 193 Ca 0.02 2.24 0.04 0.00 0.02 0.00 0.00 61.00 63.32 3h0p s PRO 193 Cb -0.19 -2.40 -0.04 0.00 0.02 0.00 0.00 34.50 31.90 3h0p s PRO 193 CO 0.05 -1.00 0.24 -0.51 -0.33 0.00 0.00 177.00 175.45 3h0p s LEU 194 N -3.21 4.12 0.45 -5.54 1.43 -1.26 -4.86 118.68 109.80 3h0p s LEU 194 Ca 0.67 0.03 0.12 0.00 -1.03 0.00 0.00 54.13 53.93 3h0p s LEU 194 Cb -0.40 -2.70 1.03 0.00 0.03 0.00 0.00 46.19 44.15 3h0p s LEU 194 CO 0.49 0.04 2.04 1.55 0.23 0.00 0.00 176.35 180.70 3h0p h PRO 195 N 2.07 0.36 -6.12 1.29 0.13 -2.04 -3.41 132.00 124.27 3h0p h PRO 195 Ca -0.49 -0.02 -0.56 0.00 -0.87 0.00 0.00 66.00 64.06 3h0p h PRO 195 Cb 1.20 -0.08 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 3h0p h PRO 195 CO 0.65 0.24 0.22 0.14 -0.23 0.00 0.00 178.00 179.02 3h0p s VAL 196 N -5.35 4.97 -0.63 1.56 -7.23 -1.26 -4.96 120.40 107.49 3h0p s VAL 196 Ca -0.07 1.65 0.22 0.00 -1.81 0.00 0.00 61.98 61.96 3h0p s VAL 196 Cb 0.18 -4.14 -0.26 0.00 0.56 0.00 0.00 36.38 32.73 3h0p s VAL 196 CO 0.73 0.18 0.77 -1.54 -0.31 0.00 0.00 175.10 174.93 3h0p n SER 197 N 4.08 0.62 -4.66 4.85 3.41 -1.26 -4.90 113.62 115.76 3h0p n SER 197 Ca 0.02 -0.58 -0.42 0.00 -0.26 0.00 0.00 58.87 57.62 3h0p n SER 197 Cb 0.51 1.32 -0.03 0.00 -0.26 0.00 0.00 64.21 65.75 3h0p n SER 197 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3h0p s VAL 198 N -3.20 3.20 -1.31 -3.33 1.01 -1.26 -2.87 120.40 112.65 3h0p s VAL 198 Ca 0.02 0.24 -0.18 0.00 0.00 0.00 0.00 61.98 62.07 3h0p s VAL 198 Cb 0.15 -3.16 0.06 0.00 0.00 0.00 0.00 36.38 33.43 3h0p s VAL 198 CO 0.88 -0.03 1.80 -0.81 0.00 0.00 0.00 175.10 176.94 3h0p n PRO 199 N 7.50 3.10 -1.64 2.72 -0.04 -1.26 -4.86 135.00 140.52 3h0p n PRO 199 Ca 0.20 -3.17 -0.31 0.00 -0.04 0.00 0.00 63.50 60.17 3h0p n PRO 199 Cb 0.42 -3.48 0.05 0.00 -0.04 0.00 0.00 33.50 30.44 3h0p n PRO 199 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3h0p s SER 200 N 4.20 5.41 -1.52 3.54 1.04 -1.26 -4.10 113.70 121.01 3h0p s SER 200 Ca 0.54 1.66 -0.03 0.00 0.48 0.00 0.00 55.95 58.60 3h0p s SER 200 Cb 0.05 -2.50 0.01 0.00 0.10 0.00 0.00 66.02 63.68 3h0p s SER 200 CO 0.06 -1.42 0.29 1.41 0.98 0.00 0.00 173.24 174.56 3h0p n HIS 201 N -2.96 -1.54 -4.31 5.02 8.25 -0.70 -4.83 115.22 114.16 3h0p n HIS 201 Ca 0.08 0.25 -0.18 0.00 -0.26 0.00 0.00 57.72 57.61 3h0p n HIS 201 Cb 0.53 -3.84 -0.09 0.00 1.12 0.00 0.00 29.99 27.71 3h0p n HIS 201 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3h0p h ALA 203 N 2.27 2.55 0.00 0.00 0.00 -1.90 -3.39 119.26 118.78 3h0p h ALA 203 Ca -0.33 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3h0p h ALA 203 Cb 1.25 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3h0p h ALA 203 CO 0.50 -0.76 0.43 1.28 0.00 0.00 0.00 179.25 180.70 3h0p n LEU 204 N -4.37 0.00 0.00 0.00 4.77 -1.26 -4.72 117.00 111.43 3h0p n LEU 204 Ca 0.14 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 3h0p n LEU 204 Cb 0.73 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.82 3h0p n LEU 204 CO 0.36 -0.43 0.00 1.17 -1.33 0.00 0.00 177.39 177.16 3h0p n LYS 206 N 2.86 0.00 -0.17 3.23 3.00 -1.26 -4.68 118.16 121.14 3h0p n LYS 206 Ca 0.00 0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.32 3h0p n LYS 206 Cb 0.00 0.00 0.28 0.00 0.00 0.00 0.00 35.03 35.31 3h0p n LYS 206 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.40 176.40 3h0p h PRO 207 N 0.00 0.90 -0.41 1.64 0.13 -1.92 -0.36 132.00 131.98 3h0p h PRO 207 Ca 0.00 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 65.01 3h0p h PRO 207 Cb 0.00 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 30.91 3h0p h PRO 207 CO 0.00 0.60 0.01 0.00 -0.23 0.00 0.00 178.00 178.38 3h0p h ALA 208 N 1.57 0.55 -0.99 -0.56 0.00 -1.85 -2.45 119.26 115.52 3h0p h ALA 208 Ca 0.25 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.96 3h0p h ALA 208 Cb -0.10 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.47 3h0p h ALA 208 CO -0.05 0.32 0.64 0.00 0.00 0.00 0.00 179.25 180.16 3h0p h ALA 209 N 0.89 1.34 -0.65 0.00 0.00 -1.71 0.09 119.26 119.23 3h0p h ALA 209 Ca 0.12 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3h0p h ALA 209 Cb 0.46 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3h0p h ALA 209 CO 0.02 0.49 0.21 -0.44 0.00 0.00 0.00 179.25 179.52 3h0p h ASP 210 N 1.21 0.95 0.23 0.00 3.32 -0.89 0.62 116.42 121.85 3h0p h ASP 210 Ca 0.41 -0.21 -0.17 0.00 0.02 0.00 0.00 57.03 57.08 3h0p h ASP 210 Cb 0.08 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 3h0p h ASP 210 CO -0.15 0.90 -0.67 0.11 -1.72 0.00 0.00 179.24 177.72 3h0p h LYS 211 N 0.94 0.40 -0.23 3.56 1.57 -1.11 -2.99 116.57 118.72 3h0p h LYS 211 Ca 0.21 -0.30 -0.11 0.00 -1.87 0.00 0.00 60.65 58.58 3h0p h LYS 211 Cb 0.29 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3h0p h LYS 211 CO -0.01 0.93 -0.32 1.25 -0.57 0.00 0.00 179.45 180.73 3h0p h LEU 212 N 0.28 0.48 -1.43 2.94 5.85 -0.64 -2.82 115.31 119.98 3h0p h LEU 212 Ca -0.02 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 3h0p h LEU 212 Cb 1.22 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.10 3h0p h LEU 212 CO 0.11 0.77 0.24 0.00 -0.34 0.00 0.00 178.44 179.23 3h0p h ALA 213 N 1.26 1.56 -0.45 1.25 0.00 -0.74 0.11 119.26 122.26 3h0p h ALA 213 Ca 0.05 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3h0p h ALA 213 Cb 0.75 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3h0p h ALA 213 CO 0.06 0.36 0.08 0.28 0.00 0.00 0.00 179.25 180.03 3h0p h VAL 214 N 0.63 1.24 -0.32 0.00 2.07 -1.42 -1.81 116.25 116.65 3h0p h VAL 214 Ca 0.16 -0.89 -0.17 0.00 0.82 0.00 0.00 66.70 66.62 3h0p h VAL 214 Cb 0.04 0.96 -0.00 0.00 -1.52 0.00 0.00 31.29 30.76 3h0p h VAL 214 CO -0.03 0.31 -0.47 -0.33 0.02 0.00 0.00 177.57 177.08 3h0p h GLU 215 N 0.60 0.88 -0.19 1.57 4.39 -1.16 -3.03 114.58 117.64 3h0p h GLU 215 Ca 0.14 -0.52 -0.04 0.00 0.34 0.00 0.00 59.36 59.28 3h0p h GLU 215 Cb 0.38 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.06 3h0p h GLU 215 CO 0.01 1.16 -0.05 -0.07 -1.16 0.00 0.00 179.01 178.90 3h0p h LEU 216 N 0.68 0.27 -1.62 1.33 3.38 -0.78 -1.85 115.31 116.72 3h0p h LEU 216 Ca 0.03 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3h0p h LEU 216 Cb 1.08 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.76 3h0p h LEU 216 CO 0.11 0.36 0.00 0.00 0.09 0.00 0.00 178.44 179.00 3h0p h ALA 217 N 1.67 1.00 -0.01 1.53 0.00 -1.20 -2.46 119.26 119.80 3h0p h ALA 217 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3h0p h ALA 217 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3h0p h ALA 217 CO 0.01 0.00 -0.26 1.63 0.00 0.00 0.00 179.25 180.63 3h0p n LYS 218 N -2.77 0.91 -3.99 0.00 5.02 -0.70 -4.90 118.16 111.73 3h0p n LYS 218 Ca -0.00 -0.56 -0.35 0.00 -2.02 0.00 0.00 58.31 55.38 3h0p n LYS 218 Cb 0.20 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.62 3h0p n LYS 218 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3h0p s ILE 219 N -2.47 4.72 -0.06 -0.18 1.01 -0.93 -5.06 121.20 118.23 3h0p s ILE 219 Ca 0.24 -0.05 -0.30 0.00 0.00 0.00 0.00 60.65 60.54 3h0p s ILE 219 Cb 0.19 -3.14 -0.05 0.00 0.01 0.00 0.00 42.46 39.48 3h0p s ILE 219 CO 0.51 0.45 1.50 -0.89 0.00 0.00 0.00 174.94 176.51 3h0p s THR 220 N 0.51 3.74 -0.07 2.92 2.01 -1.26 -5.03 115.64 118.45 3h0p s THR 220 Ca 0.03 0.98 -0.02 0.00 0.31 0.00 0.00 61.69 62.99 3h0p s THR 220 Cb -0.13 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.72 3h0p s THR 220 CO 0.01 -0.06 0.03 -0.36 -0.69 0.00 0.00 174.62 173.55 3h0p s PHE 221 N 3.42 3.22 0.28 4.92 0.40 -1.26 -4.54 117.98 124.41 3h0p s PHE 221 Ca 0.67 0.22 0.10 0.00 -0.60 0.00 0.00 56.93 57.33 3h0p s PHE 221 Cb -0.31 -1.79 -0.05 0.00 0.51 0.00 0.00 43.02 41.38 3h0p s PHE 221 CO 0.26 0.51 -0.16 -1.12 0.70 0.00 0.00 175.22 175.41 3h0p s SER 222 N -1.07 3.41 0.52 1.36 0.01 0.03 -4.95 113.70 113.00 3h0p s SER 222 Ca 0.15 -1.07 -0.21 0.00 1.31 0.00 0.00 55.95 56.13 3h0p s SER 222 Cb -0.11 -0.28 -0.06 0.00 0.21 0.00 0.00 66.02 65.78 3h0p s SER 222 CO 0.05 -0.07 1.15 0.00 0.41 0.00 0.00 173.24 174.78 3h0p s ALA 223 N -2.64 2.78 0.26 1.44 0.00 -1.26 -4.25 121.76 118.10 3h0p s ALA 223 Ca 0.29 0.87 -0.28 0.00 0.00 0.00 0.00 51.96 52.84 3h0p s ALA 223 Cb -0.02 -3.37 -0.09 0.00 0.00 0.00 0.00 23.12 19.63 3h0p s ALA 223 CO 0.14 -0.76 0.93 -1.25 0.00 0.00 0.00 175.76 174.82 3h0p s PRO 224 N -3.09 4.75 0.20 0.00 0.04 -1.26 -4.57 135.00 131.06 3h0p s PRO 224 Ca 0.70 1.41 0.04 0.00 0.04 0.00 0.00 61.00 63.19 3h0p s PRO 224 Cb -0.26 -3.11 0.11 0.00 0.04 0.00 0.00 34.50 31.28 3h0p s PRO 224 CO 0.30 0.44 1.46 1.79 0.04 0.00 0.00 177.00 181.03 3h0p h THR 225 N 2.97 1.46 -4.18 1.26 1.35 -1.46 -3.43 112.91 110.88 3h0p h THR 225 Ca -0.46 -2.37 -0.60 0.00 -0.55 0.00 0.00 66.41 62.43 3h0p h THR 225 Cb 1.20 2.28 -0.30 0.00 -1.73 0.00 0.00 68.15 69.59 3h0p h THR 225 CO 0.67 0.69 -0.85 -0.69 -0.25 0.00 0.00 175.52 175.09 3h0p s VAL 226 N -3.42 1.63 0.35 6.82 1.01 -1.26 -5.12 120.40 120.41 3h0p s VAL 226 Ca -0.03 -0.85 -0.29 0.00 0.00 0.00 0.00 61.98 60.81 3h0p s VAL 226 Cb 0.11 -1.37 -0.11 0.00 0.00 0.00 0.00 36.38 35.01 3h0p s VAL 226 CO 0.81 0.46 1.51 -2.84 0.00 0.00 0.00 175.10 175.05 3h0p s PRO 227 N -0.26 4.12 -0.15 2.72 0.02 -1.26 -4.90 135.00 135.29 3h0p s PRO 227 Ca 0.02 2.57 -0.00 0.00 0.02 0.00 0.00 61.00 63.61 3h0p s PRO 227 Cb -0.10 -2.99 -0.01 0.00 0.02 0.00 0.00 34.50 31.43 3h0p s PRO 227 CO 0.01 -0.56 -0.14 0.08 -0.33 0.00 0.00 177.00 176.07 3h0p s VAL 228 N -0.80 2.81 -0.25 3.83 1.01 -1.26 -4.48 120.40 121.26 3h0p s VAL 228 Ca 0.56 -0.72 -0.20 0.00 0.00 0.00 0.00 61.98 61.62 3h0p s VAL 228 Cb -0.47 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 33.70 3h0p s VAL 228 CO 0.59 0.51 0.60 0.54 0.00 0.00 0.00 175.10 177.33 3h0p s VAL 229 N 0.77 5.01 0.10 2.92 0.11 -1.26 -2.60 120.40 125.45 3h0p s VAL 229 Ca -0.05 1.06 -0.23 0.00 -2.93 0.00 0.00 61.98 59.82 3h0p s VAL 229 Cb -0.15 -3.90 -0.07 0.00 -1.53 0.00 0.00 36.38 30.72 3h0p s VAL 229 CO 0.01 0.05 0.71 0.54 -3.33 0.00 0.00 175.10 173.08 3h0p s ASN 230 N 1.48 7.24 0.07 3.54 2.20 -0.10 -4.45 114.94 124.92 3h0p s ASN 230 Ca 0.25 1.47 0.21 0.00 -0.94 0.00 0.00 52.86 53.85 3h0p s ASN 230 Cb -0.16 -2.45 0.85 0.00 -2.00 0.00 0.00 41.25 37.50 3h0p s ASN 230 CO 0.09 0.17 1.65 -0.46 -2.94 0.00 0.00 177.10 175.61 3h0p n ASN 231 N 1.99 0.22 -0.07 3.54 0.23 -1.26 -0.89 115.26 119.02 3h0p n ASN 231 Ca -0.06 0.54 -0.20 0.00 -0.53 0.00 0.00 54.58 54.33 3h0p n ASN 231 Cb 0.50 -0.59 -0.12 0.00 -2.08 0.00 0.00 39.78 37.48 3h0p n ASN 231 CO 0.00 0.00 0.00 1.62 -0.93 0.00 0.00 177.26 177.95 3h0p h VAL 232 N 0.00 1.13 0.00 3.53 3.04 -1.92 0.20 116.25 122.24 3h0p h VAL 232 Ca 0.00 -2.26 0.00 0.00 -1.01 0.00 0.00 66.70 63.43 3h0p h VAL 232 Cb 0.38 2.60 0.00 0.00 -2.01 0.00 0.00 31.29 32.25 3h0p h VAL 232 CO 0.00 0.47 -1.11 0.47 -1.01 0.00 0.00 177.57 176.39 3h0p n ASP 233 N -4.35 0.84 -3.25 3.17 8.00 -1.24 -4.75 116.55 114.96 3h0p n ASP 233 Ca -0.26 -0.82 -0.09 0.00 0.71 0.00 0.00 54.79 54.33 3h0p n ASP 233 Cb 0.69 1.15 0.02 0.00 -0.02 0.00 0.00 41.12 42.96 3h0p n ASP 233 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 3h0p n VAL 234 N -1.60 -8.75 -3.46 2.53 0.31 -0.07 -5.03 118.33 102.25 3h0p n VAL 234 Ca 0.03 -0.54 -0.12 0.00 -0.01 0.00 0.00 64.34 63.69 3h0p n VAL 234 Cb 0.35 -6.13 -0.03 0.00 -0.91 0.00 0.00 33.84 27.12 3h0p n VAL 234 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3h0p s LYS 235 N -3.85 1.11 0.09 5.55 -2.85 -1.23 -4.96 119.74 113.61 3h0p s LYS 235 Ca 0.15 -0.26 -0.20 0.00 -1.00 0.00 0.00 55.97 54.66 3h0p s LYS 235 Cb -0.03 0.52 -0.07 0.00 -2.06 0.00 0.00 37.83 36.18 3h0p s LYS 235 CO 0.78 -0.46 0.61 0.00 0.10 0.00 0.00 175.35 176.38 3h0p s GLU 237 N -1.13 0.82 0.35 0.00 2.02 -1.07 -4.97 118.70 114.72 3h0p s GLU 237 Ca 0.30 -0.96 0.23 0.00 0.02 0.00 0.00 54.97 54.56 3h0p s GLU 237 Cb -0.20 -2.12 0.33 0.00 0.10 0.00 0.00 34.13 32.24 3h0p s GLU 237 CO 0.20 -0.88 1.51 0.00 0.02 0.00 0.00 175.26 176.12 3h0p h THR 238 N 6.52 0.00 -3.15 3.63 1.03 -1.97 -3.44 112.91 115.53 3h0p h THR 238 Ca -0.14 -0.91 -0.56 0.00 -0.01 0.00 0.00 66.41 64.79 3h0p h THR 238 Cb 1.04 1.79 -0.06 0.00 -1.07 0.00 0.00 68.15 69.86 3h0p h THR 238 CO 0.44 0.00 1.07 -1.81 -0.01 0.00 0.00 175.52 175.21 3h0p s ASP 239 N -5.74 6.27 0.43 0.00 1.01 -1.26 -4.52 116.67 112.87 3h0p s ASP 239 Ca 0.06 0.59 0.19 0.00 0.71 0.00 0.00 52.55 54.11 3h0p s ASP 239 Cb 0.07 -2.54 1.13 0.00 1.01 0.00 0.00 42.92 42.59 3h0p s ASP 239 CO 0.69 -1.53 1.85 0.00 0.21 0.00 0.00 175.17 176.39 3h0p h ALA 240 N 10.76 2.28 -0.48 5.23 0.00 -1.84 -1.44 119.26 133.77 3h0p h ALA 240 Ca -0.27 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.53 3h0p h ALA 240 Cb 1.10 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 3h0p h ALA 240 CO 1.12 -0.58 -0.21 0.00 0.00 0.00 0.00 179.25 179.58 3h0p h ALA 241 N 1.60 0.71 0.00 0.00 0.00 -1.92 -2.86 119.26 116.79 3h0p h ALA 241 Ca 0.48 -0.39 -0.07 0.00 0.00 0.00 0.00 54.91 54.93 3h0p h ALA 241 Cb 1.27 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 3h0p h ALA 241 CO -0.17 0.67 -0.35 0.00 0.00 0.00 0.00 179.25 179.41 3h0p h ALA 242 N 0.89 1.21 -0.44 0.00 0.00 -1.68 -2.98 119.26 116.25 3h0p h ALA 242 Ca 0.11 -0.32 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3h0p h ALA 242 Cb 0.79 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3h0p h ALA 242 CO 0.07 0.43 0.17 0.82 0.00 0.00 0.00 179.25 180.74 3h0p h ILE 243 N 0.00 1.21 -0.56 0.00 2.04 -1.19 -1.86 117.51 117.15 3h0p h ILE 243 Ca -0.00 -0.65 -0.03 0.00 1.00 0.00 0.00 64.86 65.17 3h0p h ILE 243 Cb 0.71 0.80 -0.02 0.00 -0.74 0.00 0.00 36.82 37.57 3h0p h ILE 243 CO 0.05 0.24 0.22 -0.09 0.00 0.00 0.00 178.15 178.57 3h0p h ARG 244 N 0.57 0.84 0.00 2.37 2.43 -1.40 -1.80 114.38 117.39 3h0p h ARG 244 Ca 0.15 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 3h0p h ARG 244 Cb 0.21 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 3h0p h ARG 244 CO -0.01 0.73 -0.21 -0.44 -1.51 0.00 0.00 179.97 178.52 3h0p h ASP 245 N 0.77 0.00 -0.07 -3.80 3.32 -1.38 0.90 116.42 116.15 3h0p h ASP 245 Ca 0.19 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 57.03 3h0p h ASP 245 Cb 0.20 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.76 3h0p h ASP 245 CO -0.02 0.21 -0.78 0.00 -1.72 0.00 0.00 179.24 176.94 3h0p h ALA 246 N 1.79 0.19 -0.47 3.45 0.00 -0.88 -2.77 119.26 120.57 3h0p h ALA 246 Ca -0.00 -0.61 -0.04 0.00 0.00 0.00 0.00 54.91 54.26 3h0p h ALA 246 Cb 0.42 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3h0p h ALA 246 CO 0.03 0.57 0.12 -0.07 0.00 0.00 0.00 179.25 179.90 3h0p h LEU 247 N 0.31 0.70 -1.38 0.00 3.38 -0.87 -1.56 115.31 115.91 3h0p h LEU 247 Ca -0.08 -0.23 0.19 0.00 0.09 0.00 0.00 57.88 57.85 3h0p h LEU 247 Cb 1.43 -0.19 -0.07 0.00 0.09 0.00 0.00 40.66 41.92 3h0p h LEU 247 CO 0.16 0.75 0.59 0.58 0.09 0.00 0.00 178.44 180.61 3h0p h VAL 248 N 0.63 0.72 0.00 1.22 2.07 -0.76 -2.06 116.25 118.07 3h0p h VAL 248 Ca 0.15 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.49 3h0p h VAL 248 Cb 0.31 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 3h0p h VAL 248 CO 0.00 0.10 -0.78 0.54 0.02 0.00 0.00 177.57 177.45 3h0p n ARG 249 N -4.56 0.19 -0.29 1.57 1.74 -1.05 -4.47 116.66 109.79 3h0p n ARG 249 Ca 0.19 0.02 -0.02 0.00 -0.77 0.00 0.00 57.85 57.27 3h0p n ARG 249 Cb 0.62 -1.58 0.10 0.00 -1.02 0.00 0.00 32.46 30.58 3h0p n ARG 249 CO 0.00 0.00 0.00 0.37 -1.52 0.00 0.00 177.63 176.48 3h0p h GLN 250 N 0.00 0.95 0.00 5.56 4.15 -0.53 -3.20 115.11 122.04 3h0p h GLN 250 Ca 0.00 -0.06 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 3h0p h GLN 250 Cb 0.65 -0.21 -0.00 0.00 0.21 0.00 0.00 27.48 28.13 3h0p h GLN 250 CO 0.00 0.63 -0.02 1.25 -1.93 0.00 0.00 178.83 178.76 3h0p h LEU 251 N 0.98 0.00 -2.97 -2.39 5.85 -1.78 -2.72 115.31 112.28 3h0p h LEU 251 Ca 0.32 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.04 3h0p h LEU 251 Cb 0.03 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.06 3h0p h LEU 251 CO -0.12 0.02 0.00 0.00 -0.34 0.00 0.00 178.44 178.00 3h0p n TYR 252 N -4.22 0.32 -4.43 1.25 0.18 -1.22 -1.73 117.16 107.32 3h0p n TYR 252 Ca -0.03 -0.57 -0.25 0.00 1.88 0.00 0.00 57.90 58.93 3h0p n TYR 252 Cb 0.10 -0.07 -0.10 0.00 -0.38 0.00 0.00 39.34 38.89 3h0p n TYR 252 CO 0.00 0.00 0.00 -0.80 -2.08 0.00 0.00 176.86 173.98 3h0p s ASN 253 N -1.21 3.66 0.59 9.48 0.01 -1.03 -3.84 114.94 122.60 3h0p s ASN 253 Ca 0.18 -0.91 -0.18 0.00 -0.71 0.00 0.00 52.86 51.24 3h0p s ASN 253 Cb 0.11 -0.36 -0.04 0.00 0.41 0.00 0.00 41.25 41.38 3h0p s ASN 253 CO 0.09 0.07 1.16 -2.84 -1.51 0.00 0.00 177.10 174.07 3h0p s PRO 254 N -3.17 3.05 -0.35 -0.60 0.02 -1.24 -4.64 135.00 128.08 3h0p s PRO 254 Ca 0.26 1.67 -0.21 0.00 0.02 0.00 0.00 61.00 62.74 3h0p s PRO 254 Cb -0.06 -1.96 0.00 0.00 0.02 0.00 0.00 34.50 32.50 3h0p s PRO 254 CO 0.14 -1.10 0.67 0.08 -0.33 0.00 0.00 177.00 176.45 3h0p s VAL 255 N -1.81 4.86 -1.26 3.83 1.01 0.15 -4.50 120.40 122.68 3h0p s VAL 255 Ca 0.74 0.68 -0.07 0.00 0.00 0.00 0.00 61.98 63.32 3h0p s VAL 255 Cb -0.26 -4.10 0.18 0.00 0.00 0.00 0.00 36.38 32.20 3h0p s VAL 255 CO 0.32 -0.32 1.95 0.00 0.00 0.00 0.00 175.10 177.05 3h0p n GLN 256 N 6.11 4.02 -0.14 2.72 1.13 0.72 -0.93 117.38 131.01 3h0p n GLN 256 Ca -0.00 -3.67 -0.12 0.00 -1.94 0.00 0.00 57.00 51.27 3h0p n GLN 256 Cb 0.48 -2.79 -0.02 0.00 0.11 0.00 0.00 30.24 28.03 3h0p n GLN 256 CO 0.00 0.00 0.00 2.35 -1.44 0.00 0.00 177.06 177.97 3h0p h TRP 257 N 5.38 1.00 -0.18 1.08 2.91 -1.61 -0.37 115.95 124.16 3h0p h TRP 257 Ca 0.45 -0.25 0.04 0.00 1.13 0.00 0.00 58.89 60.26 3h0p h TRP 257 Cb 0.54 -0.23 -0.04 0.00 -0.51 0.00 0.00 29.16 28.92 3h0p h TRP 257 CO 1.31 1.03 -0.08 1.15 -1.03 0.00 0.00 178.44 180.82 3h0p h THR 258 N 0.68 0.75 -0.21 2.65 2.02 -1.05 -0.56 112.91 117.19 3h0p h THR 258 Ca 0.09 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.19 3h0p h THR 258 Cb 0.77 0.75 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 3h0p h THR 258 CO 0.06 0.00 -0.22 0.11 0.37 0.00 0.00 175.52 175.84 3h0p h LYS 259 N -0.05 0.37 -0.59 6.66 1.57 -1.81 -2.06 116.57 120.66 3h0p h LYS 259 Ca 0.09 -0.12 -0.07 0.00 -1.87 0.00 0.00 60.65 58.68 3h0p h LYS 259 Cb 0.19 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.45 3h0p h LYS 259 CO -0.21 0.58 0.08 0.77 -0.57 0.00 0.00 179.45 180.10 3h0p h SER 260 N 0.34 0.94 -0.59 0.86 0.02 -0.29 0.71 113.55 115.55 3h0p h SER 260 Ca 0.06 -0.27 -0.10 0.00 -0.84 0.00 0.00 61.79 60.64 3h0p h SER 260 Cb 0.58 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 3h0p h SER 260 CO 0.04 0.97 -0.03 0.58 -1.14 0.00 0.00 176.83 177.25 3h0p h VAL 261 N 0.88 1.27 -0.55 2.27 2.07 -0.93 -0.15 116.25 121.12 3h0p h VAL 261 Ca 0.18 -1.19 -0.06 0.00 0.82 0.00 0.00 66.70 66.45 3h0p h VAL 261 Cb 0.44 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3h0p h VAL 261 CO 0.01 0.43 0.11 -0.33 0.02 0.00 0.00 177.57 177.81 3h0p h GLU 262 N 0.95 0.86 -0.15 1.57 5.08 -1.16 -1.54 114.58 120.20 3h0p h GLU 262 Ca 0.16 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3h0p h GLU 262 Cb 0.59 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.72 3h0p h GLU 262 CO 0.04 0.79 0.00 0.35 -1.00 0.00 0.00 179.01 179.19 3h0p h PHE 263 N 0.82 0.28 -0.62 4.33 3.57 -0.38 -1.27 116.94 123.67 3h0p h PHE 263 Ca 0.18 -0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.71 3h0p h PHE 263 Cb 0.33 -0.07 -0.07 0.00 2.79 0.00 0.00 35.95 38.93 3h0p h PHE 263 CO 0.02 0.47 0.27 0.82 -2.23 0.00 0.00 178.31 177.66 3h0p h ILE 264 N 0.00 0.82 -0.56 1.41 2.04 -0.85 -1.49 117.51 118.89 3h0p h ILE 264 Ca 0.04 -0.16 -0.07 0.00 1.00 0.00 0.00 64.86 65.67 3h0p h ILE 264 Cb 0.36 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 3h0p h ILE 264 CO 0.01 0.09 0.05 0.00 0.00 0.00 0.00 178.15 178.30 3h0p h ALA 265 N 1.40 1.04 0.00 1.87 0.00 -1.15 -1.78 119.26 120.64 3h0p h ALA 265 Ca 0.30 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3h0p h ALA 265 Cb 0.33 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3h0p h ALA 265 CO -0.27 0.61 0.00 0.00 0.00 0.00 0.00 179.25 179.59 3h0p n ALA 266 N -2.47 1.33 1.40 0.00 0.00 -0.49 -1.12 120.51 119.15 3h0p n ALA 266 Ca 0.03 0.13 0.14 0.00 0.00 0.00 0.00 53.44 53.74 3h0p n ALA 266 Cb 0.29 -1.32 0.47 0.00 0.00 0.00 0.00 19.45 18.89 3h0p n ALA 266 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3h0p n GLN 267 N -2.17 1.30 -0.12 0.00 1.13 -0.67 -4.93 117.38 111.92 3h0p n GLN 267 Ca 0.00 -0.74 0.00 0.00 -1.94 0.00 0.00 57.00 54.32 3h0p n GLN 267 Cb 0.12 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 28.99 3h0p n GLN 267 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3h0p n GLY 268 N 1.24 0.56 3.73 1.08 0.00 -0.28 -5.06 105.19 106.47 3h0p n GLY 268 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 3h0p n GLY 268 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3h0p s VAL 269 N -2.24 3.03 -0.15 1.61 1.01 -1.22 -4.93 120.40 117.52 3h0p s VAL 269 Ca 0.00 0.83 0.18 0.00 0.00 0.00 0.00 61.98 62.98 3h0p s VAL 269 Cb 0.00 -3.53 -0.25 0.00 0.00 0.00 0.00 36.38 32.60 3h0p s VAL 269 CO 0.00 0.11 0.16 -0.62 0.00 0.00 0.00 175.10 174.75 3h0p n GLU 270 N 2.89 0.84 -3.96 2.72 1.02 0.11 -4.56 120.64 119.70 3h0p n GLU 270 Ca 0.08 -0.05 -0.12 0.00 -0.02 0.00 0.00 57.16 57.05 3h0p n GLU 270 Cb 0.42 -1.48 -0.13 0.00 -0.02 0.00 0.00 31.44 30.22 3h0p n GLU 270 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3h0p s HIS 271 N -2.70 0.20 -0.16 -0.32 5.04 -1.01 -2.31 115.29 114.03 3h0p s HIS 271 Ca -0.09 -0.19 -0.01 0.00 -1.54 0.00 0.00 55.06 53.23 3h0p s HIS 271 Cb 0.07 -0.13 -0.01 0.00 0.04 0.00 0.00 32.58 32.55 3h0p s HIS 271 CO 0.79 -0.06 -0.11 -0.51 -2.34 0.00 0.00 174.74 172.51 3h0p s LEU 272 N -0.53 2.71 -0.23 8.88 1.02 -0.52 -1.81 118.68 128.20 3h0p s LEU 272 Ca -0.05 -0.38 -0.09 0.00 0.02 0.00 0.00 54.13 53.63 3h0p s LEU 272 Cb -0.04 -1.64 -0.04 0.00 0.02 0.00 0.00 46.19 44.49 3h0p s LEU 272 CO -0.00 0.09 0.12 -0.31 0.02 0.00 0.00 176.35 176.27 3h0p s TYR 273 N 0.80 3.24 -0.41 0.29 2.02 -0.40 -2.00 117.35 120.89 3h0p s TYR 273 Ca -0.04 0.06 -0.25 0.00 -0.37 0.00 0.00 57.07 56.46 3h0p s TYR 273 Cb -0.15 -2.23 0.02 0.00 -0.40 0.00 0.00 41.96 39.20 3h0p s TYR 273 CO 0.01 -0.02 0.92 -2.00 -1.57 0.00 0.00 175.55 172.89 3h0p s GLU 274 N 1.07 3.70 -1.09 -0.62 2.12 0.20 -1.13 118.70 122.95 3h0p s GLU 274 Ca 0.06 0.37 -0.08 0.00 0.36 0.00 0.00 54.97 55.68 3h0p s GLU 274 Cb -0.14 -3.86 0.27 0.00 0.26 0.00 0.00 34.13 30.67 3h0p s GLU 274 CO 0.04 -1.07 1.08 0.28 -0.54 0.00 0.00 175.26 175.06 3h0p n VAL 275 N 6.17 4.41 0.00 3.70 0.31 -0.03 -1.24 118.33 131.65 3h0p n VAL 275 Ca 0.06 -5.36 0.00 0.00 -0.01 0.00 0.00 64.34 59.03 3h0p n VAL 275 Cb 0.48 -2.56 0.00 0.00 -0.91 0.00 0.00 33.84 30.85 3h0p n VAL 275 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3h0p n GLY 276 N 2.61 -0.76 3.79 2.92 0.00 -1.26 -4.50 105.19 107.99 3h0p n GLY 276 Ca 0.24 -1.07 -0.31 0.00 0.00 0.00 0.00 46.02 44.88 3h0p n GLY 276 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3h0p s PRO 277 N -2.00 2.58 1.39 1.61 0.04 -1.26 -4.42 135.00 132.94 3h0p s PRO 277 Ca 0.00 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.16 3h0p s PRO 277 Cb 0.00 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.60 3h0p s PRO 277 CO 0.00 -1.39 0.00 0.41 0.04 0.00 0.00 177.00 176.06 3h0p n GLY 278 N -1.40 -1.72 1.73 0.56 0.00 -1.25 -4.75 105.19 98.36 3h0p n GLY 278 Ca 0.09 -1.32 0.02 0.00 0.00 0.00 0.00 46.02 44.80 3h0p n GLY 278 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h0p n LYS 279 N -0.28 0.37 0.33 1.61 5.02 -1.26 -4.89 118.16 119.06 3h0p n LYS 279 Ca 0.00 -2.13 -0.17 0.00 -2.02 0.00 0.00 58.31 53.99 3h0p n LYS 279 Cb 0.00 -0.22 -0.09 0.00 -0.02 0.00 0.00 35.03 34.70 3h0p n LYS 279 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 3h0p h VAL 280 N 6.41 0.38 -0.40 -0.18 2.07 -1.97 -1.07 116.25 121.49 3h0p h VAL 280 Ca -0.26 -0.11 -0.09 0.00 0.82 0.00 0.00 66.70 67.06 3h0p h VAL 280 Cb 1.71 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 3h0p h VAL 280 CO 0.06 0.02 -0.11 -0.07 0.02 0.00 0.00 177.57 177.49 3h0p h LEU 281 N -0.89 0.69 -0.37 2.57 3.38 -1.95 -2.57 115.31 116.16 3h0p h LEU 281 Ca -0.08 -0.20 0.06 0.00 0.09 0.00 0.00 57.88 57.75 3h0p h LEU 281 Cb 0.65 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 41.17 3h0p h LEU 281 CO 0.14 0.82 0.06 0.74 0.09 0.00 0.00 178.44 180.29 3h0p h THR 282 N 0.64 0.79 -0.67 0.22 2.02 -1.89 -2.34 112.91 111.68 3h0p h THR 282 Ca 0.11 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.22 3h0p h THR 282 Cb 0.56 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.54 3h0p h THR 282 CO 0.03 0.03 0.36 1.23 0.37 0.00 0.00 175.52 177.55 3h0p h GLY 283 N 0.17 0.98 2.00 2.16 0.00 -0.81 -3.00 103.07 104.58 3h0p h GLY 283 Ca 0.18 -0.43 -0.09 0.00 0.00 0.00 0.00 47.33 46.99 3h0p h GLY 283 CO -0.25 0.42 -0.42 1.41 0.00 0.00 0.00 176.54 177.69 3h0p h LEU 284 N 0.93 0.00 -0.01 3.11 3.38 -1.12 -3.39 115.31 118.20 3h0p h LEU 284 Ca 0.24 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.23 3h0p h LEU 284 Cb 0.03 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.72 3h0p h LEU 284 CO -0.04 0.42 -0.53 0.74 0.09 0.00 0.00 178.44 179.12 3h0p h THR 285 N 0.00 0.00 0.00 0.22 2.02 -1.33 -2.13 112.91 111.69 3h0p h THR 285 Ca -0.00 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.14 3h0p h THR 285 Cb 0.89 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.29 3h0p h THR 285 CO 0.06 0.00 -0.16 0.11 0.37 0.00 0.00 175.52 175.90 3h0p h LYS 286 N -0.66 0.00 0.00 6.66 1.57 -1.75 -0.36 116.57 122.03 3h0p h LYS 286 Ca 0.01 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 3h0p h LYS 286 Cb 0.71 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.01 3h0p h LYS 286 CO -0.36 0.16 -0.30 0.00 -0.57 0.00 0.00 179.45 178.38 3h0p h ARG 287 N 0.00 0.00 0.00 3.15 3.08 -1.62 -2.92 114.38 116.07 3h0p h ARG 287 Ca -0.00 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.98 3h0p h ARG 287 Cb 0.48 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 3h0p h ARG 287 CO 0.02 0.30 -0.51 0.82 -1.07 0.00 0.00 179.97 179.53 3h0p h ILE 288 N 0.00 0.62 -3.51 2.04 2.04 -0.72 -3.41 117.51 114.57 3h0p h ILE 288 Ca -0.00 -1.60 -0.59 0.00 1.00 0.00 0.00 64.86 63.66 3h0p h ILE 288 Cb 0.56 1.31 -0.39 0.00 -0.74 0.00 0.00 36.82 37.56 3h0p h ILE 288 CO 0.04 0.21 -0.77 -0.69 0.00 0.00 0.00 178.15 176.93 3h0p s VAL 289 N -2.12 1.29 0.52 1.67 1.01 -0.27 -4.97 120.40 117.53 3h0p s VAL 289 Ca -0.16 -1.17 0.20 0.00 0.00 0.00 0.00 61.98 60.84 3h0p s VAL 289 Cb 0.02 -1.68 0.28 0.00 0.00 0.00 0.00 36.38 35.00 3h0p s VAL 289 CO 0.37 -0.22 2.15 -0.78 0.00 0.00 0.00 175.10 176.63 3h0p h ASP 290 N 8.01 0.00 0.86 3.32 -0.00 -1.76 -2.54 116.42 124.30 3h0p h ASP 290 Ca -0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.87 3h0p h ASP 290 Cb 1.07 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.40 3h0p h ASP 290 CO 0.41 0.03 -0.28 0.35 -0.00 0.00 0.00 179.24 179.74 3h0p n THR 291 N -4.31 0.13 -2.74 2.25 -2.24 -1.26 -4.85 114.28 101.27 3h0p n THR 291 Ca -0.03 -0.08 -0.37 0.00 -2.27 0.00 0.00 64.05 61.30 3h0p n THR 291 Cb 0.11 -0.18 -0.06 0.00 -2.10 0.00 0.00 70.33 68.10 3h0p n THR 291 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3h0p s LEU 292 N -3.40 4.34 0.24 3.22 1.43 -0.96 -5.01 118.68 118.54 3h0p s LEU 292 Ca 0.11 1.88 0.08 0.00 -1.03 0.00 0.00 54.13 55.17 3h0p s LEU 292 Cb 0.17 -4.01 -0.04 0.00 0.03 0.00 0.00 46.19 42.34 3h0p s LEU 292 CO 0.63 -0.11 0.12 0.42 0.23 0.00 0.00 176.35 177.64 3h0p s THR 293 N -1.59 4.10 0.05 5.49 -4.23 -0.98 -4.56 115.64 113.92 3h0p s THR 293 Ca 0.50 -1.53 -0.12 0.00 -1.18 0.00 0.00 61.69 59.36 3h0p s THR 293 Cb -0.20 -3.19 0.02 0.00 1.34 0.00 0.00 72.50 70.47 3h0p s THR 293 CO 0.25 -0.32 0.27 0.00 -0.54 0.00 0.00 174.62 174.29 3h0p s ALA 294 N -2.13 -0.59 0.15 3.99 0.00 -1.26 -1.43 121.76 120.49 3h0p s ALA 294 Ca 0.32 -0.09 -0.23 0.00 0.00 0.00 0.00 51.96 51.95 3h0p s ALA 294 Cb -0.08 0.33 0.07 0.00 0.00 0.00 0.00 23.12 23.44 3h0p s ALA 294 CO 0.23 -0.41 0.60 -1.54 0.00 0.00 0.00 175.76 174.64 3h0p s SER 295 N -2.12 -0.57 0.17 0.00 1.04 -0.85 -4.96 113.70 106.42 3h0p s SER 295 Ca -0.04 0.03 0.03 0.00 0.48 0.00 0.00 55.95 56.45 3h0p s SER 295 Cb -0.01 0.59 -0.03 0.00 0.10 0.00 0.00 66.02 66.67 3h0p s SER 295 CO -0.04 -0.95 0.28 0.00 0.98 0.00 0.00 173.24 173.52 3h0p s ALA 296 N -3.62 3.91 -0.35 5.32 0.00 -1.26 -0.63 121.76 125.13 3h0p s ALA 296 Ca 0.00 -1.11 0.06 0.00 0.00 0.00 0.00 51.96 50.92 3h0p s ALA 296 Cb -0.01 -1.71 0.45 0.00 0.00 0.00 0.00 23.12 21.85 3h0p s ALA 296 CO -0.12 0.46 1.25 1.28 0.00 0.00 0.00 175.76 178.63 3h0p n LEU 297 N -0.74 5.14 -0.11 0.00 4.77 -0.37 -4.70 117.00 120.98 3h0p n LEU 297 Ca -0.08 -4.80 0.08 0.00 -0.03 0.00 0.00 56.01 51.18 3h0p n LEU 297 Cb 0.55 -0.42 -0.06 0.00 -2.33 0.00 0.00 43.42 41.16 3h0p n LEU 297 CO 0.47 2.08 0.05 -0.46 -1.33 0.00 0.00 177.39 178.20 3h0p n ASN 298 N -0.68 1.00 -4.74 -1.43 0.23 -1.26 -4.78 115.26 103.60 3h0p n ASN 298 Ca 0.45 -1.00 -0.35 0.00 -0.53 0.00 0.00 54.58 53.14 3h0p n ASN 298 Cb 0.88 0.85 -0.08 0.00 -2.08 0.00 0.00 39.78 39.35 3h0p n ASN 298 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 3h0p s GLU 299 N -2.32 3.69 0.19 -3.83 2.02 -1.26 -4.78 118.70 112.40 3h0p s GLU 299 Ca 0.08 -0.26 -0.18 0.00 0.02 0.00 0.00 54.97 54.63 3h0p s GLU 299 Cb 0.12 -3.18 0.15 0.00 0.10 0.00 0.00 34.13 31.32 3h0p s GLU 299 CO 0.58 0.51 1.62 -1.35 0.02 0.00 0.00 175.26 176.63 3h0p h PRO 300 N 5.90 -0.10 -0.14 0.39 0.11 -1.92 -0.86 132.00 135.38 3h0p h PRO 300 Ca -0.46 0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.59 3h0p h PRO 300 Cb 1.19 0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3h0p h PRO 300 CO 0.65 -0.07 -0.24 0.00 -0.21 0.00 0.00 178.00 178.13 3h0p h ALA 301 N 1.25 1.34 -0.18 -0.75 0.00 -1.98 -0.76 119.26 118.18 3h0p h ALA 301 Ca 0.24 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3h0p h ALA 301 Cb 0.47 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 3h0p h ALA 301 CO -0.58 0.45 0.04 0.00 0.00 0.00 0.00 179.25 179.17 3h0p h ALA 302 N 1.53 0.24 -0.60 0.00 0.00 -1.71 -0.36 119.26 118.36 3h0p h ALA 302 Ca 0.04 -0.15 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 3h0p h ALA 302 Cb 0.55 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3h0p h ALA 302 CO 0.04 -0.12 -0.00 1.25 0.00 0.00 0.00 179.25 180.42 3h0p h LEU 303 N 0.10 1.04 -0.87 0.00 6.46 -0.93 -1.17 115.31 119.94 3h0p h LEU 303 Ca 0.06 -0.30 -0.04 0.00 -0.12 0.00 0.00 57.88 57.48 3h0p h LEU 303 Cb 0.27 -0.28 -0.03 0.00 -0.73 0.00 0.00 40.66 39.89 3h0p h LEU 303 CO 0.00 1.09 0.32 -1.28 -0.62 0.00 0.00 178.44 177.95 3h0p h SER 304 N 0.97 1.05 -0.47 1.25 0.87 -1.01 -2.01 113.55 114.20 3h0p h SER 304 Ca 0.17 -0.15 -0.09 0.00 -1.23 0.00 0.00 61.79 60.49 3h0p h SER 304 Cb 0.56 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 3h0p h SER 304 CO 0.03 0.92 -0.06 0.00 -0.53 0.00 0.00 176.83 177.19 3h0p h ALA 305 N 1.23 0.64 -0.89 6.23 0.00 -0.81 -2.84 119.26 122.82 3h0p h ALA 305 Ca 0.26 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 3h0p h ALA 305 Cb 0.19 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 3h0p h ALA 305 CO -0.02 0.50 0.55 0.00 0.00 0.00 0.00 179.25 180.28 3h0p h ALA 306 N 0.90 1.13 -0.38 0.00 0.00 -0.82 -2.77 119.26 117.31 3h0p h ALA 306 Ca 0.13 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3h0p h ALA 306 Cb 0.59 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 3h0p h ALA 306 CO 0.04 0.57 -0.11 -0.07 0.00 0.00 0.00 179.25 179.67 3h0p h LEU 307 N 1.21 0.76 -7.26 0.00 3.38 -1.34 -3.36 115.31 108.70 3h0p h LEU 307 Ca 0.32 -0.37 -0.72 0.00 0.09 0.00 0.00 57.88 57.20 3h0p h LEU 307 Cb -0.08 -0.21 -0.12 0.00 0.09 0.00 0.00 40.66 40.34 3h0p h LEU 307 CO -0.06 0.96 2.03 1.07 0.09 0.00 0.00 178.44 182.52 3h0p n THR 308 N -4.34 4.05 -0.28 0.22 5.66 -1.05 -4.99 114.28 113.55 3h0p n THR 308 Ca -0.02 -4.21 0.00 0.00 -3.05 0.00 0.00 64.05 56.78 3h0p n THR 308 Cb 0.37 -2.43 0.00 0.00 -1.55 0.00 0.00 70.33 66.72 3h0p n THR 308 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02