#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 3.73 -4.23 -0.78 1.13 -1.26 -4.58 117.38 111.39 3h0p n GLN 3 Ca 0.00 -2.90 -0.17 0.00 -1.94 0.00 0.00 57.00 51.99 3h0p n GLN 3 Cb 0.00 -1.96 -0.11 0.00 0.11 0.00 0.00 30.24 28.29 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 -2.52 1.32 0.25 1.08 -0.71 -1.26 -0.96 117.98 115.17 3h0p s PHE 4 Ca 0.46 -0.61 0.10 0.00 -1.04 0.00 0.00 56.93 55.85 3h0p s PHE 4 Cb 0.35 -0.69 -0.05 0.00 -1.21 0.00 0.00 43.02 41.43 3h0p s PHE 4 CO 0.14 0.11 -0.18 0.00 -1.34 0.00 0.00 175.22 173.95 3h0p s ALA 5 N -2.45 2.47 -0.17 1.99 0.00 -0.36 -1.50 121.76 121.74 3h0p s ALA 5 Ca 0.10 -1.78 -0.04 0.00 0.00 0.00 0.00 51.96 50.25 3h0p s ALA 5 Cb -0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 3h0p s ALA 5 CO 0.02 0.22 -0.04 -0.06 0.00 0.00 0.00 175.76 175.90 3h0p s PHE 6 N -2.58 3.00 -0.04 0.00 0.40 -0.79 -1.30 117.98 116.67 3h0p s PHE 6 Ca 0.26 -0.44 0.07 0.00 -0.60 0.00 0.00 56.93 56.23 3h0p s PHE 6 Cb -0.04 -1.99 -0.02 0.00 0.51 0.00 0.00 43.02 41.49 3h0p s PHE 6 CO 0.12 -0.15 -0.25 0.14 0.70 0.00 0.00 175.22 175.77 3h0p s VAL 7 N 0.62 2.08 -0.16 -0.44 -7.23 -0.21 -1.57 120.40 113.49 3h0p s VAL 7 Ca -0.03 -1.08 -0.00 0.00 -1.81 0.00 0.00 61.98 59.06 3h0p s VAL 7 Cb -0.14 -1.73 -0.00 0.00 0.56 0.00 0.00 36.38 35.06 3h0p s VAL 7 CO 0.02 0.58 -0.14 -0.36 -0.31 0.00 0.00 175.10 174.89 3h0p s PHE 8 N -0.39 2.80 0.62 2.82 0.08 0.26 -0.71 117.98 123.47 3h0p s PHE 8 Ca 0.03 -0.99 -0.08 0.00 0.12 0.00 0.00 56.93 56.01 3h0p s PHE 8 Cb -0.12 -1.90 0.00 0.00 -0.57 0.00 0.00 43.02 40.43 3h0p s PHE 8 CO 0.01 -0.45 0.97 -1.25 -0.10 0.00 0.00 175.22 174.40 3h0p s PRO 9 N 0.83 3.03 0.00 0.24 0.04 -1.26 -0.81 135.00 137.06 3h0p s PRO 9 Ca -0.05 0.25 0.00 0.00 0.04 0.00 0.00 61.00 61.24 3h0p s PRO 9 Cb -0.15 -2.18 0.00 0.00 0.04 0.00 0.00 34.50 32.21 3h0p s PRO 9 CO -0.00 -0.75 0.00 0.41 0.04 0.00 0.00 177.00 176.70 3h0p n GLY 10 N -2.71 6.50 3.53 0.56 0.00 -1.22 -3.76 105.19 108.10 3h0p n GLY 10 Ca 0.05 -1.90 -0.50 0.00 0.00 0.00 0.00 46.02 43.66 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 0.72 0.00 1.61 -0.06 -1.26 -2.57 117.38 115.81 3h0p n GLN 11 Ca 0.00 0.26 0.00 0.00 -2.00 0.00 0.00 57.00 55.26 3h0p n GLN 11 Cb 0.00 -1.65 0.00 0.00 -4.06 0.00 0.00 30.24 24.53 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 1.87 2.26 0.14 1.69 0.00 -1.26 -4.92 105.19 104.97 3h0p n GLY 12 Ca 0.16 0.00 0.13 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 0.75 -4.79 1.61 7.64 -1.06 -4.90 113.62 112.86 3h0p n SER 13 Ca 0.00 -0.59 -0.32 0.00 1.01 0.00 0.00 58.87 58.97 3h0p n SER 13 Cb 0.00 0.12 0.04 0.00 -1.01 0.00 0.00 64.21 63.37 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 -2.68 2.93 -0.11 1.43 0.00 -1.26 -3.99 119.66 115.97 3h0p s GLN 14 Ca 0.20 1.20 -0.30 0.00 -0.00 0.00 0.00 55.36 56.46 3h0p s GLN 14 Cb 0.19 -1.98 0.09 0.00 0.00 0.00 0.00 33.01 31.31 3h0p s GLN 14 CO 0.57 -1.12 0.81 -1.54 0.00 0.00 0.00 175.29 174.01 3h0p s SER 15 N -3.03 -0.55 0.06 12.60 1.04 -1.26 -5.03 113.70 117.53 3h0p s SER 15 Ca 0.63 0.66 -0.31 0.00 0.48 0.00 0.00 55.95 57.41 3h0p s SER 15 Cb -0.17 0.53 -0.07 0.00 0.10 0.00 0.00 66.02 66.41 3h0p s SER 15 CO 0.45 -0.47 1.50 -0.69 0.98 0.00 0.00 173.24 175.01 3h0p s VAL 16 N -1.00 3.29 0.00 5.02 1.01 -1.26 -4.89 120.40 122.57 3h0p s VAL 16 Ca -0.06 0.79 0.00 0.00 0.00 0.00 0.00 61.98 62.71 3h0p s VAL 16 Cb -0.01 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.86 3h0p s VAL 16 CO 0.06 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.79 3h0p n GLY 17 N 3.74 -0.52 0.00 4.51 0.00 0.61 -4.98 105.19 108.55 3h0p n GLY 17 Ca 0.14 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.08 0.99 4.32 -1.26 -4.71 117.00 116.26 3h0p n LEU 19 Ca 0.00 0.00 -0.07 0.00 -0.02 0.00 0.00 56.01 55.92 3h0p n LEU 19 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 3h0p n LEU 19 CO 0.00 0.00 0.91 0.00 -1.22 0.00 0.00 177.39 177.08 3h0p h ALA 20 N 0.10 0.34 0.00 -1.18 0.00 -1.99 -0.23 119.26 116.30 3h0p h ALA 20 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3h0p h ALA 20 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 3h0p h ALA 20 CO 0.00 -0.32 0.00 0.39 0.00 0.00 0.00 179.25 179.32 3h0p n GLU 21 N -5.05 0.44 0.00 0.00 -0.58 -1.26 -2.48 120.64 111.71 3h0p n GLU 21 Ca -0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 3h0p n GLU 21 Cb 0.12 -1.28 0.00 0.00 -0.57 0.00 0.00 31.44 29.71 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 0.92 0.00 0.22 0.62 0.00 -0.10 -2.44 120.51 119.73 3h0p n ALA 23 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 3h0p n ALA 23 Cb 0.22 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.16 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 1.17 0.15 0.00 0.00 -1.75 -3.14 119.26 115.68 3h0p h ALA 24 Ca 0.00 -0.24 -0.32 0.00 0.00 0.00 0.00 54.91 54.35 3h0p h ALA 24 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3h0p h ALA 24 CO 0.00 0.34 -1.58 -0.97 0.00 0.00 0.00 179.25 177.04 3h0p h ASN 25 N 0.00 0.48 -3.25 0.00 -0.73 -1.78 -3.45 115.58 106.84 3h0p h ASN 25 Ca -0.00 -0.66 -0.43 0.00 1.87 0.00 0.00 56.30 57.08 3h0p h ASN 25 Cb 0.65 -0.16 -0.39 0.00 0.27 0.00 0.00 38.32 38.69 3h0p h ASN 25 CO 0.03 1.55 -0.76 -0.31 -0.37 0.00 0.00 177.43 177.58 3h0p s TYR 26 N -2.61 0.50 0.52 0.67 2.02 -1.19 -5.02 117.35 112.25 3h0p s TYR 26 Ca -0.11 -0.15 0.42 0.00 -0.37 0.00 0.00 57.07 56.87 3h0p s TYR 26 Cb 0.06 -0.73 2.16 0.00 -0.40 0.00 0.00 41.96 43.05 3h0p s TYR 26 CO 0.86 -0.34 2.28 -1.35 -1.57 0.00 0.00 175.55 175.43 3h0p h PRO 27 N 8.36 0.00 0.00 -1.71 0.11 -1.89 -2.47 132.00 134.40 3h0p h PRO 27 Ca -0.17 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.93 3h0p h PRO 27 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3h0p h PRO 27 CO 0.24 0.00 -0.03 0.97 -0.21 0.00 0.00 178.00 178.97 3h0p h ILE 28 N 0.00 0.15 0.55 4.15 2.10 -1.95 -2.24 117.51 120.27 3h0p h ILE 28 Ca 0.00 -0.36 -0.03 0.00 1.08 0.00 0.00 64.86 65.55 3h0p h ILE 28 Cb 0.13 1.31 0.01 0.00 -1.09 0.00 0.00 36.82 37.18 3h0p h ILE 28 CO 0.00 0.03 -0.27 0.58 -1.08 0.00 0.00 178.15 177.42 3h0p h VAL 29 N 0.00 0.42 0.00 2.19 2.07 -1.74 -0.70 116.25 118.48 3h0p h VAL 29 Ca -0.00 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.27 3h0p h VAL 29 Cb 0.30 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.56 3h0p h VAL 29 CO 0.00 0.03 -0.22 -0.33 0.02 0.00 0.00 177.57 177.08 3h0p h GLU 30 N -0.87 0.00 -0.34 1.57 5.08 -1.70 -1.96 114.58 116.36 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 0.62 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.86 3h0p h GLU 30 CO 0.12 0.22 -0.30 0.93 -1.00 0.00 0.00 179.01 178.98 3h0p h GLU 31 N 0.00 0.81 -0.45 2.33 5.08 -1.33 0.10 114.58 121.13 3h0p h GLU 31 Ca -0.00 -0.41 0.01 0.00 -1.00 0.00 0.00 59.36 57.95 3h0p h GLU 31 Cb 0.57 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.80 3h0p h GLU 31 CO 0.03 1.04 0.29 1.15 -1.00 0.00 0.00 179.01 180.52 3h0p h THR 32 N 0.59 1.11 -0.13 1.13 2.02 -0.63 -1.94 112.91 115.06 3h0p h THR 32 Ca 0.06 -0.20 -0.05 0.00 0.77 0.00 0.00 66.41 66.98 3h0p h THR 32 Cb 0.87 0.46 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 3h0p h THR 32 CO 0.08 0.11 -0.17 -0.26 0.37 0.00 0.00 175.52 175.65 3h0p h PHE 33 N 0.60 0.22 -0.62 3.16 0.04 -1.31 -2.35 116.94 116.68 3h0p h PHE 33 Ca 0.16 -0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.84 3h0p h PHE 33 Cb -0.06 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.00 3h0p h PHE 33 CO -0.05 0.38 0.13 0.00 -0.60 0.00 0.00 178.31 178.17 3h0p h ALA 34 N 1.64 1.07 -0.48 2.45 0.00 -0.30 0.27 119.26 123.91 3h0p h ALA 34 Ca 0.04 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 3h0p h ALA 34 Cb 0.42 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3h0p h ALA 34 CO 0.03 0.61 0.17 1.49 0.00 0.00 0.00 179.25 181.55 3h0p h GLU 35 N 0.93 0.73 -0.21 0.00 4.81 -0.88 -0.52 114.58 119.44 3h0p h GLU 35 Ca 0.20 -0.15 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 3h0p h GLU 35 Cb 0.36 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 3h0p h GLU 35 CO 0.00 0.67 0.02 0.00 -0.73 0.00 0.00 179.01 178.97 3h0p h ALA 36 N 1.02 0.28 -1.00 2.92 0.00 -1.02 -2.73 119.26 118.72 3h0p h ALA 36 Ca 0.16 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 55.01 3h0p h ALA 36 Cb 0.23 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.86 3h0p h ALA 36 CO -0.01 -0.03 0.63 0.77 0.00 0.00 0.00 179.25 180.61 3h0p h SER 37 N 0.13 0.88 0.03 0.00 0.02 -0.28 0.19 113.55 114.52 3h0p h SER 37 Ca 0.06 0.06 -0.07 0.00 -0.84 0.00 0.00 61.79 61.00 3h0p h SER 37 Cb 0.36 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 3h0p h SER 37 CO 0.01 0.43 -0.19 0.00 -1.14 0.00 0.00 176.83 175.95 3h0p h ALA 38 N 1.57 1.36 0.01 3.77 0.00 -0.93 0.13 119.26 125.17 3h0p h ALA 38 Ca 0.51 -0.27 -0.22 0.00 0.00 0.00 0.00 54.91 54.94 3h0p h ALA 38 Cb 0.60 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3h0p h ALA 38 CO -0.29 0.44 -1.04 0.00 0.00 0.00 0.00 179.25 178.36 3h0p h ALA 39 N 1.53 0.35 0.03 0.00 0.00 -0.72 -3.34 119.26 117.11 3h0p h ALA 39 Ca 0.05 -0.93 -0.28 0.00 0.00 0.00 0.00 54.91 53.75 3h0p h ALA 39 Cb 0.50 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3h0p h ALA 39 CO 0.03 1.24 -1.50 -0.07 0.00 0.00 0.00 179.25 178.95 3h0p h LEU 40 N 0.00 0.11 0.00 0.00 3.38 -0.47 -3.48 115.31 114.86 3h0p h LEU 40 Ca -0.03 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.76 3h0p h LEU 40 Cb 1.79 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 42.51 3h0p h LEU 40 CO 0.13 1.15 0.00 0.61 0.09 0.00 0.00 178.44 180.42 3h0p n GLY 41 N 1.55 0.79 3.35 0.83 0.00 0.45 -5.06 105.19 107.10 3h0p n GLY 41 Ca -0.13 -0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.21 -0.81 1.61 -0.85 -1.17 -5.07 117.35 108.86 3h0p s TYR 42 Ca 0.00 -0.10 -0.26 0.00 -0.52 0.00 0.00 57.07 56.19 3h0p s TYR 42 Cb 0.00 0.30 0.03 0.00 0.38 0.00 0.00 41.96 42.66 3h0p s TYR 42 CO 0.00 -0.74 1.43 0.34 -1.52 0.00 0.00 175.55 175.05 3h0p s ASP 43 N -2.81 6.10 0.21 -0.18 -1.08 -1.26 -4.33 116.67 113.32 3h0p s ASP 43 Ca 0.04 -0.64 -0.07 0.00 -0.52 0.00 0.00 52.55 51.36 3h0p s ASP 43 Cb 0.01 -2.56 0.17 0.00 -1.46 0.00 0.00 42.92 39.08 3h0p s ASP 43 CO -0.11 -1.86 1.73 0.25 0.52 0.00 0.00 175.17 175.70 3h0p h LEU 44 N 13.60 1.01 -0.23 -1.34 5.85 -1.90 -2.01 115.31 130.30 3h0p h LEU 44 Ca -0.13 -0.22 -0.01 0.00 0.84 0.00 0.00 57.88 58.36 3h0p h LEU 44 Cb 1.05 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 3h0p h LEU 44 CO 1.31 0.99 0.12 -0.25 -0.34 0.00 0.00 178.44 180.27 3h0p h TRP 45 N 1.01 0.33 -0.92 1.25 2.91 -1.89 -1.78 115.95 116.86 3h0p h TRP 45 Ca 0.21 -0.01 0.07 0.00 1.13 0.00 0.00 58.89 60.28 3h0p h TRP 45 Cb 0.39 -0.10 -0.07 0.00 -0.51 0.00 0.00 29.16 28.87 3h0p h TRP 45 CO 0.03 0.31 0.57 0.00 -1.03 0.00 0.00 178.44 178.32 3h0p h ALA 46 N 0.99 1.28 -0.44 2.65 0.00 -1.90 -0.74 119.26 121.09 3h0p h ALA 46 Ca 0.08 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3h0p h ALA 46 Cb 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3h0p h ALA 46 CO -0.01 0.32 0.27 1.25 0.00 0.00 0.00 179.25 181.07 3h0p h LEU 47 N 1.03 0.53 -1.28 0.00 5.85 -0.94 0.25 115.31 120.75 3h0p h LEU 47 Ca 0.40 -0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.99 3h0p h LEU 47 Cb 0.21 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 3h0p h LEU 47 CO -0.19 0.43 -0.36 0.71 -0.34 0.00 0.00 178.44 178.70 3h0p h THR 48 N 0.59 1.23 0.02 1.05 1.35 -0.46 0.60 112.91 117.29 3h0p h THR 48 Ca 0.16 -1.24 -0.30 0.00 -0.55 0.00 0.00 66.41 64.47 3h0p h THR 48 Cb -0.00 1.68 -0.04 0.00 -1.73 0.00 0.00 68.15 68.05 3h0p h THR 48 CO -0.03 0.35 -1.74 1.56 -0.25 0.00 0.00 175.52 175.42 3h0p h GLN 49 N 0.00 0.05 0.00 4.72 1.08 -0.80 0.17 115.11 120.33 3h0p h GLN 49 Ca -0.00 -0.09 -0.08 0.00 -1.45 0.00 0.00 58.65 57.03 3h0p h GLN 49 Cb 0.65 0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.09 3h0p h GLN 49 CO 0.05 0.64 -1.76 1.04 -0.95 0.00 0.00 178.83 177.85 3h0p n GLN 50 N -3.13 0.88 0.00 1.46 1.13 0.85 -4.14 117.38 114.43 3h0p n GLN 50 Ca -0.19 -0.09 0.00 0.00 -1.94 0.00 0.00 57.00 54.78 3h0p n GLN 50 Cb 1.05 -1.35 0.00 0.00 0.11 0.00 0.00 30.24 30.05 3h0p n GLN 50 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3h0p n GLY 51 N 1.83 1.56 3.67 1.08 0.00 0.20 -4.78 105.19 108.75 3h0p n GLY 51 Ca -0.09 -0.65 -0.29 0.00 0.00 0.00 0.00 46.02 44.99 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 0.49 0.34 1.61 0.04 -1.26 -4.82 135.00 131.40 3h0p s PRO 52 Ca 0.00 0.60 0.08 0.00 0.04 0.00 0.00 61.00 61.73 3h0p s PRO 52 Cb 0.00 -1.74 0.79 0.00 0.04 0.00 0.00 34.50 33.60 3h0p s PRO 52 CO 0.00 -2.71 1.83 0.00 0.04 0.00 0.00 177.00 176.16 3h0p h ALA 53 N -1.88 1.79 -0.71 8.56 0.00 -1.94 -0.67 119.26 124.42 3h0p h ALA 53 Ca -0.54 0.04 0.08 0.00 0.00 0.00 0.00 54.91 54.49 3h0p h ALA 53 Cb 1.32 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 3h0p h ALA 53 CO 0.56 -0.09 0.47 0.93 0.00 0.00 0.00 179.25 181.12 3h0p h GLU 54 N 0.72 0.63 0.08 0.00 3.07 -1.98 0.16 114.58 117.27 3h0p h GLU 54 Ca 0.51 -0.04 -0.12 0.00 -0.50 0.00 0.00 59.36 59.21 3h0p h GLU 54 Cb 0.82 -0.14 0.01 0.00 -0.84 0.00 0.00 28.75 28.60 3h0p h GLU 54 CO -0.27 0.42 -0.51 0.93 -1.40 0.00 0.00 179.01 178.18 3h0p h GLU 55 N 0.65 0.20 -0.34 2.33 4.39 -1.48 -3.20 114.58 117.12 3h0p h GLU 55 Ca 0.32 -0.32 0.05 0.00 0.34 0.00 0.00 59.36 59.75 3h0p h GLU 55 Cb 0.40 0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 3h0p h GLU 55 CO -0.11 1.14 0.23 1.25 -1.16 0.00 0.00 179.01 180.36 3h0p h LEU 56 N -0.57 0.20 -0.04 1.33 5.85 -1.15 -1.85 115.31 119.08 3h0p h LEU 56 Ca -0.09 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.63 3h0p h LEU 56 Cb 1.38 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.36 3h0p h LEU 56 CO 0.10 0.13 0.00 0.59 -0.34 0.00 0.00 178.44 178.92 3h0p n ASN 57 N -4.48 0.16 -4.66 1.25 3.02 0.55 -3.26 115.26 107.84 3h0p n ASN 57 Ca 0.04 0.52 -0.42 0.00 -0.03 0.00 0.00 54.58 54.69 3h0p n ASN 57 Cb 0.24 -0.56 -0.03 0.00 -0.61 0.00 0.00 39.78 38.83 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 -3.03 4.17 0.46 3.52 1.02 -0.70 -4.81 119.74 120.37 3h0p s LYS 58 Ca 0.11 2.13 0.24 0.00 0.02 0.00 0.00 55.97 58.47 3h0p s LYS 58 Cb 0.15 -3.97 1.26 0.00 -0.52 0.00 0.00 37.83 34.75 3h0p s LYS 58 CO 0.47 -0.85 1.84 0.00 -0.92 0.00 0.00 175.35 175.89 3h0p h THR 59 N 5.59 0.57 0.00 2.17 1.03 -1.88 0.34 112.91 120.73 3h0p h THR 59 Ca -0.38 -0.08 0.00 0.00 -0.01 0.00 0.00 66.41 65.94 3h0p h THR 59 Cb 1.17 0.32 0.00 0.00 -1.07 0.00 0.00 68.15 68.57 3h0p h THR 59 CO 0.96 0.04 0.00 -2.67 -0.01 0.00 0.00 175.52 173.84 3h0p n TRP 60 N -4.43 0.00 -0.05 0.00 2.14 -1.26 -1.87 117.44 111.97 3h0p n TRP 60 Ca 0.21 0.00 -0.06 0.00 2.07 0.00 0.00 57.50 59.72 3h0p n TRP 60 Cb 0.88 -0.43 -0.08 0.00 -0.81 0.00 0.00 31.31 30.88 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 -1.43 1.81 -0.21 -2.67 6.02 0.95 -4.49 117.38 117.36 3h0p n GLN 61 Ca 0.08 0.02 -0.08 0.00 -0.01 0.00 0.00 57.00 57.00 3h0p n GLN 61 Cb 0.25 -1.27 0.02 0.00 1.02 0.00 0.00 30.24 30.27 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 0.10 5.09 2.02 -0.69 -2.38 112.91 118.31 3h0p h THR 62 Ca -0.28 -0.91 -0.00 0.00 0.77 0.00 0.00 66.41 65.98 3h0p h THR 62 Cb 1.59 0.73 0.00 0.00 -1.74 0.00 0.00 68.15 68.73 3h0p h THR 62 CO -0.00 0.34 -0.05 1.56 0.37 0.00 0.00 175.52 177.74 3h0p h GLN 63 N 0.84 -0.13 -0.47 6.66 4.20 -1.62 0.15 115.11 124.73 3h0p h GLN 63 Ca 0.18 0.01 -0.04 0.00 0.06 0.00 0.00 58.65 58.86 3h0p h GLN 63 Cb 0.36 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.15 3h0p h GLN 63 CO 0.00 0.07 0.13 -1.00 -0.67 0.00 0.00 178.83 177.36 3h0p h PRO 64 N -0.32 0.70 -0.59 1.46 0.13 -1.78 -0.45 132.00 131.15 3h0p h PRO 64 Ca -0.01 -0.13 0.01 0.00 -0.87 0.00 0.00 66.00 65.00 3h0p h PRO 64 Cb 0.26 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 31.25 3h0p h PRO 64 CO 0.02 0.63 0.39 0.00 -0.23 0.00 0.00 178.00 178.81 3h0p h ALA 65 N 1.45 0.75 -0.16 -0.56 0.00 -0.99 0.60 119.26 120.36 3h0p h ALA 65 Ca 0.16 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 3h0p h ALA 65 Cb 0.24 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3h0p h ALA 65 CO -0.00 0.18 -0.48 -0.07 0.00 0.00 0.00 179.25 178.87 3h0p h LEU 66 N 0.80 0.69 0.08 0.00 3.38 -0.45 -1.39 115.31 118.42 3h0p h LEU 66 Ca 0.22 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.59 3h0p h LEU 66 Cb -0.08 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.46 3h0p h LEU 66 CO -0.05 1.17 -0.06 0.25 0.09 0.00 0.00 178.44 179.84 3h0p h LEU 67 N 0.25 -0.15 -0.51 1.67 5.85 -0.99 -1.75 115.31 119.69 3h0p h LEU 67 Ca -0.02 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.73 3h0p h LEU 67 Cb 1.10 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 42.15 3h0p h LEU 67 CO 0.10 -0.09 0.32 0.74 -0.34 0.00 0.00 178.44 179.16 3h0p h THR 68 N -0.14 1.08 -0.74 1.05 2.02 -0.87 -0.62 112.91 114.69 3h0p h THR 68 Ca -0.00 -0.22 0.05 0.00 0.77 0.00 0.00 66.41 67.02 3h0p h THR 68 Cb 0.13 0.39 -0.06 0.00 -1.74 0.00 0.00 68.15 66.87 3h0p h THR 68 CO -0.01 0.12 0.44 0.00 0.37 0.00 0.00 175.52 176.44 3h0p h ALA 69 N 1.21 1.00 -0.30 6.16 0.00 -1.12 0.81 119.26 127.03 3h0p h ALA 69 Ca 0.20 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.99 3h0p h ALA 69 Cb -0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3h0p h ALA 69 CO -0.07 0.16 -0.28 0.77 0.00 0.00 0.00 179.25 179.83 3h0p h SER 70 N 0.82 0.77 -0.69 0.00 0.02 -0.65 -2.23 113.55 111.59 3h0p h SER 70 Ca 0.32 -0.46 -0.05 0.00 -0.84 0.00 0.00 61.79 60.76 3h0p h SER 70 Cb 0.15 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 3h0p h SER 70 CO -0.17 1.07 0.26 0.58 -1.14 0.00 0.00 176.83 177.43 3h0p h VAL 71 N 0.48 1.25 -0.23 2.27 2.07 -0.86 -1.52 116.25 119.70 3h0p h VAL 71 Ca 0.05 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 66.77 3h0p h VAL 71 Cb 0.85 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 31.03 3h0p h VAL 71 CO 0.07 0.32 0.12 0.00 0.02 0.00 0.00 177.57 178.11 3h0p h ALA 72 N 1.24 0.28 -0.51 1.67 0.00 -0.65 -0.26 119.26 121.04 3h0p h ALA 72 Ca 0.23 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 3h0p h ALA 72 Cb 0.24 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3h0p h ALA 72 CO -0.02 -0.28 0.17 -0.07 0.00 0.00 0.00 179.25 179.06 3h0p h LEU 73 N 0.26 0.69 -0.43 0.00 3.38 -1.18 -0.10 115.31 117.92 3h0p h LEU 73 Ca 0.09 -0.09 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3h0p h LEU 73 Cb 0.01 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3h0p h LEU 73 CO -0.05 0.64 0.22 -0.25 0.09 0.00 0.00 178.44 179.09 3h0p h TRP 74 N 0.74 0.61 -0.47 1.13 2.91 -0.76 0.18 115.95 120.28 3h0p h TRP 74 Ca 0.17 -0.02 -0.08 0.00 1.13 0.00 0.00 58.89 60.09 3h0p h TRP 74 Cb 0.20 -0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 28.63 3h0p h TRP 74 CO 0.01 0.48 -0.02 0.00 -1.03 0.00 0.00 178.44 177.88 3h0p h ARG 75 N 0.56 0.80 -0.32 2.65 3.08 -0.50 -1.58 114.38 119.07 3h0p h ARG 75 Ca 0.15 -0.23 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 3h0p h ARG 75 Cb 0.09 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 3h0p h ARG 75 CO -0.02 0.82 0.12 0.28 -1.07 0.00 0.00 179.97 180.10 3h0p h VAL 76 N 0.74 1.19 -0.33 2.04 2.07 -0.65 -0.98 116.25 120.34 3h0p h VAL 76 Ca 0.14 -0.59 0.05 0.00 0.82 0.00 0.00 66.70 67.12 3h0p h VAL 76 Cb 0.48 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 31.19 3h0p h VAL 76 CO 0.02 0.20 0.04 -0.25 0.02 0.00 0.00 177.57 177.61 3h0p h TRP 77 N 0.36 0.06 -0.71 1.57 2.91 -0.63 -2.01 115.95 117.50 3h0p h TRP 77 Ca 0.11 0.02 -0.05 0.00 1.13 0.00 0.00 58.89 60.10 3h0p h TRP 77 Cb 0.20 0.02 -0.03 0.00 -0.51 0.00 0.00 29.16 28.84 3h0p h TRP 77 CO -0.00 -0.01 0.25 1.96 -1.03 0.00 0.00 178.44 179.61 3h0p h GLN 78 N 0.15 1.09 -0.73 2.65 4.20 -1.21 0.82 115.11 122.08 3h0p h GLN 78 Ca 0.16 -0.22 0.03 0.00 0.06 0.00 0.00 58.65 58.67 3h0p h GLN 78 Cb 0.19 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 27.76 3h0p h GLN 78 CO -0.23 0.92 0.48 0.37 -0.67 0.00 0.00 178.83 179.71 3h0p h GLN 79 N 1.04 0.89 -0.10 1.46 4.15 -0.62 -2.14 115.11 119.80 3h0p h GLN 79 Ca 0.23 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.60 3h0p h GLN 79 Cb 0.26 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 27.75 3h0p h GLN 79 CO -0.01 0.59 0.00 1.04 -1.93 0.00 0.00 178.83 178.52 3h0p n GLN 80 N -4.45 1.49 -0.36 1.69 1.13 -0.81 -4.91 117.38 111.17 3h0p n GLN 80 Ca 0.09 -0.74 0.00 0.00 -1.94 0.00 0.00 57.00 54.41 3h0p n GLN 80 Cb 0.10 -1.38 0.00 0.00 0.11 0.00 0.00 30.24 29.07 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 1.04 0.76 3.67 1.08 0.00 -0.80 -5.02 105.19 105.91 3h0p n GLY 81 Ca 0.16 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.73 3h0p n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3h0p n GLY 82 N -2.21 0.69 0.00 -0.02 0.00 0.26 -4.99 105.19 98.93 3h0p n GLY 82 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.50 3h0p n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3h0p n LYS 83 N 1.84 0.00 -4.40 1.61 5.02 -1.26 -4.57 118.16 116.40 3h0p n LYS 83 Ca 0.11 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.15 3h0p n LYS 83 Cb 0.32 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.23 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 1.81 0.41 1.97 0.04 -1.26 -5.03 135.00 132.94 3h0p s PRO 85 Ca 0.00 -1.58 0.21 0.00 0.04 0.00 0.00 61.00 59.68 3h0p s PRO 85 Cb 0.00 -1.91 0.83 0.00 0.04 0.00 0.00 34.50 33.45 3h0p s PRO 85 CO 0.00 0.37 1.79 0.00 0.04 0.00 0.00 177.00 179.20 3h0p h ALA 86 N 2.52 1.03 -2.28 8.56 0.00 -1.51 -3.47 119.26 124.11 3h0p h ALA 86 Ca -0.43 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.21 3h0p h ALA 86 Cb 1.24 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3h0p h ALA 86 CO 0.56 0.36 0.00 -0.11 0.00 0.00 0.00 179.25 180.07 3h0p n LEU 87 N -3.48 0.00 0.00 0.00 7.94 -1.26 -4.52 117.00 115.68 3h0p n LEU 87 Ca -0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3h0p n LEU 87 Cb 0.46 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.41 3h0p n LEU 87 CO 0.35 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.63 3h0p n ALA 89 N -3.00 0.00 -2.56 1.96 0.00 -0.61 -1.88 120.51 114.42 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 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 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 0.35 -0.48 0.00 0.00 -1.26 -0.58 107.32 105.35 3h0p s GLY 90 Ca 0.00 -0.88 -0.14 0.00 0.00 0.00 0.00 44.72 43.70 3h0p s GLY 90 CO 0.00 -0.97 0.40 -1.58 0.00 0.00 0.00 173.10 170.95 3h0p s HIS 91 N -2.61 3.28 0.00 1.90 2.46 0.01 -4.21 115.29 116.12 3h0p s HIS 91 Ca -0.05 -1.20 0.00 0.00 0.47 0.00 0.00 55.06 54.28 3h0p s HIS 91 Cb -0.02 -3.34 0.00 0.00 -0.13 0.00 0.00 32.58 29.10 3h0p s HIS 91 CO -0.05 -0.88 0.00 0.45 -2.47 0.00 0.00 174.74 171.78 3h0p n SER 92 N 5.15 0.00 -0.24 9.88 2.88 -1.26 -1.13 113.62 128.90 3h0p n SER 92 Ca -0.12 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.56 3h0p n SER 92 Cb 0.42 0.00 0.43 0.00 -0.75 0.00 0.00 64.21 64.31 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 0.56 -2.08 2.46 7.12 -1.92 -1.58 115.31 119.87 3h0p h LEU 93 Ca 0.00 0.04 0.09 0.00 0.13 0.00 0.00 57.88 58.14 3h0p h LEU 93 Cb 0.00 -0.07 -0.01 0.00 -0.53 0.00 0.00 40.66 40.05 3h0p h LEU 93 CO 0.00 0.27 0.27 1.23 -0.13 0.00 0.00 178.44 180.08 3h0p h GLY 94 N 0.58 0.00 1.57 3.75 0.00 -1.21 -0.59 103.07 107.18 3h0p h GLY 94 Ca 0.44 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.74 3h0p h GLY 94 CO -0.19 0.00 0.11 0.83 0.00 0.00 0.00 176.54 177.29 3h0p h GLU 95 N 0.00 0.55 -0.56 4.80 5.08 -1.45 -1.16 114.58 121.84 3h0p h GLU 95 Ca 0.15 -0.08 -0.11 0.00 -1.00 0.00 0.00 59.36 58.32 3h0p h GLU 95 Cb 0.70 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 3h0p h GLU 95 CO -0.00 0.50 -0.07 1.88 -1.00 0.00 0.00 179.01 180.31 3h0p h TYR 96 N 0.54 1.14 -0.15 4.33 0.05 -1.25 -1.14 116.97 120.49 3h0p h TYR 96 Ca 0.13 -0.22 0.01 0.00 0.05 0.00 0.00 58.73 58.69 3h0p h TYR 96 Cb 0.19 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 37.63 3h0p h TYR 96 CO 0.01 1.04 0.08 0.77 -1.05 0.00 0.00 178.16 179.01 3h0p h SER 97 N 0.91 0.14 -0.69 3.88 0.02 -1.34 -0.82 113.55 115.64 3h0p h SER 97 Ca 0.15 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 61.13 3h0p h SER 97 Cb 0.64 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 63.11 3h0p h SER 97 CO 0.04 0.10 0.43 0.00 -1.14 0.00 0.00 176.83 176.26 3h0p h ALA 98 N 1.07 0.90 -0.19 3.77 0.00 -1.12 0.08 119.26 123.76 3h0p h ALA 98 Ca 0.06 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 3h0p h ALA 98 Cb -0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3h0p h ALA 98 CO -0.03 0.19 -0.16 -0.07 0.00 0.00 0.00 179.25 179.18 3h0p h LEU 99 N 0.83 0.30 -0.14 0.00 3.38 -0.59 0.78 115.31 119.88 3h0p h LEU 99 Ca 0.28 -0.07 -0.11 0.00 0.09 0.00 0.00 57.88 58.07 3h0p h LEU 99 Cb 0.03 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3h0p h LEU 99 CO -0.11 0.49 -0.33 0.58 0.09 0.00 0.00 178.44 179.16 3h0p h VAL 100 N 0.29 1.37 -0.31 1.22 2.07 -0.37 0.87 116.25 121.39 3h0p h VAL 100 Ca 0.05 -1.62 -0.07 0.00 0.82 0.00 0.00 66.70 65.89 3h0p h VAL 100 Cb 0.47 2.05 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 3h0p h VAL 100 CO 0.03 0.48 -0.11 0.00 0.02 0.00 0.00 177.57 177.99 3h0p n ALA 102 N -2.48 2.59 -1.04 0.00 0.00 0.24 -4.92 120.51 114.89 3h0p n ALA 102 Ca 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 53.44 53.27 3h0p n ALA 102 Cb 0.32 -1.25 -0.01 0.00 0.00 0.00 0.00 19.45 18.51 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 0.81 0.52 0.13 0.00 0.00 -0.78 -0.47 105.19 105.39 3h0p n GLY 103 Ca 0.13 -0.37 -0.22 0.00 0.00 0.00 0.00 46.02 45.56 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 1.38 -4.25 1.61 2.07 -1.03 -3.42 116.25 112.61 3h0p h VAL 104 Ca -0.03 -2.59 -0.69 0.00 0.82 0.00 0.00 66.70 64.21 3h0p h VAL 104 Cb 0.20 3.10 -0.30 0.00 -1.52 0.00 0.00 31.29 32.77 3h0p h VAL 104 CO 0.05 0.76 -0.88 -0.63 0.02 0.00 0.00 177.57 176.89 3h0p s ILE 105 N -2.50 2.16 0.33 4.57 1.01 -1.14 -0.61 121.20 125.02 3h0p s ILE 105 Ca -0.12 -1.05 -0.29 0.00 0.00 0.00 0.00 60.65 59.19 3h0p s ILE 105 Cb 0.02 -1.77 -0.11 0.00 0.01 0.00 0.00 42.46 40.61 3h0p s ILE 105 CO 0.87 0.58 1.49 0.21 0.00 0.00 0.00 174.94 178.09 3h0p s ASN 106 N -0.38 6.45 0.11 3.58 3.84 -1.26 -4.36 114.94 122.91 3h0p s ASN 106 Ca 0.03 2.92 -0.25 0.00 0.21 0.00 0.00 52.86 55.78 3h0p s ASN 106 Cb -0.12 -2.65 -0.07 0.00 -0.55 0.00 0.00 41.25 37.86 3h0p s ASN 106 CO 0.02 -0.82 1.67 0.15 -2.79 0.00 0.00 177.10 175.32 3h0p h PHE 107 N 3.95 -0.46 -0.88 0.43 3.57 -1.99 0.15 116.94 121.72 3h0p h PHE 107 Ca -0.49 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.01 3h0p h PHE 107 Cb 1.23 0.20 -0.04 0.00 2.79 0.00 0.00 35.95 40.13 3h0p h PHE 107 CO 0.56 -0.26 0.50 0.00 -2.23 0.00 0.00 178.31 176.89 3h0p h ALA 108 N 0.58 1.23 -0.38 2.41 0.00 -1.93 0.05 119.26 121.23 3h0p h ALA 108 Ca 0.04 -0.11 0.04 0.00 0.00 0.00 0.00 54.91 54.88 3h0p h ALA 108 Cb 0.36 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 3h0p h ALA 108 CO -0.14 0.64 0.15 -0.44 0.00 0.00 0.00 179.25 179.46 3h0p h ASP 109 N 1.22 0.20 -0.84 0.00 3.32 -1.81 -1.69 116.42 116.82 3h0p h ASP 109 Ca 0.31 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.36 3h0p h ASP 109 Cb -0.01 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 3h0p h ASP 109 CO -0.05 0.15 0.39 0.00 -1.72 0.00 0.00 179.24 178.01 3h0p h ALA 110 N 1.22 1.09 -0.31 3.45 0.00 0.27 0.28 119.26 125.27 3h0p h ALA 110 Ca 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3h0p h ALA 110 Cb 0.12 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 3h0p h ALA 110 CO -0.15 0.67 0.16 0.28 0.00 0.00 0.00 179.25 180.21 3h0p h VAL 111 N 1.21 1.14 -0.50 0.00 2.07 -0.75 0.03 116.25 119.45 3h0p h VAL 111 Ca 0.29 -0.38 -0.11 0.00 0.82 0.00 0.00 66.70 67.32 3h0p h VAL 111 Cb 0.14 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 30.72 3h0p h VAL 111 CO -0.03 0.14 -0.13 0.03 0.02 0.00 0.00 177.57 177.60 3h0p h ARG 112 N 0.37 0.94 0.31 1.57 3.08 -0.88 -2.83 114.38 116.94 3h0p h ARG 112 Ca 0.11 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.80 3h0p h ARG 112 Cb 0.08 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 3h0p h ARG 112 CO -0.02 1.01 -0.20 -0.07 -1.07 0.00 0.00 179.97 179.63 3h0p h LEU 113 N 0.84 -0.50 -1.44 3.04 3.38 -0.07 -3.03 115.31 117.54 3h0p h LEU 113 Ca 0.13 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 3h0p h LEU 113 Cb 0.67 0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 3h0p h LEU 113 CO 0.05 -0.31 -0.19 -0.37 0.09 0.00 0.00 178.44 177.71 3h0p h VAL 114 N -0.49 0.56 0.00 1.22 -1.51 -1.04 -0.05 116.25 114.95 3h0p h VAL 114 Ca -0.03 -0.89 0.00 0.00 -1.23 0.00 0.00 66.70 64.55 3h0p h VAL 114 Cb 0.41 1.60 0.00 0.00 -2.13 0.00 0.00 31.29 31.17 3h0p h VAL 114 CO 0.02 0.18 0.00 1.21 -1.23 0.00 0.00 177.57 177.76 3h0p n GLU 115 N -3.48 0.31 0.00 5.19 2.13 -1.07 -1.64 120.64 122.07 3h0p n GLU 115 Ca -0.01 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.81 3h0p n GLU 115 Cb 0.35 -1.17 0.00 0.00 0.27 0.00 0.00 31.44 30.90 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 0.38 0.00 -0.17 5.31 0.63 -0.03 -1.86 116.66 120.93 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 0.08 0.00 0.01 0.00 0.45 0.00 0.00 32.46 33.00 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 0.78 0.99 5.14 0.00 -1.57 -3.05 103.07 105.36 3h0p h GLY 118 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 46.90 3h0p h GLY 118 CO 0.00 0.40 0.22 0.50 0.00 0.00 0.00 176.54 177.66 3h0p h LYS 119 N 0.64 0.46 -0.90 4.80 1.57 -1.64 -1.44 116.57 120.06 3h0p h LYS 119 Ca 0.16 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3h0p h LYS 119 Cb 0.20 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.41 3h0p h LYS 119 CO -0.01 0.33 0.00 1.19 -0.57 0.00 0.00 179.45 180.39 3h0p n PHE 120 N -4.83 0.00 0.00 -1.35 3.72 -1.15 -2.41 117.46 111.44 3h0p n PHE 120 Ca -0.01 -0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 3h0p n PHE 120 Cb 0.04 -0.05 0.00 0.00 -0.94 0.00 0.00 39.48 38.53 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 0.68 0.00 -0.18 -1.08 -0.06 -0.54 -1.77 117.38 114.42 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 0.03 0.00 0.21 0.00 -4.06 0.00 0.00 30.24 26.42 3h0p n GLN 122 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 3h0p n GLU 123 N 0.00 2.51 0.12 3.69 1.02 -1.01 -4.50 120.64 122.46 3h0p n GLU 123 Ca 0.00 -2.29 -0.13 0.00 -0.02 0.00 0.00 57.16 54.73 3h0p n GLU 123 Cb 0.00 -1.51 -0.06 0.00 -0.02 0.00 0.00 31.44 29.84 3h0p n GLU 123 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3h0p h ALA 124 N 4.50 -0.28 -2.76 0.62 0.00 -1.64 -3.44 119.26 116.26 3h0p h ALA 124 Ca 0.00 -0.04 -0.55 0.00 0.00 0.00 0.00 54.91 54.32 3h0p h ALA 124 Cb 0.99 0.20 -0.17 0.00 0.00 0.00 0.00 17.79 18.82 3h0p h ALA 124 CO 0.00 -0.68 -0.78 0.14 0.00 0.00 0.00 179.25 177.93 3h0p s VAL 125 N -6.13 2.00 0.54 0.00 -7.23 -1.26 -4.94 120.40 103.37 3h0p s VAL 125 Ca -0.15 -2.05 -0.20 0.00 -1.81 0.00 0.00 61.98 57.77 3h0p s VAL 125 Cb 0.07 -1.99 -0.07 0.00 0.56 0.00 0.00 36.38 34.94 3h0p s VAL 125 CO 0.65 -0.33 0.93 -2.65 -0.31 0.00 0.00 175.10 173.39 3h0p n PRO 126 N 0.06 1.02 -1.64 4.82 -0.02 -1.26 -4.84 135.00 133.15 3h0p n PRO 126 Ca -0.11 0.38 -0.47 0.00 -2.02 0.00 0.00 63.50 61.29 3h0p n PRO 126 Cb 0.58 -2.08 -0.03 0.00 -0.02 0.00 0.00 33.50 31.95 3h0p n PRO 126 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3h0p n GLU 127 N -0.49 1.73 -1.06 -0.52 2.13 -1.26 -2.46 120.64 118.70 3h0p n GLU 127 Ca 0.12 0.62 -0.02 0.00 0.66 0.00 0.00 57.16 58.53 3h0p n GLU 127 Cb 0.45 -2.24 -0.01 0.00 0.27 0.00 0.00 31.44 29.91 3h0p n GLU 127 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3h0p n GLY 128 N 2.30 0.53 0.00 8.31 0.00 -1.26 -4.90 105.19 110.17 3h0p n GLY 128 Ca 0.14 -0.30 0.09 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.77 0.00 -4.08 2.61 -2.24 -1.03 -4.89 114.28 101.87 3h0p n THR 129 Ca -0.02 -0.07 -0.25 0.00 -2.27 0.00 0.00 64.05 61.44 3h0p n THR 129 Cb 0.15 0.94 -0.06 0.00 -2.10 0.00 0.00 70.33 69.26 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 -2.94 2.36 0.00 3.38 0.00 -1.26 -0.59 107.32 108.27 3h0p s GLY 130 Ca 0.06 -1.89 0.00 0.00 0.00 0.00 0.00 44.72 42.89 3h0p s GLY 130 CO 0.80 -1.91 0.00 0.61 0.00 0.00 0.00 173.10 172.60 3h0p n GLY 131 N -1.33 2.13 0.00 0.20 0.00 -0.31 -4.30 105.19 101.57 3h0p n GLY 131 Ca -0.02 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.27 3h0p n GLY 131 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3h0p n SER 133 N -0.07 0.00 -4.61 1.61 7.64 -0.14 -1.96 113.62 116.09 3h0p n SER 133 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 3h0p n SER 133 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 3h0p n SER 133 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3h0p s ALA 134 N -0.70 3.55 -0.23 -0.43 0.00 0.54 0.19 121.76 124.69 3h0p s ALA 134 Ca 0.00 -0.53 -0.15 0.00 0.00 0.00 0.00 51.96 51.28 3h0p s ALA 134 Cb 0.00 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 19.93 3h0p s ALA 134 CO 0.00 -1.06 0.38 0.42 0.00 0.00 0.00 175.76 175.50 3h0p s ILE 135 N 2.71 5.19 -0.09 0.00 -1.09 0.12 -1.02 121.20 127.01 3h0p s ILE 135 Ca 0.28 0.64 0.01 0.00 -2.23 0.00 0.00 60.65 59.35 3h0p s ILE 135 Cb -0.15 -3.71 -0.02 0.00 -1.58 0.00 0.00 42.46 37.00 3h0p s ILE 135 CO 0.11 0.22 -0.11 -0.63 -1.23 0.00 0.00 174.94 173.30 3h0p s ILE 136 N 1.58 3.27 -0.58 2.92 -1.09 -0.22 -1.89 121.20 125.19 3h0p s ILE 136 Ca 0.17 -0.62 -0.03 0.00 -2.23 0.00 0.00 60.65 57.94 3h0p s ILE 136 Cb -0.15 -2.34 0.00 0.00 -1.58 0.00 0.00 42.46 38.39 3h0p s ILE 136 CO 0.08 0.56 0.45 0.61 -1.23 0.00 0.00 174.94 175.41 3h0p n GLY 137 N 2.83 0.30 3.03 6.18 0.00 -0.21 -0.66 105.19 116.66 3h0p n GLY 137 Ca -0.18 -0.31 -0.13 0.00 0.00 0.00 0.00 46.02 45.41 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 -3.52 0.68 0.72 0.99 2.96 -1.26 -4.15 118.68 115.10 3h0p s LEU 138 Ca 0.22 0.44 -0.16 0.00 -0.22 0.00 0.00 54.13 54.42 3h0p s LEU 138 Cb -0.10 0.63 0.03 0.00 0.50 0.00 0.00 46.19 47.25 3h0p s LEU 138 CO 0.28 -0.14 1.20 -0.90 -1.32 0.00 0.00 176.35 175.47 3h0p n ASP 139 N 3.92 1.39 -0.33 3.68 5.75 -1.26 -4.47 116.55 125.22 3h0p n ASP 139 Ca -0.23 0.71 0.11 0.00 -0.01 0.00 0.00 54.79 55.37 3h0p n ASP 139 Cb 0.54 -1.51 0.31 0.00 -1.03 0.00 0.00 41.12 39.43 3h0p n ASP 139 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 3h0p h ASP 140 N -0.17 0.80 0.17 -1.12 3.32 -1.99 -2.20 116.42 115.23 3h0p h ASP 140 Ca -0.48 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.62 3h0p h ASP 140 Cb 1.32 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.78 3h0p h ASP 140 CO 0.49 0.37 -0.08 0.00 -1.72 0.00 0.00 179.24 178.30 3h0p h ALA 141 N 1.59 -0.23 -0.92 3.45 0.00 -1.99 -0.96 119.26 120.19 3h0p h ALA 141 Ca 0.51 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.35 3h0p h ALA 141 Cb 0.70 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 3h0p h ALA 141 CO -0.28 -0.58 0.61 0.77 0.00 0.00 0.00 179.25 179.77 3h0p h SER 142 N -0.33 1.05 -0.31 0.00 0.02 -1.83 -0.78 113.55 111.37 3h0p h SER 142 Ca -0.02 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.88 3h0p h SER 142 Cb 0.26 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.53 3h0p h SER 142 CO 0.04 0.75 0.12 0.40 -1.14 0.00 0.00 176.83 176.99 3h0p h ILE 143 N 1.23 1.19 -0.74 3.27 2.04 -1.27 0.74 117.51 123.96 3h0p h ILE 143 Ca 0.35 -0.58 0.03 0.00 1.00 0.00 0.00 64.86 65.65 3h0p h ILE 143 Cb -0.11 0.99 -0.04 0.00 -0.74 0.00 0.00 36.82 36.92 3h0p h ILE 143 CO -0.09 0.20 0.47 0.00 0.00 0.00 0.00 178.15 178.74 3h0p h ALA 144 N 0.96 0.96 -0.44 1.87 0.00 -0.84 -0.50 119.26 121.26 3h0p h ALA 144 Ca 0.10 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 3h0p h ALA 144 Cb 0.20 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3h0p h ALA 144 CO -0.01 0.28 0.15 -0.22 0.00 0.00 0.00 179.25 179.45 3h0p h LYS 145 N 0.93 0.67 -0.58 0.00 3.64 -0.82 -1.56 116.57 118.85 3h0p h LYS 145 Ca 0.29 -0.13 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 3h0p h LYS 145 Cb -0.01 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 31.68 3h0p h LYS 145 CO -0.10 0.64 0.25 0.00 -2.27 0.00 0.00 179.45 177.96 3h0p h ALA 146 N 1.00 1.35 -0.40 5.00 0.00 -0.41 -1.54 119.26 124.26 3h0p h ALA 146 Ca 0.14 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3h0p h ALA 146 Cb 0.23 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3h0p h ALA 146 CO -0.01 0.50 -0.07 0.00 0.00 0.00 0.00 179.25 179.67 3h0p h GLU 148 N 0.56 0.78 0.00 0.00 5.08 -0.99 -0.97 114.58 119.04 3h0p h GLU 148 Ca 0.10 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 3h0p h GLU 148 Cb 0.58 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.69 3h0p h GLU 148 CO 0.03 0.67 -0.20 0.93 -1.00 0.00 0.00 179.01 179.45 3h0p h GLU 149 N 0.72 0.00 0.00 2.33 5.08 -1.23 -3.19 114.58 118.28 3h0p h GLU 149 Ca 0.18 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 3h0p h GLU 149 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3h0p h GLU 149 CO -0.02 0.20 -1.26 0.43 -1.00 0.00 0.00 179.01 177.35 3h0p n SER 150 N -3.80 0.59 0.03 1.42 7.64 -0.77 -4.57 113.62 114.17 3h0p n SER 150 Ca -0.02 -0.45 -0.11 0.00 1.01 0.00 0.00 58.87 59.31 3h0p n SER 150 Cb 0.30 1.18 -0.05 0.00 -1.01 0.00 0.00 64.21 64.62 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 2.58 -0.03 -6.52 -0.43 0.00 -1.18 -3.44 119.26 110.24 3h0p h ALA 151 Ca 0.00 0.02 -0.51 0.00 0.00 0.00 0.00 54.91 54.41 3h0p h ALA 151 Cb 0.71 0.10 -0.11 0.00 0.00 0.00 0.00 17.79 18.49 3h0p h ALA 151 CO 0.00 -0.54 -0.82 0.39 0.00 0.00 0.00 179.25 178.29 3h0p n GLU 152 N -5.17 -4.08 0.00 0.00 1.02 -1.26 -0.99 120.64 110.16 3h0p n GLU 152 Ca -0.06 0.47 0.00 0.00 -0.02 0.00 0.00 57.16 57.55 3h0p n GLU 152 Cb 0.10 -5.14 0.00 0.00 -0.02 0.00 0.00 31.44 26.38 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 -1.61 2.55 3.98 0.62 0.00 -1.26 -5.03 105.19 104.44 3h0p n GLY 153 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 3h0p n GLY 153 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3h0p s GLN 154 N -0.59 1.33 -0.19 1.61 -0.21 -0.17 -5.09 119.66 116.35 3h0p s GLN 154 Ca 0.00 -0.94 -0.12 0.00 0.02 0.00 0.00 55.36 54.33 3h0p s GLN 154 Cb 0.00 -2.19 -0.05 0.00 1.00 0.00 0.00 33.01 31.78 3h0p s GLN 154 CO 0.00 -1.77 0.21 0.08 -2.12 0.00 0.00 175.29 171.70 3h0p s VAL 155 N -3.38 5.35 -0.30 1.09 1.01 -1.26 -4.77 120.40 118.14 3h0p s VAL 155 Ca 0.69 0.35 -0.08 0.00 0.00 0.00 0.00 61.98 62.94 3h0p s VAL 155 Cb -0.05 -3.55 0.15 0.00 0.00 0.00 0.00 36.38 32.93 3h0p s VAL 155 CO 0.47 0.39 0.66 0.54 0.00 0.00 0.00 175.10 177.16 3h0p s VAL 156 N 0.61 -0.96 0.06 2.92 0.11 -1.25 -0.52 120.40 121.36 3h0p s VAL 156 Ca 0.12 0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.11 3h0p s VAL 156 Cb -0.12 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.71 3h0p s VAL 156 CO 0.02 0.00 0.11 -0.44 -3.33 0.00 0.00 175.10 171.46 3h0p s SER 157 N 2.86 0.22 -0.16 3.54 0.01 -0.59 -4.68 113.70 114.90 3h0p s SER 157 Ca 0.01 -0.67 -0.29 0.00 1.31 0.00 0.00 55.95 56.31 3h0p s SER 157 Cb -0.12 0.27 -0.02 0.00 0.21 0.00 0.00 66.02 66.35 3h0p s SER 157 CO -0.19 -0.61 1.41 -2.84 0.41 0.00 0.00 173.24 171.41 3h0p s PRO 158 N -3.36 4.12 -0.06 12.44 0.02 -1.26 -1.21 135.00 145.68 3h0p s PRO 158 Ca 0.01 1.74 0.04 0.00 0.02 0.00 0.00 61.00 62.81 3h0p s PRO 158 Cb 0.03 -3.87 -0.06 0.00 0.02 0.00 0.00 34.50 30.62 3h0p s PRO 158 CO -0.08 -0.88 -0.00 1.33 -0.33 0.00 0.00 177.00 177.04 3h0p n VAL 159 N 5.65 0.40 -4.02 3.83 0.24 0.98 -4.74 118.33 120.67 3h0p n VAL 159 Ca 0.15 -0.22 -0.32 0.00 -2.04 0.00 0.00 64.34 61.91 3h0p n VAL 159 Cb 0.45 -0.82 -0.15 0.00 -1.47 0.00 0.00 33.84 31.85 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 -3.98 4.62 -1.23 -1.34 0.01 -0.78 0.50 114.94 112.74 3h0p s ASN 160 Ca -0.05 -1.58 -0.16 0.00 -0.71 0.00 0.00 52.86 50.37 3h0p s ASN 160 Cb 0.02 -1.60 0.13 0.00 0.41 0.00 0.00 41.25 40.21 3h0p s ASN 160 CO 0.21 -0.26 1.54 -0.36 -1.51 0.00 0.00 177.10 176.73 3h0p s PHE 161 N 1.08 3.22 0.12 2.20 0.08 -0.51 -0.88 117.98 123.28 3h0p s PHE 161 Ca -0.03 -1.92 -0.12 0.00 0.12 0.00 0.00 56.93 54.97 3h0p s PHE 161 Cb -0.20 -4.48 -0.11 0.00 -0.57 0.00 0.00 43.02 37.66 3h0p s PHE 161 CO -0.05 -1.56 1.37 -0.91 -0.10 0.00 0.00 175.22 173.98 3h0p h ASN 162 N 7.37 0.96 -5.17 1.36 2.35 -1.63 0.29 115.58 121.12 3h0p h ASN 162 Ca 0.36 -0.56 0.17 0.00 -0.55 0.00 0.00 56.30 55.72 3h0p h ASN 162 Cb 0.88 -0.28 -0.10 0.00 0.05 0.00 0.00 38.32 38.86 3h0p h ASN 162 CO 1.32 1.35 0.52 -0.94 -1.65 0.00 0.00 177.43 178.03 3h0p s SER 163 N -6.98 -0.22 0.17 5.81 1.04 -0.74 -4.24 113.70 108.55 3h0p s SER 163 Ca -0.11 -0.27 -0.32 0.00 0.48 0.00 0.00 55.95 55.73 3h0p s SER 163 Cb 0.10 0.43 -0.10 0.00 0.10 0.00 0.00 66.02 66.54 3h0p s SER 163 CO 0.89 -0.77 1.58 -2.84 0.98 0.00 0.00 173.24 173.08 3h0p s PRO 164 N -3.17 4.21 0.00 4.02 0.02 -1.26 -1.34 135.00 137.48 3h0p s PRO 164 Ca 0.10 2.38 0.00 0.00 0.02 0.00 0.00 61.00 63.51 3h0p s PRO 164 Cb -0.01 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.37 3h0p s PRO 164 CO -0.01 -0.61 0.00 0.41 -0.33 0.00 0.00 177.00 176.45 3h0p n GLY 165 N 3.71 0.90 2.61 0.52 0.00 -1.26 -4.97 105.19 106.71 3h0p n GLY 165 Ca 0.14 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.60 0.29 -0.07 1.61 -0.21 -0.45 -1.05 119.66 119.18 3h0p s GLN 166 Ca 0.00 -0.51 0.02 0.00 0.02 0.00 0.00 55.36 54.88 3h0p s GLN 166 Cb 0.00 -0.99 0.02 0.00 1.00 0.00 0.00 33.01 33.03 3h0p s GLN 166 CO 0.00 -1.05 -0.10 0.08 -2.12 0.00 0.00 175.29 172.09 3h0p s VAL 167 N 2.04 1.05 -0.12 1.09 1.01 -0.79 -1.78 120.40 122.90 3h0p s VAL 167 Ca 0.10 -0.40 -0.15 0.00 0.00 0.00 0.00 61.98 61.54 3h0p s VAL 167 Cb -0.16 -0.99 -0.05 0.00 0.00 0.00 0.00 36.38 35.18 3h0p s VAL 167 CO -0.30 0.35 0.35 -0.69 0.00 0.00 0.00 175.10 174.80 3h0p s VAL 168 N 0.92 5.24 0.23 2.92 1.01 -0.06 0.11 120.40 130.77 3h0p s VAL 168 Ca -0.10 0.67 0.07 0.00 0.00 0.00 0.00 61.98 62.62 3h0p s VAL 168 Cb -0.15 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.52 3h0p s VAL 168 CO 0.01 0.43 0.18 0.27 0.00 0.00 0.00 175.10 175.98 3h0p s ILE 169 N 0.09 4.42 0.10 2.22 -4.36 0.13 -0.01 121.20 123.79 3h0p s ILE 169 Ca 0.20 -1.35 -0.17 0.00 -0.26 0.00 0.00 60.65 59.07 3h0p s ILE 169 Cb -0.14 -3.36 0.04 0.00 1.25 0.00 0.00 42.46 40.25 3h0p s ILE 169 CO 0.07 -0.30 0.41 0.00 0.24 0.00 0.00 174.94 175.36 3h0p s ALA 170 N -2.05 -0.97 0.00 2.27 0.00 -0.35 -0.96 121.76 119.69 3h0p s ALA 170 Ca 0.32 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.37 3h0p s ALA 170 Cb -0.08 0.58 0.00 0.00 0.00 0.00 0.00 23.12 23.61 3h0p s ALA 170 CO 0.24 -0.58 0.00 0.41 0.00 0.00 0.00 175.76 175.83 3h0p n GLY 171 N 0.02 -0.05 3.76 0.00 0.00 -0.83 -1.54 105.19 106.56 3h0p n GLY 171 Ca -0.17 -1.10 -0.41 0.00 0.00 0.00 0.00 46.02 44.34 3h0p n GLY 171 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3h0p s HIS 172 N -3.90 2.79 0.21 1.61 3.76 0.32 -1.16 115.29 118.92 3h0p s HIS 172 Ca 0.00 1.09 -0.09 0.00 -0.15 0.00 0.00 55.06 55.91 3h0p s HIS 172 Cb 0.00 -3.94 0.32 0.00 1.11 0.00 0.00 32.58 30.07 3h0p s HIS 172 CO 0.00 -2.88 1.72 -0.22 -0.85 0.00 0.00 174.74 172.51 3h0p h LYS 173 N 3.88 0.32 -0.49 1.40 3.64 -1.03 -0.63 116.57 123.65 3h0p h LYS 173 Ca -0.49 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 58.81 3h0p h LYS 173 Cb 1.23 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 3h0p h LYS 173 CO 0.70 0.21 0.06 0.93 -2.27 0.00 0.00 179.45 179.09 3h0p h GLU 174 N 0.33 0.78 -0.41 1.90 3.07 -1.91 0.02 114.58 118.37 3h0p h GLU 174 Ca 0.33 -0.18 -0.11 0.00 -0.50 0.00 0.00 59.36 58.90 3h0p h GLU 174 Cb 0.47 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.26 3h0p h GLU 174 CO -0.38 0.75 -0.19 0.00 -1.40 0.00 0.00 179.01 177.80 3h0p h ALA 175 N 1.32 0.90 -0.46 3.43 0.00 -1.59 -1.18 119.26 121.70 3h0p h ALA 175 Ca 0.16 -0.36 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 3h0p h ALA 175 Cb 0.36 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3h0p h ALA 175 CO 0.01 0.63 -0.21 0.28 0.00 0.00 0.00 179.25 179.96 3h0p h VAL 176 N 0.70 1.27 -0.39 0.00 2.07 -0.46 0.14 116.25 119.57 3h0p h VAL 176 Ca 0.10 -1.35 -0.06 0.00 0.82 0.00 0.00 66.70 66.21 3h0p h VAL 176 Cb 0.69 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 3h0p h VAL 176 CO 0.05 0.46 0.02 -0.33 0.02 0.00 0.00 177.57 177.79 3h0p h GLU 177 N 0.80 0.68 -0.23 1.57 4.39 -0.88 -0.08 114.58 120.82 3h0p h GLU 177 Ca 0.11 -0.21 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 3h0p h GLU 177 Cb 0.76 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.33 3h0p h GLU 177 CO 0.06 0.77 0.11 0.00 -1.16 0.00 0.00 179.01 178.79 3h0p h ARG 178 N 0.51 0.34 -0.75 2.33 3.08 -1.08 -2.74 114.38 116.08 3h0p h ARG 178 Ca 0.11 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 3h0p h ARG 178 Cb 0.45 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.40 3h0p h ARG 178 CO 0.02 0.36 0.36 0.00 -1.07 0.00 0.00 179.97 179.63 3h0p h ALA 179 N 0.97 1.22 -0.43 0.04 0.00 -0.58 -1.10 119.26 119.38 3h0p h ALA 179 Ca 0.08 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 3h0p h ALA 179 Cb 0.13 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3h0p h ALA 179 CO -0.01 0.59 0.26 0.78 0.00 0.00 0.00 179.25 180.87 3h0p h GLY 180 N 1.10 0.63 1.06 0.00 0.00 -0.98 0.11 103.07 104.99 3h0p h GLY 180 Ca 0.26 -0.26 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 3h0p h GLY 180 CO -0.03 0.25 0.17 0.00 0.00 0.00 0.00 176.54 176.93 3h0p h ALA 181 N 1.12 0.92 -0.56 3.60 0.00 -1.15 -1.18 119.26 122.01 3h0p h ALA 181 Ca 0.15 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.74 3h0p h ALA 181 Cb 0.00 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3h0p h ALA 181 CO -0.03 0.64 0.05 0.00 0.00 0.00 0.00 179.25 179.91 3h0p h ALA 182 N 1.08 0.74 -0.60 0.00 0.00 -0.92 -1.84 119.26 117.72 3h0p h ALA 182 Ca 0.22 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.89 3h0p h ALA 182 Cb 0.38 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 3h0p h ALA 182 CO 0.00 0.53 0.36 0.00 0.00 0.00 0.00 179.25 180.14 3h0p h LYS 184 N 0.70 0.54 0.00 0.00 1.79 -1.01 0.29 116.57 118.88 3h0p h LYS 184 Ca 0.25 -0.04 -0.01 0.00 -2.18 0.00 0.00 60.65 58.66 3h0p h LYS 184 Cb 0.05 -0.12 -0.00 0.00 -1.58 0.00 0.00 32.23 30.58 3h0p h LYS 184 CO -0.11 0.39 -0.06 0.00 -1.08 0.00 0.00 179.45 178.59 3h0p h ALA 185 N 1.12 1.18 -0.01 3.86 0.00 -0.95 -1.22 119.26 123.23 3h0p h ALA 185 Ca 0.15 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.00 3h0p h ALA 185 Cb -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3h0p h ALA 185 CO -0.03 0.08 -0.04 0.00 0.00 0.00 0.00 179.25 179.26 3h0p n ALA 186 N -2.20 2.67 0.00 0.00 0.00 -0.35 -4.91 120.51 115.72 3h0p n ALA 186 Ca -0.02 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.01 3h0p n ALA 186 Cb 0.20 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.46 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 1.19 1.06 3.76 0.00 0.00 -0.46 -5.05 105.19 105.69 3h0p n GLY 187 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 3.57 0.22 4.61 0.00 -0.01 -4.75 121.76 123.40 3h0p s ALA 188 Ca 0.00 1.35 -0.04 0.00 0.00 0.00 0.00 51.96 53.27 3h0p s ALA 188 Cb 0.00 -3.54 0.21 0.00 0.00 0.00 0.00 23.12 19.79 3h0p s ALA 188 CO 0.00 -0.76 1.66 -0.22 0.00 0.00 0.00 175.76 176.44 3h0p h LYS 189 N 3.98 0.81 -2.79 0.00 3.64 -1.05 -3.41 116.57 117.75 3h0p h LYS 189 Ca -0.48 -0.29 0.03 0.00 -1.27 0.00 0.00 60.65 58.64 3h0p h LYS 189 Cb 1.22 -0.06 -0.12 0.00 -0.41 0.00 0.00 32.23 32.87 3h0p h LYS 189 CO 0.70 0.91 0.29 -0.98 -2.27 0.00 0.00 179.45 178.11 3h0p s ARG 190 N -4.74 1.23 -0.19 1.90 1.70 -1.16 -5.01 118.95 112.69 3h0p s ARG 190 Ca -0.10 -0.51 -0.02 0.00 -0.47 0.00 0.00 55.73 54.64 3h0p s ARG 190 Cb 0.13 0.53 0.06 0.00 -0.57 0.00 0.00 34.95 35.10 3h0p s ARG 190 CO 0.83 -0.55 0.01 0.00 -1.08 0.00 0.00 175.30 174.51 3h0p s ALA 191 N -3.60 1.22 -0.29 7.88 0.00 -1.26 -1.06 121.76 124.65 3h0p s ALA 191 Ca 0.04 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.24 3h0p s ALA 191 Cb -0.02 -1.19 0.08 0.00 0.00 0.00 0.00 23.12 21.99 3h0p s ALA 191 CO -0.09 -1.08 -0.04 -0.51 0.00 0.00 0.00 175.76 174.05 3h0p s LEU 192 N 1.75 3.93 0.32 0.00 1.43 -0.19 -4.92 118.68 121.00 3h0p s LEU 192 Ca -0.01 -1.71 -0.29 0.00 -1.03 0.00 0.00 54.13 51.09 3h0p s LEU 192 Cb -0.17 -1.55 -0.12 0.00 0.03 0.00 0.00 46.19 44.38 3h0p s LEU 192 CO -0.07 -0.28 1.47 -2.65 0.23 0.00 0.00 176.35 175.05 3h0p n PRO 193 N 4.37 2.47 -1.75 1.29 -0.02 -1.26 -0.34 135.00 139.77 3h0p n PRO 193 Ca -0.06 0.87 -0.31 0.00 -2.02 0.00 0.00 63.50 61.98 3h0p n PRO 193 Cb 0.42 -2.58 0.04 0.00 -0.02 0.00 0.00 33.50 31.37 3h0p n PRO 193 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3h0p s LEU 194 N -0.95 3.00 0.00 2.45 1.02 -1.26 -4.84 118.68 118.10 3h0p s LEU 194 Ca 0.60 1.37 0.22 0.00 0.02 0.00 0.00 54.13 56.34 3h0p s LEU 194 Cb -0.53 -4.23 1.34 0.00 0.02 0.00 0.00 46.19 42.79 3h0p s LEU 194 CO 0.56 -1.33 1.86 -0.81 0.02 0.00 0.00 176.35 176.65 3h0p n PRO 195 N -3.03 0.99 -2.58 1.29 -0.05 -1.26 -4.86 135.00 125.50 3h0p n PRO 195 Ca 0.07 0.00 -0.30 0.00 -0.05 0.00 0.00 63.50 63.21 3h0p n PRO 195 Cb 0.55 -1.35 -0.02 0.00 -0.05 0.00 0.00 33.50 32.63 3h0p n PRO 195 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 175.50 175.59 3h0p s VAL 196 N -2.00 4.74 -0.91 0.52 -7.23 -1.26 -5.00 120.40 109.26 3h0p s VAL 196 Ca 0.34 0.72 0.12 0.00 -1.81 0.00 0.00 61.98 61.35 3h0p s VAL 196 Cb 0.15 -3.77 -0.05 0.00 0.56 0.00 0.00 36.38 33.27 3h0p s VAL 196 CO 0.26 -0.70 0.63 -1.54 -0.31 0.00 0.00 175.10 173.44 3h0p n SER 197 N -1.73 1.06 -4.67 4.85 3.41 -1.26 -4.87 113.62 110.41 3h0p n SER 197 Ca 0.04 -1.03 -0.36 0.00 -0.26 0.00 0.00 58.87 57.26 3h0p n SER 197 Cb 0.54 0.67 -0.09 0.00 -0.26 0.00 0.00 64.21 65.07 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 -1.75 5.31 -1.30 -3.33 1.01 -1.26 -4.31 120.40 114.77 3h0p s VAL 198 Ca 0.08 0.16 -0.18 0.00 0.00 0.00 0.00 61.98 62.04 3h0p s VAL 198 Cb 0.09 -3.46 0.07 0.00 0.00 0.00 0.00 36.38 33.08 3h0p s VAL 198 CO 0.37 0.37 1.74 -0.81 0.00 0.00 0.00 175.10 176.78 3h0p n PRO 199 N 4.08 3.20 -1.91 2.72 -0.04 -1.26 -4.78 135.00 137.01 3h0p n PRO 199 Ca -0.15 -3.28 -0.34 0.00 -0.04 0.00 0.00 63.50 59.69 3h0p n PRO 199 Cb 0.52 -3.50 0.04 0.00 -0.04 0.00 0.00 33.50 30.52 3h0p n PRO 199 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 3h0p s SER 200 N 4.23 5.21 -1.63 3.54 0.01 -1.26 -4.02 113.70 119.78 3h0p s SER 200 Ca 0.54 2.15 0.00 0.00 1.31 0.00 0.00 55.95 59.95 3h0p s SER 200 Cb 0.04 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.70 3h0p s SER 200 CO 0.08 -1.57 0.00 1.41 0.41 0.00 0.00 173.24 173.57 3h0p n HIS 201 N -1.98 -0.62 -4.39 2.43 8.25 -0.82 -4.82 115.22 113.27 3h0p n HIS 201 Ca 0.12 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.37 3h0p n HIS 201 Cb 0.51 -3.41 -0.09 0.00 1.12 0.00 0.00 29.99 28.12 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 2.07 2.50 0.00 0.00 0.00 -1.90 -3.38 119.26 118.54 3h0p h ALA 203 Ca -0.33 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.55 3h0p h ALA 203 Cb 1.25 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 3h0p h ALA 203 CO 0.52 -0.79 0.30 1.28 0.00 0.00 0.00 179.25 180.56 3h0p n LEU 204 N -4.42 0.97 0.00 0.00 4.77 -1.26 -4.72 117.00 112.35 3h0p n LEU 204 Ca 0.20 -0.93 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 3h0p n LEU 204 Cb 0.84 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.68 3h0p n LEU 204 CO 0.34 -0.06 0.00 1.17 -1.33 0.00 0.00 177.39 177.50 3h0p n LYS 206 N 2.80 0.00 -0.35 3.23 3.00 -1.26 -4.68 118.16 120.89 3h0p n LYS 206 Ca 0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 58.31 58.37 3h0p n LYS 206 Cb 0.16 0.00 0.14 0.00 0.00 0.00 0.00 35.03 35.33 3h0p n LYS 206 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.40 176.05 3h0p h PRO 207 N 0.00 1.25 -0.83 1.64 0.11 -1.93 -1.55 132.00 130.70 3h0p h PRO 207 Ca 0.00 -0.08 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 3h0p h PRO 207 Cb 0.00 -0.28 -0.04 0.00 0.11 0.00 0.00 31.00 30.79 3h0p h PRO 207 CO 0.00 0.83 0.40 0.00 -0.21 0.00 0.00 178.00 179.02 3h0p h ALA 208 N 1.41 1.07 -0.51 -0.75 0.00 -1.85 -2.31 119.26 116.31 3h0p h ALA 208 Ca 0.36 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 3h0p h ALA 208 Cb -0.11 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.34 3h0p h ALA 208 CO -0.09 0.63 -0.01 0.00 0.00 0.00 0.00 179.25 179.78 3h0p h ALA 209 N 1.21 1.02 -0.49 0.00 0.00 -1.77 -0.09 119.26 119.14 3h0p h ALA 209 Ca 0.28 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3h0p h ALA 209 Cb 0.11 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3h0p h ALA 209 CO -0.04 0.61 0.24 -0.44 0.00 0.00 0.00 179.25 179.61 3h0p h ASP 210 N 0.81 0.63 -0.43 0.00 3.32 -0.98 -0.53 116.42 119.24 3h0p h ASP 210 Ca 0.15 -0.13 -0.15 0.00 0.02 0.00 0.00 57.03 56.93 3h0p h ASP 210 Cb 0.49 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 3h0p h ASP 210 CO 0.02 0.58 -0.32 0.11 -1.72 0.00 0.00 179.24 177.92 3h0p h LYS 211 N 0.64 0.97 -0.72 3.56 1.57 -1.15 -3.04 116.57 118.41 3h0p h LYS 211 Ca 0.17 -0.47 -0.01 0.00 -1.87 0.00 0.00 60.65 58.47 3h0p h LYS 211 Cb 0.11 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.39 3h0p h LYS 211 CO -0.02 1.14 0.41 1.25 -0.57 0.00 0.00 179.45 181.66 3h0p h LEU 212 N 0.81 0.88 -1.80 2.94 5.85 -0.85 -2.50 115.31 120.63 3h0p h LEU 212 Ca 0.08 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.73 3h0p h LEU 212 Cb 0.91 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 3h0p h LEU 212 CO 0.08 0.71 0.14 0.00 -0.34 0.00 0.00 178.44 179.04 3h0p h ALA 213 N 1.21 1.87 0.01 1.25 0.00 -0.99 0.31 119.26 122.92 3h0p h ALA 213 Ca 0.25 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 3h0p h ALA 213 Cb 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3h0p h ALA 213 CO -0.04 0.11 -0.01 0.28 0.00 0.00 0.00 179.25 179.59 3h0p h VAL 214 N 0.27 1.23 -0.37 0.00 2.07 -1.35 -2.08 116.25 116.03 3h0p h VAL 214 Ca 0.08 -0.74 -0.10 0.00 0.82 0.00 0.00 66.70 66.76 3h0p h VAL 214 Cb 0.00 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 3h0p h VAL 214 CO -0.02 0.19 -0.20 -0.33 0.02 0.00 0.00 177.57 177.23 3h0p h GLU 215 N -0.33 0.70 -0.20 1.57 4.39 -0.99 -2.74 114.58 116.98 3h0p h GLU 215 Ca -0.00 -0.27 -0.08 0.00 0.34 0.00 0.00 59.36 59.35 3h0p h GLU 215 Cb 0.32 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 3h0p h GLU 215 CO 0.00 0.85 -0.23 -0.07 -1.16 0.00 0.00 179.01 178.40 3h0p h LEU 216 N 0.62 0.36 -2.38 1.33 3.38 -0.45 -2.84 115.31 115.33 3h0p h LEU 216 Ca 0.09 -0.11 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 3h0p h LEU 216 Cb 0.68 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 3h0p h LEU 216 CO 0.05 0.60 -0.03 0.00 0.09 0.00 0.00 178.44 179.15 3h0p h ALA 217 N 1.43 1.20 -0.01 1.53 0.00 -1.05 -2.18 119.26 120.18 3h0p h ALA 217 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3h0p h ALA 217 Cb 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3h0p h ALA 217 CO 0.04 0.04 -0.13 1.63 0.00 0.00 0.00 179.25 180.83 3h0p n LYS 218 N -3.42 1.39 -3.76 0.00 5.02 -1.07 -4.86 118.16 111.46 3h0p n LYS 218 Ca -0.02 -0.89 -0.36 0.00 -2.02 0.00 0.00 58.31 55.01 3h0p n LYS 218 Cb 0.15 -1.48 -0.11 0.00 -0.02 0.00 0.00 35.03 33.57 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 -2.22 4.80 -0.04 -0.18 -1.09 -0.82 -5.05 121.20 116.61 3h0p s ILE 219 Ca 0.31 -0.01 -0.30 0.00 -2.23 0.00 0.00 60.65 58.42 3h0p s ILE 219 Cb 0.20 -3.24 -0.07 0.00 -1.58 0.00 0.00 42.46 37.77 3h0p s ILE 219 CO 0.42 0.34 1.88 -0.89 -1.23 0.00 0.00 174.94 175.46 3h0p s THR 220 N 1.33 3.22 -0.24 2.92 2.01 -1.26 -4.98 115.64 118.63 3h0p s THR 220 Ca 0.06 0.27 -0.08 0.00 0.31 0.00 0.00 61.69 62.24 3h0p s THR 220 Cb -0.15 -3.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.14 3h0p s THR 220 CO 0.05 -0.04 0.10 -0.36 -0.69 0.00 0.00 174.62 173.68 3h0p s PHE 221 N 4.81 3.16 0.45 4.92 0.40 -1.26 -4.57 117.98 125.90 3h0p s PHE 221 Ca 0.84 -0.15 0.08 0.00 -0.60 0.00 0.00 56.93 57.11 3h0p s PHE 221 Cb -0.38 -2.24 0.01 0.00 0.51 0.00 0.00 43.02 40.92 3h0p s PHE 221 CO 0.37 -0.18 0.54 -1.12 0.70 0.00 0.00 175.22 175.53 3h0p s SER 222 N 1.36 5.38 0.26 1.36 0.01 0.22 -4.83 113.70 117.45 3h0p s SER 222 Ca 0.06 -0.60 -0.30 0.00 1.31 0.00 0.00 55.95 56.42 3h0p s SER 222 Cb -0.15 -0.46 -0.09 0.00 0.21 0.00 0.00 66.02 65.53 3h0p s SER 222 CO 0.05 -0.83 1.28 0.00 0.41 0.00 0.00 173.24 174.16 3h0p s ALA 223 N -2.44 3.50 0.17 1.44 0.00 -1.26 -4.39 121.76 118.77 3h0p s ALA 223 Ca 0.53 1.14 -0.30 0.00 0.00 0.00 0.00 51.96 53.33 3h0p s ALA 223 Cb -0.07 -3.46 -0.08 0.00 0.00 0.00 0.00 23.12 19.51 3h0p s ALA 223 CO 0.32 -0.53 1.16 -1.25 0.00 0.00 0.00 175.76 175.47 3h0p s PRO 224 N -0.86 4.52 0.00 0.00 0.04 -1.26 -4.51 135.00 132.93 3h0p s PRO 224 Ca 0.52 1.81 0.26 0.00 0.04 0.00 0.00 61.00 63.63 3h0p s PRO 224 Cb -0.37 -3.27 0.61 0.00 0.04 0.00 0.00 34.50 31.51 3h0p s PRO 224 CO 0.44 -0.05 1.47 0.25 0.04 0.00 0.00 177.00 179.15 3h0p n THR 225 N 2.64 0.00 -3.80 1.26 -2.24 0.38 -4.82 114.28 107.69 3h0p n THR 225 Ca 0.04 -0.14 -0.13 0.00 -2.27 0.00 0.00 64.05 61.56 3h0p n THR 225 Cb 0.45 0.53 -0.14 0.00 -2.10 0.00 0.00 70.33 69.08 3h0p n THR 225 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3h0p s VAL 226 N -2.54 -0.02 0.37 2.28 1.01 -1.25 -5.08 120.40 115.17 3h0p s VAL 226 Ca 0.22 0.07 -0.26 0.00 0.00 0.00 0.00 61.98 62.00 3h0p s VAL 226 Cb 0.19 -0.18 -0.09 0.00 0.00 0.00 0.00 36.38 36.30 3h0p s VAL 226 CO 0.55 0.03 1.18 -2.16 0.00 0.00 0.00 175.10 174.69 3h0p s PRO 227 N 0.45 4.20 -0.12 2.72 0.05 -1.26 -4.85 135.00 136.19 3h0p s PRO 227 Ca -0.03 1.89 0.00 0.00 0.05 0.00 0.00 61.00 62.92 3h0p s PRO 227 Cb -0.05 -2.82 0.02 0.00 0.05 0.00 0.00 34.50 31.70 3h0p s PRO 227 CO -0.02 -0.21 -0.11 0.08 0.05 0.00 0.00 177.00 176.79 3h0p s VAL 228 N -1.33 1.27 -0.22 -0.36 1.01 -1.26 -4.49 120.40 115.02 3h0p s VAL 228 Ca 0.54 -0.46 -0.20 0.00 0.00 0.00 0.00 61.98 61.85 3h0p s VAL 228 Cb -0.32 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 3h0p s VAL 228 CO 0.41 0.41 0.61 0.54 0.00 0.00 0.00 175.10 177.07 3h0p s VAL 229 N 1.43 5.02 0.46 2.92 0.11 -1.26 -3.90 120.40 125.18 3h0p s VAL 229 Ca 0.01 1.13 -0.16 0.00 -2.93 0.00 0.00 61.98 60.03 3h0p s VAL 229 Cb -0.13 -3.92 -0.08 0.00 -1.53 0.00 0.00 36.38 30.71 3h0p s VAL 229 CO -0.07 0.09 0.92 0.54 -3.33 0.00 0.00 175.10 173.24 3h0p s ASN 230 N 1.31 6.66 0.09 3.54 2.20 -0.11 -4.46 114.94 124.16 3h0p s ASN 230 Ca 0.27 1.48 0.25 0.00 -0.94 0.00 0.00 52.86 53.91 3h0p s ASN 230 Cb -0.16 -2.46 0.48 0.00 -2.00 0.00 0.00 41.25 37.11 3h0p s ASN 230 CO 0.09 -0.48 1.42 -0.46 -2.94 0.00 0.00 177.10 174.73 3h0p n ASN 231 N -1.27 0.61 0.11 3.54 0.23 -1.26 -1.28 115.26 115.93 3h0p n ASN 231 Ca 0.06 0.09 -0.23 0.00 -0.53 0.00 0.00 54.58 53.96 3h0p n ASN 231 Cb 0.54 0.07 -0.15 0.00 -2.08 0.00 0.00 39.78 38.15 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 1.14 0.00 3.53 3.04 -1.90 -1.24 116.25 120.82 3h0p h VAL 232 Ca 0.00 -2.65 0.00 0.00 -1.01 0.00 0.00 66.70 63.04 3h0p h VAL 232 Cb 0.67 2.91 0.00 0.00 -2.01 0.00 0.00 31.29 32.86 3h0p h VAL 232 CO 0.00 0.83 -0.70 0.47 -1.01 0.00 0.00 177.57 177.16 3h0p n ASP 233 N -3.64 1.05 -3.13 3.17 8.00 -1.26 -4.85 116.55 115.88 3h0p n ASP 233 Ca -0.20 -0.53 -0.14 0.00 0.71 0.00 0.00 54.79 54.63 3h0p n ASP 233 Cb 1.09 1.12 0.07 0.00 -0.02 0.00 0.00 41.12 43.37 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 -1.38 -8.35 -3.52 2.53 0.31 -0.40 -5.03 118.33 102.48 3h0p n VAL 234 Ca 0.01 -1.19 -0.10 0.00 -0.01 0.00 0.00 64.34 63.05 3h0p n VAL 234 Cb 0.17 -6.16 -0.02 0.00 -0.91 0.00 0.00 33.84 26.93 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 -4.37 1.19 -0.22 5.55 -2.85 -1.18 -4.92 119.74 112.93 3h0p s LYS 235 Ca 0.39 -0.49 -0.13 0.00 -1.00 0.00 0.00 55.97 54.74 3h0p s LYS 235 Cb -0.05 0.51 -0.04 0.00 -2.06 0.00 0.00 37.83 36.19 3h0p s LYS 235 CO 0.68 -0.52 0.29 0.00 0.10 0.00 0.00 175.35 175.90 3h0p s GLU 237 N 1.24 2.05 0.00 0.00 0.41 -1.25 -5.03 118.70 116.12 3h0p s GLU 237 Ca 0.14 -1.03 0.00 0.00 -0.41 0.00 0.00 54.97 53.67 3h0p s GLU 237 Cb -0.14 -2.24 0.00 0.00 -1.78 0.00 0.00 34.13 29.97 3h0p s GLU 237 CO 0.07 0.52 0.00 0.25 -0.49 0.00 0.00 175.26 175.60 3h0p n THR 238 N 1.02 0.00 -2.26 3.63 -2.24 -1.26 -4.76 114.28 108.40 3h0p n THR 238 Ca -0.15 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 3h0p n THR 238 Cb 0.52 -0.68 -0.03 0.00 -2.10 0.00 0.00 70.33 68.05 3h0p n THR 238 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3h0p s ASP 239 N -2.69 6.89 0.21 3.42 1.01 -1.26 -4.69 116.67 119.56 3h0p s ASP 239 Ca 0.00 2.08 -0.14 0.00 0.71 0.00 0.00 52.55 55.20 3h0p s ASP 239 Cb 0.00 -2.56 0.23 0.00 1.01 0.00 0.00 42.92 41.60 3h0p s ASP 239 CO 0.00 -0.68 1.61 0.00 0.21 0.00 0.00 175.17 176.31 3h0p h ALA 240 N 7.63 0.36 -0.48 5.23 0.00 -1.91 0.25 119.26 130.34 3h0p h ALA 240 Ca -0.38 0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.80 3h0p h ALA 240 Cb 1.18 0.55 -0.03 0.00 0.00 0.00 0.00 17.79 19.50 3h0p h ALA 240 CO 0.89 -0.46 0.32 0.00 0.00 0.00 0.00 179.25 179.99 3h0p h ALA 241 N 1.55 1.75 -0.14 0.00 0.00 -1.96 0.68 119.26 121.15 3h0p h ALA 241 Ca 0.30 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 55.14 3h0p h ALA 241 Cb 0.50 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3h0p h ALA 241 CO -0.68 0.20 -0.09 0.00 0.00 0.00 0.00 179.25 178.67 3h0p h ALA 242 N 1.72 0.20 -0.62 0.00 0.00 -0.98 -1.91 119.26 117.66 3h0p h ALA 242 Ca 0.19 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 3h0p h ALA 242 Cb 0.06 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3h0p h ALA 242 CO -0.05 0.02 0.26 0.82 0.00 0.00 0.00 179.25 180.30 3h0p h ILE 243 N -0.05 1.23 0.12 0.00 2.04 -0.43 -2.48 117.51 117.94 3h0p h ILE 243 Ca 0.03 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 3h0p h ILE 243 Cb 0.59 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 3h0p h ILE 243 CO 0.03 0.28 -0.06 0.03 0.00 0.00 0.00 178.15 178.43 3h0p h ARG 244 N 0.87 -0.15 -0.71 2.37 3.08 -0.87 -1.91 114.38 117.06 3h0p h ARG 244 Ca 0.21 0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.28 3h0p h ARG 244 Cb 0.19 0.03 -0.04 0.00 0.08 0.00 0.00 29.97 30.24 3h0p h ARG 244 CO -0.02 -0.07 0.47 0.22 -1.07 0.00 0.00 179.97 179.50 3h0p h ASP 245 N -0.19 0.80 -0.49 7.04 3.58 -1.27 0.97 116.42 126.87 3h0p h ASP 245 Ca -0.02 -0.02 -0.08 0.00 0.42 0.00 0.00 57.03 57.33 3h0p h ASP 245 Cb 0.15 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 3h0p h ASP 245 CO 0.03 0.57 -0.00 0.00 -2.88 0.00 0.00 179.24 176.96 3h0p h ALA 246 N 1.56 0.98 -0.56 -0.78 0.00 -1.23 0.14 119.26 119.37 3h0p h ALA 246 Ca 0.27 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 3h0p h ALA 246 Cb -0.07 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3h0p h ALA 246 CO -0.06 0.62 0.05 -0.07 0.00 0.00 0.00 179.25 179.79 3h0p h LEU 247 N 0.84 0.92 0.11 0.00 3.38 -0.37 0.14 115.31 120.33 3h0p h LEU 247 Ca 0.16 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 3h0p h LEU 247 Cb 0.50 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.01 3h0p h LEU 247 CO 0.02 0.98 -0.05 0.58 0.09 0.00 0.00 178.44 180.06 3h0p h VAL 248 N 0.84 0.97 0.00 1.22 2.07 -0.33 -3.00 116.25 118.02 3h0p h VAL 248 Ca 0.16 -0.28 -0.05 0.00 0.82 0.00 0.00 66.70 67.35 3h0p h VAL 248 Cb 0.47 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 3h0p h VAL 248 CO 0.02 0.07 -0.26 0.03 0.02 0.00 0.00 177.57 177.45 3h0p h ARG 249 N -0.27 0.00 -0.76 1.57 3.08 -0.68 -2.79 114.38 114.52 3h0p h ARG 249 Ca -0.01 0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.15 3h0p h ARG 249 Cb 0.22 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 30.19 3h0p h ARG 249 CO 0.02 0.26 0.38 0.37 -1.07 0.00 0.00 179.97 179.93 3h0p h GLN 250 N 0.00 0.59 -0.59 0.04 4.15 -0.58 -2.05 115.11 116.68 3h0p h GLN 250 Ca -0.00 -0.04 0.07 0.00 0.77 0.00 0.00 58.65 59.46 3h0p h GLN 250 Cb 0.53 -0.13 -0.04 0.00 0.21 0.00 0.00 27.48 28.05 3h0p h GLN 250 CO 0.03 0.39 0.39 1.25 -1.93 0.00 0.00 178.83 178.97 3h0p h LEU 251 N 0.61 0.45 -3.03 -2.39 5.85 -1.52 -2.74 115.31 112.54 3h0p h LEU 251 Ca 0.39 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.11 3h0p h LEU 251 Cb 0.46 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.40 3h0p h LEU 251 CO -0.30 0.28 0.00 0.00 -0.34 0.00 0.00 178.44 178.08 3h0p n TYR 252 N -4.48 0.18 -4.34 1.25 0.18 -1.06 -1.95 117.16 106.94 3h0p n TYR 252 Ca 0.09 -0.79 -0.19 0.00 1.88 0.00 0.00 57.90 58.88 3h0p n TYR 252 Cb 0.29 -0.13 -0.10 0.00 -0.38 0.00 0.00 39.34 39.01 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 -2.02 2.61 0.52 9.48 -0.87 -0.79 -3.72 114.94 120.15 3h0p s ASN 253 Ca 0.23 -0.97 -0.22 0.00 -1.57 0.00 0.00 52.86 50.33 3h0p s ASN 253 Cb 0.19 -0.15 -0.06 0.00 -0.02 0.00 0.00 41.25 41.22 3h0p s ASN 253 CO 0.04 -0.13 1.31 -2.84 -2.57 0.00 0.00 177.10 172.92 3h0p s PRO 254 N -3.37 3.33 -0.45 -0.60 0.02 -1.23 -4.66 135.00 128.04 3h0p s PRO 254 Ca 0.20 2.13 -0.25 0.00 0.02 0.00 0.00 61.00 63.11 3h0p s PRO 254 Cb -0.02 -2.32 0.03 0.00 0.02 0.00 0.00 34.50 32.20 3h0p s PRO 254 CO 0.07 -1.01 0.89 0.08 -0.33 0.00 0.00 177.00 176.71 3h0p s VAL 255 N -1.35 4.52 -1.33 3.83 1.01 0.18 -4.48 120.40 122.78 3h0p s VAL 255 Ca 0.69 0.73 -0.09 0.00 0.00 0.00 0.00 61.98 63.32 3h0p s VAL 255 Cb -0.38 -4.40 0.13 0.00 0.00 0.00 0.00 36.38 31.73 3h0p s VAL 255 CO 0.45 -0.77 2.13 0.00 0.00 0.00 0.00 175.10 176.91 3h0p n GLN 256 N 7.03 3.85 -0.18 2.72 1.13 -0.47 -1.43 117.38 130.03 3h0p n GLN 256 Ca 0.05 -3.34 -0.11 0.00 -1.94 0.00 0.00 57.00 51.67 3h0p n GLN 256 Cb 0.48 -2.86 0.01 0.00 0.11 0.00 0.00 30.24 27.98 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 5.37 1.17 -0.71 1.08 2.91 -1.78 -1.11 115.95 122.87 3h0p h TRP 257 Ca 0.53 -0.25 0.02 0.00 1.13 0.00 0.00 58.89 60.32 3h0p h TRP 257 Cb 0.51 -0.28 -0.04 0.00 -0.51 0.00 0.00 29.16 28.83 3h0p h TRP 257 CO 1.42 1.09 0.45 1.15 -1.03 0.00 0.00 178.44 181.52 3h0p h THR 258 N 0.91 1.12 -0.02 2.65 2.02 -1.11 -1.39 112.91 117.08 3h0p h THR 258 Ca 0.13 -0.31 -0.13 0.00 0.77 0.00 0.00 66.41 66.88 3h0p h THR 258 Cb 0.71 0.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 3h0p h THR 258 CO 0.05 0.16 -0.58 0.11 0.37 0.00 0.00 175.52 175.64 3h0p h LYS 259 N 0.90 0.08 -0.45 6.66 1.57 -1.78 -2.03 116.57 121.52 3h0p h LYS 259 Ca 0.28 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.90 3h0p h LYS 259 Cb -0.02 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 3h0p h LYS 259 CO -0.09 0.64 -0.13 0.77 -0.57 0.00 0.00 179.45 180.06 3h0p h SER 260 N 0.06 0.89 -0.26 0.86 0.02 -0.65 0.15 113.55 114.61 3h0p h SER 260 Ca -0.00 -0.37 -0.15 0.00 -0.84 0.00 0.00 61.79 60.42 3h0p h SER 260 Cb 1.04 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.33 3h0p h SER 260 CO 0.08 1.06 -0.39 0.58 -1.14 0.00 0.00 176.83 177.02 3h0p h VAL 261 N 0.72 1.28 -0.54 2.27 2.07 -1.22 -1.03 116.25 119.79 3h0p h VAL 261 Ca 0.11 -1.57 -0.04 0.00 0.82 0.00 0.00 66.70 66.02 3h0p h VAL 261 Cb 0.68 1.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 3h0p h VAL 261 CO 0.05 0.52 0.17 -0.33 0.02 0.00 0.00 177.57 178.00 3h0p h GLU 262 N 0.66 0.80 -0.35 1.57 5.08 -1.25 -1.57 114.58 119.53 3h0p h GLU 262 Ca 0.05 -0.14 -0.13 0.00 -1.00 0.00 0.00 59.36 58.14 3h0p h GLU 262 Cb 0.96 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 3h0p h GLU 262 CO 0.09 0.69 -0.31 0.35 -1.00 0.00 0.00 179.01 178.83 3h0p h PHE 263 N 0.78 0.90 -0.49 4.33 3.57 -0.64 -1.27 116.94 124.13 3h0p h PHE 263 Ca 0.18 -0.24 -0.06 0.00 3.53 0.00 0.00 57.97 61.38 3h0p h PHE 263 Cb 0.22 -0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.74 3h0p h PHE 263 CO 0.01 0.99 0.07 0.82 -2.23 0.00 0.00 178.31 177.97 3h0p h ILE 264 N 0.65 1.25 -0.56 1.41 2.04 -0.83 -2.32 117.51 119.15 3h0p h ILE 264 Ca 0.07 -0.95 -0.07 0.00 1.00 0.00 0.00 64.86 64.92 3h0p h ILE 264 Cb 0.85 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 3h0p h ILE 264 CO 0.07 0.34 0.08 0.00 0.00 0.00 0.00 178.15 178.64 3h0p h ALA 265 N 0.96 1.09 0.00 1.87 0.00 -1.21 -2.21 119.26 119.77 3h0p h ALA 265 Ca 0.15 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3h0p h ALA 265 Cb 0.41 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 3h0p h ALA 265 CO 0.01 0.59 -0.04 0.00 0.00 0.00 0.00 179.25 179.81 3h0p h ALA 266 N 1.24 1.14 0.00 0.00 0.00 -0.73 -0.95 119.26 119.96 3h0p h ALA 266 Ca 0.18 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3h0p h ALA 266 Cb 0.39 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3h0p h ALA 266 CO 0.01 0.05 0.00 1.96 0.00 0.00 0.00 179.25 181.27 3h0p h GLN 267 N 0.00 0.00 0.00 0.00 1.08 -0.88 -3.47 115.11 111.84 3h0p h GLN 267 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3h0p h GLN 267 Cb 0.23 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 3h0p h GLN 267 CO 0.01 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.30 3h0p n GLY 268 N 1.25 0.93 3.76 3.46 0.00 -0.36 -5.08 105.19 109.16 3h0p n GLY 268 Ca 0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.00 2.81 -0.07 1.61 1.01 -1.16 -4.95 120.40 117.65 3h0p s VAL 269 Ca 0.00 0.78 0.16 0.00 0.00 0.00 0.00 61.98 62.91 3h0p s VAL 269 Cb 0.00 -3.49 -0.23 0.00 0.00 0.00 0.00 36.38 32.65 3h0p s VAL 269 CO 0.00 0.17 0.26 -0.62 0.00 0.00 0.00 175.10 174.91 3h0p n GLU 270 N 1.20 0.83 -3.87 2.72 1.02 -0.13 -4.57 120.64 117.84 3h0p n GLU 270 Ca 0.01 -0.10 -0.12 0.00 -0.02 0.00 0.00 57.16 56.93 3h0p n GLU 270 Cb 0.42 -1.39 -0.13 0.00 -0.02 0.00 0.00 31.44 30.32 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 -2.89 -0.02 -0.15 -0.32 5.04 -0.90 -2.40 115.29 113.66 3h0p s HIS 271 Ca -0.07 0.06 -0.01 0.00 -1.54 0.00 0.00 55.06 53.50 3h0p s HIS 271 Cb 0.09 -0.01 -0.01 0.00 0.04 0.00 0.00 32.58 32.68 3h0p s HIS 271 CO 0.67 -0.09 -0.11 -0.51 -2.34 0.00 0.00 174.74 172.35 3h0p s LEU 272 N -0.35 2.76 -0.22 8.88 1.43 -0.39 -1.23 118.68 129.56 3h0p s LEU 272 Ca -0.04 -0.34 -0.07 0.00 -1.03 0.00 0.00 54.13 52.65 3h0p s LEU 272 Cb -0.03 -1.64 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 3h0p s LEU 272 CO 0.00 0.13 0.06 -0.31 0.23 0.00 0.00 176.35 176.46 3h0p s TYR 273 N 0.59 3.14 -0.43 0.29 2.02 -0.42 -1.66 117.35 120.89 3h0p s TYR 273 Ca -0.07 -0.20 -0.25 0.00 -0.37 0.00 0.00 57.07 56.18 3h0p s TYR 273 Cb -0.15 -2.16 0.02 0.00 -0.40 0.00 0.00 41.96 39.27 3h0p s TYR 273 CO 0.03 -0.13 0.91 -2.00 -1.57 0.00 0.00 175.55 172.79 3h0p s GLU 274 N 1.06 3.64 -1.03 -0.62 2.12 -0.39 -1.05 118.70 122.43 3h0p s GLU 274 Ca 0.04 0.29 -0.12 0.00 0.36 0.00 0.00 54.97 55.54 3h0p s GLU 274 Cb -0.14 -3.88 0.24 0.00 0.26 0.00 0.00 34.13 30.61 3h0p s GLU 274 CO 0.03 -1.11 1.05 0.08 -0.54 0.00 0.00 175.26 174.77 3h0p s VAL 275 N 3.62 5.69 0.00 3.70 1.01 0.11 -1.60 120.40 132.93 3h0p s VAL 275 Ca 0.37 -2.92 0.00 0.00 0.00 0.00 0.00 61.98 59.43 3h0p s VAL 275 Cb -0.11 -4.61 0.00 0.00 0.00 0.00 0.00 36.38 31.66 3h0p s VAL 275 CO 0.23 -1.21 0.00 0.61 0.00 0.00 0.00 175.10 174.73 3h0p n GLY 276 N 3.44 -0.65 3.78 4.51 0.00 -1.26 -4.52 105.19 110.48 3h0p n GLY 276 Ca 0.22 -1.08 -0.31 0.00 0.00 0.00 0.00 46.02 44.85 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 2.30 0.79 1.61 0.04 -1.26 -4.46 135.00 132.02 3h0p s PRO 277 Ca 0.00 1.04 0.00 0.00 0.04 0.00 0.00 61.00 62.08 3h0p s PRO 277 Cb 0.00 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.63 3h0p s PRO 277 CO 0.00 -1.58 0.00 0.41 0.04 0.00 0.00 177.00 175.87 3h0p n GLY 278 N -1.45 -1.94 1.47 0.56 0.00 -1.26 -4.75 105.19 97.83 3h0p n GLY 278 Ca 0.08 -1.36 0.04 0.00 0.00 0.00 0.00 46.02 44.78 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 -1.13 0.33 0.46 1.61 5.02 -1.26 -4.91 118.16 118.27 3h0p n LYS 279 Ca 0.00 -2.27 -0.20 0.00 -2.02 0.00 0.00 58.31 53.83 3h0p n LYS 279 Cb 0.08 -0.31 -0.10 0.00 -0.02 0.00 0.00 35.03 34.68 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 6.14 0.08 -0.55 -0.18 2.07 -1.98 -1.86 116.25 119.96 3h0p h VAL 280 Ca -0.19 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.27 3h0p h VAL 280 Cb 1.75 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.57 3h0p h VAL 280 CO 0.10 0.00 0.09 -0.07 0.02 0.00 0.00 177.57 177.71 3h0p h LEU 281 N -1.20 0.83 -0.59 2.57 3.38 -1.95 -2.34 115.31 116.02 3h0p h LEU 281 Ca -0.11 -0.17 0.09 0.00 0.09 0.00 0.00 57.88 57.78 3h0p h LEU 281 Cb 0.94 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 41.40 3h0p h LEU 281 CO 0.16 0.84 0.20 0.74 0.09 0.00 0.00 178.44 180.47 3h0p h THR 282 N 0.84 0.75 -0.30 0.22 2.02 -1.89 -2.21 112.91 112.33 3h0p h THR 282 Ca 0.17 -0.13 -0.07 0.00 0.77 0.00 0.00 66.41 67.16 3h0p h THR 282 Cb 0.37 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 3h0p h THR 282 CO 0.01 0.07 -0.11 1.23 0.37 0.00 0.00 175.52 177.08 3h0p h GLY 283 N 0.37 0.55 2.00 2.16 0.00 -0.79 -3.00 103.07 104.37 3h0p h GLY 283 Ca 0.30 -0.38 -0.09 0.00 0.00 0.00 0.00 47.33 47.15 3h0p h GLY 283 CO -0.32 0.35 -0.45 1.41 0.00 0.00 0.00 176.54 177.54 3h0p h LEU 284 N 0.48 0.00 -0.15 3.11 3.38 -1.20 -3.38 115.31 117.55 3h0p h LEU 284 Ca 0.09 0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.10 3h0p h LEU 284 Cb 0.49 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.17 3h0p h LEU 284 CO 0.03 0.45 -0.48 0.74 0.09 0.00 0.00 178.44 179.27 3h0p h THR 285 N 0.00 0.07 0.00 0.22 2.02 -1.34 -1.52 112.91 112.36 3h0p h THR 285 Ca -0.00 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 3h0p h THR 285 Cb 0.88 0.07 -0.00 0.00 -1.74 0.00 0.00 68.15 67.36 3h0p h THR 285 CO 0.06 0.00 -0.11 0.11 0.37 0.00 0.00 175.52 175.95 3h0p h LYS 286 N -0.53 0.00 0.00 6.66 1.57 -1.76 -0.11 116.57 122.40 3h0p h LYS 286 Ca 0.06 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.78 3h0p h LYS 286 Cb 0.65 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.96 3h0p h LYS 286 CO -0.43 0.11 -0.28 0.00 -0.57 0.00 0.00 179.45 178.28 3h0p h ARG 287 N 0.00 0.00 0.00 3.15 3.08 -1.50 -3.19 114.38 115.91 3h0p h ARG 287 Ca -0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.88 3h0p h ARG 287 Cb 0.26 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.28 3h0p h ARG 287 CO 0.01 0.28 -1.03 0.82 -1.07 0.00 0.00 179.97 178.98 3h0p h ILE 288 N 0.00 0.74 -3.00 2.04 2.04 -0.54 -3.40 117.51 115.39 3h0p h ILE 288 Ca -0.00 -1.91 -0.48 0.00 1.00 0.00 0.00 64.86 63.46 3h0p h ILE 288 Cb 0.79 1.76 -0.41 0.00 -0.74 0.00 0.00 36.82 38.22 3h0p h ILE 288 CO 0.04 0.25 -0.76 -0.69 0.00 0.00 0.00 178.15 176.99 3h0p s VAL 289 N -2.32 -0.04 -1.96 1.67 1.01 -0.61 -4.94 120.40 113.21 3h0p s VAL 289 Ca -0.25 -0.35 0.23 0.00 0.00 0.00 0.00 61.98 61.61 3h0p s VAL 289 Cb 0.05 -0.71 0.65 0.00 0.00 0.00 0.00 36.38 36.36 3h0p s VAL 289 CO 0.51 -0.39 1.76 -0.90 0.00 0.00 0.00 175.10 176.07 3h0p n ASP 290 N 5.25 0.00 -0.03 3.32 5.75 -1.21 -2.36 116.55 127.28 3h0p n ASP 290 Ca -0.07 -0.69 0.13 0.00 -0.01 0.00 0.00 54.79 54.15 3h0p n ASP 290 Cb 0.47 -0.02 0.37 0.00 -1.03 0.00 0.00 41.12 40.91 3h0p n ASP 290 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3h0p n THR 291 N -1.02 0.00 -3.14 2.12 -2.24 -1.26 -4.89 114.28 103.86 3h0p n THR 291 Ca 0.17 -0.01 -0.27 0.00 -2.27 0.00 0.00 64.05 61.67 3h0p n THR 291 Cb 0.09 0.07 -0.02 0.00 -2.10 0.00 0.00 70.33 68.37 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 -2.92 3.91 0.24 3.22 1.43 -0.99 -4.99 118.68 118.58 3h0p s LEU 292 Ca 0.14 0.70 0.12 0.00 -1.03 0.00 0.00 54.13 54.05 3h0p s LEU 292 Cb 0.18 -3.57 -0.05 0.00 0.03 0.00 0.00 46.19 42.78 3h0p s LEU 292 CO 0.63 -0.35 -0.20 0.42 0.23 0.00 0.00 176.35 177.09 3h0p s THR 293 N -2.36 2.51 0.04 5.49 -4.23 -1.01 -4.77 115.64 111.31 3h0p s THR 293 Ca 0.44 -2.22 -0.12 0.00 -1.18 0.00 0.00 61.69 58.61 3h0p s THR 293 Cb -0.10 -2.28 0.01 0.00 1.34 0.00 0.00 72.50 71.47 3h0p s THR 293 CO 0.36 -0.29 0.25 0.00 -0.54 0.00 0.00 174.62 174.40 3h0p s ALA 294 N -2.17 -0.52 0.14 3.99 0.00 -1.26 -1.26 121.76 120.67 3h0p s ALA 294 Ca 0.27 -0.11 -0.19 0.00 0.00 0.00 0.00 51.96 51.92 3h0p s ALA 294 Cb -0.06 0.28 0.05 0.00 0.00 0.00 0.00 23.12 23.38 3h0p s ALA 294 CO 0.13 -0.37 0.48 -1.54 0.00 0.00 0.00 175.76 174.46 3h0p s SER 295 N -2.00 -0.36 0.08 0.00 1.04 -0.66 -4.94 113.70 106.84 3h0p s SER 295 Ca -0.06 -0.19 0.01 0.00 0.48 0.00 0.00 55.95 56.18 3h0p s SER 295 Cb -0.01 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.59 3h0p s SER 295 CO -0.03 -0.90 0.20 0.00 0.98 0.00 0.00 173.24 173.49 3h0p s ALA 296 N -3.78 3.93 -0.50 5.32 0.00 -1.26 -1.26 121.76 124.21 3h0p s ALA 296 Ca 0.02 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.12 3h0p s ALA 296 Cb 0.01 -1.75 0.43 0.00 0.00 0.00 0.00 23.12 21.80 3h0p s ALA 296 CO -0.12 0.78 1.46 1.28 0.00 0.00 0.00 175.76 179.15 3h0p n LEU 297 N 0.21 5.81 -0.14 0.00 4.77 -0.63 -4.68 117.00 122.34 3h0p n LEU 297 Ca -0.06 -4.82 0.03 0.00 -0.03 0.00 0.00 56.01 51.13 3h0p n LEU 297 Cb 0.52 -0.62 -0.00 0.00 -2.33 0.00 0.00 43.42 40.99 3h0p n LEU 297 CO 0.50 1.97 0.17 -0.46 -1.33 0.00 0.00 177.39 178.24 3h0p n ASN 298 N -0.65 0.92 -4.56 -1.43 0.23 -1.26 -4.75 115.26 103.76 3h0p n ASN 298 Ca 0.48 -0.96 -0.34 0.00 -0.53 0.00 0.00 54.58 53.23 3h0p n ASN 298 Cb 0.70 0.52 -0.11 0.00 -2.08 0.00 0.00 39.78 38.80 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 -1.12 3.50 0.21 -3.83 2.02 -1.26 -4.79 118.70 113.43 3h0p s GLU 299 Ca 0.05 -0.48 -0.17 0.00 0.02 0.00 0.00 54.97 54.39 3h0p s GLU 299 Cb 0.05 -2.90 0.21 0.00 0.10 0.00 0.00 34.13 31.60 3h0p s GLU 299 CO 0.18 0.37 1.58 -1.35 0.02 0.00 0.00 175.26 176.06 3h0p h PRO 300 N 6.27 -0.07 -0.67 0.39 0.11 -1.93 -0.84 132.00 135.26 3h0p h PRO 300 Ca -0.37 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.70 3h0p h PRO 300 Cb 1.19 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 3h0p h PRO 300 CO 0.61 -0.05 0.25 0.00 -0.21 0.00 0.00 178.00 178.61 3h0p h ALA 301 N 1.31 1.18 -0.41 -0.75 0.00 -1.99 -0.48 119.26 118.13 3h0p h ALA 301 Ca 0.31 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 3h0p h ALA 301 Cb 0.58 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 3h0p h ALA 301 CO -0.81 0.59 -0.03 0.00 0.00 0.00 0.00 179.25 178.99 3h0p h ALA 302 N 1.30 0.55 -0.33 0.00 0.00 -1.70 -0.73 119.26 118.35 3h0p h ALA 302 Ca 0.22 -0.28 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 3h0p h ALA 302 Cb 0.21 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3h0p h ALA 302 CO -0.02 0.36 -0.20 1.25 0.00 0.00 0.00 179.25 180.65 3h0p h LEU 303 N 0.56 0.76 -0.32 0.00 6.46 -1.00 -1.83 115.31 119.94 3h0p h LEU 303 Ca 0.11 -0.42 0.04 0.00 -0.12 0.00 0.00 57.88 57.49 3h0p h LEU 303 Cb 0.53 -0.21 -0.04 0.00 -0.73 0.00 0.00 40.66 40.21 3h0p h LEU 303 CO 0.03 1.02 0.08 -1.28 -0.62 0.00 0.00 178.44 177.66 3h0p h SER 304 N 0.50 0.05 -0.84 1.25 0.87 -0.98 -2.11 113.55 112.29 3h0p h SER 304 Ca 0.07 0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.68 3h0p h SER 304 Cb 0.75 0.05 -0.04 0.00 -0.44 0.00 0.00 62.40 62.72 3h0p h SER 304 CO 0.06 0.07 0.55 0.00 -0.53 0.00 0.00 176.83 176.97 3h0p h ALA 305 N 1.22 1.07 -0.14 6.23 0.00 -1.07 -2.87 119.26 123.70 3h0p h ALA 305 Ca 0.15 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 3h0p h ALA 305 Cb 0.14 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3h0p h ALA 305 CO -0.18 0.48 -0.13 0.00 0.00 0.00 0.00 179.25 179.43 3h0p h ALA 306 N 1.30 1.53 -0.50 0.00 0.00 -0.68 -2.25 119.26 118.67 3h0p h ALA 306 Ca 0.31 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 3h0p h ALA 306 Cb -0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 3h0p h ALA 306 CO -0.06 0.34 -0.12 -0.07 0.00 0.00 0.00 179.25 179.33 3h0p h LEU 307 N 0.20 0.93 -8.71 0.00 3.38 -1.21 -3.41 115.31 106.49 3h0p h LEU 307 Ca 0.04 -0.30 -0.56 0.00 0.09 0.00 0.00 57.88 57.15 3h0p h LEU 307 Cb 0.36 -0.25 -0.07 0.00 0.09 0.00 0.00 40.66 40.79 3h0p h LEU 307 CO 0.02 1.06 0.96 -0.89 0.09 0.00 0.00 178.44 179.68 3h0p s THR 308 N -4.80 4.12 0.00 0.22 2.01 -0.85 -5.01 115.64 111.33 3h0p s THR 308 Ca -0.11 1.12 0.00 0.00 0.31 0.00 0.00 61.69 63.02 3h0p s THR 308 Cb 0.13 -4.55 0.00 0.00 0.01 0.00 0.00 72.50 68.09 3h0p s THR 308 CO 0.85 -1.02 0.00 0.00 -0.69 0.00 0.00 174.62 173.76