#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ddh n GLU 3 N 0.00 -1.45 -0.06 -1.58 -0.58 -1.26 -4.74 120.64 110.97 3ddh n GLU 3 Ca 0.00 0.76 -0.12 0.00 -0.42 0.00 0.00 57.16 57.38 3ddh n GLU 3 Cb 0.00 -5.07 -0.04 0.00 -0.57 0.00 0.00 31.44 25.75 3ddh n GLU 3 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 3ddh n LEU 4 N -2.05 1.48 -4.69 -4.62 7.94 -1.26 -5.03 117.00 108.77 3ddh n LEU 4 Ca -0.14 0.24 -0.42 0.00 -1.11 0.00 0.00 56.01 54.58 3ddh n LEU 4 Cb 0.47 -0.57 -0.03 0.00 0.53 0.00 0.00 43.42 43.82 3ddh n LEU 4 CO 0.20 -0.07 1.11 -0.63 -1.11 0.00 0.00 177.39 176.89 3ddh s ILE 5 N -2.48 3.76 -0.10 1.96 -1.09 -1.26 -4.27 121.20 117.73 3ddh s ILE 5 Ca -0.22 1.13 0.11 0.00 -2.23 0.00 0.00 60.65 59.45 3ddh s ILE 5 Cb 0.06 -3.73 -0.16 0.00 -1.58 0.00 0.00 42.46 37.05 3ddh s ILE 5 CO 0.30 -0.00 0.10 0.29 -1.23 0.00 0.00 174.94 174.39 3ddh n LYS 6 N 5.39 1.62 -4.63 2.79 4.76 -0.05 -4.94 118.16 123.10 3ddh n LYS 6 Ca 0.13 -0.03 -0.25 0.00 -2.87 0.00 0.00 58.31 55.29 3ddh n LYS 6 Cb 0.44 -1.31 -0.16 0.00 -1.84 0.00 0.00 35.03 32.15 3ddh n LYS 6 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3ddh s VAL 7 N -2.44 1.19 -0.26 -0.18 1.01 -0.92 -0.86 120.40 117.93 3ddh s VAL 7 Ca -0.06 -0.52 -0.04 0.00 0.00 0.00 0.00 61.98 61.36 3ddh s VAL 7 Cb 0.05 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.37 3ddh s VAL 7 CO 0.51 0.36 -0.01 -0.63 0.00 0.00 0.00 175.10 175.34 3ddh s ILE 8 N 0.55 3.38 -0.13 2.22 1.01 0.20 -1.52 121.20 126.91 3ddh s ILE 8 Ca -0.13 -0.80 -0.07 0.00 0.00 0.00 0.00 60.65 59.66 3ddh s ILE 8 Cb -0.15 -2.69 -0.04 0.00 0.01 0.00 0.00 42.46 39.59 3ddh s ILE 8 CO 0.04 0.20 0.11 0.00 0.00 0.00 0.00 174.94 175.28 3ddh s ALA 9 N 1.42 3.72 -0.12 9.38 0.00 0.40 -1.67 121.76 134.90 3ddh s ALA 9 Ca 0.02 -0.68 0.03 0.00 0.00 0.00 0.00 51.96 51.33 3ddh s ALA 9 Cb -0.16 -1.91 0.00 0.00 0.00 0.00 0.00 23.12 21.05 3ddh s ALA 9 CO -0.02 0.52 -0.22 -0.06 0.00 0.00 0.00 175.76 175.98 3ddh s PHE 10 N -0.72 2.62 0.72 0.00 0.40 0.46 -0.73 117.98 120.74 3ddh s PHE 10 Ca 0.13 -1.12 -0.16 0.00 -0.60 0.00 0.00 56.93 55.18 3ddh s PHE 10 Cb -0.12 -1.76 0.03 0.00 0.51 0.00 0.00 43.02 41.69 3ddh s PHE 10 CO 0.03 -0.47 1.26 0.34 0.70 0.00 0.00 175.22 177.07 3ddh s ASP 11 N 0.52 4.09 -0.07 1.36 2.15 -0.00 -0.40 116.67 124.32 3ddh s ASP 11 Ca -0.14 2.52 -0.06 0.00 0.43 0.00 0.00 52.55 55.30 3ddh s ASP 11 Cb -0.17 -2.61 -0.02 0.00 -0.30 0.00 0.00 42.92 39.82 3ddh s ASP 11 CO 0.05 -2.34 -0.12 0.00 -0.17 0.00 0.00 175.17 172.59 3ddh n ALA 12 N -2.57 0.31 -2.10 3.66 0.00 -1.26 -3.97 120.51 114.57 3ddh n ALA 12 Ca 0.15 -0.43 -0.42 0.00 0.00 0.00 0.00 53.44 52.74 3ddh n ALA 12 Cb 0.49 0.01 -0.03 0.00 0.00 0.00 0.00 19.45 19.92 3ddh n ALA 12 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3ddh s ASP 13 N -4.66 6.74 -0.27 0.00 1.01 -1.26 -0.18 116.67 118.05 3ddh s ASP 13 Ca -0.10 2.18 0.00 0.00 0.71 0.00 0.00 52.55 55.34 3ddh s ASP 13 Cb 0.01 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.40 3ddh s ASP 13 CO 0.15 -0.84 0.00 0.47 0.21 0.00 0.00 175.17 175.16 3ddh n ASP 14 N 6.26 -4.57 0.03 0.27 8.00 0.80 -4.82 116.55 122.52 3ddh n ASP 14 Ca 0.15 0.06 -0.01 0.00 0.71 0.00 0.00 54.79 55.71 3ddh n ASP 14 Cb 0.43 -2.29 -0.00 0.00 -0.02 0.00 0.00 41.12 39.23 3ddh n ASP 14 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 3ddh n THR 15 N -2.51 0.84 0.02 -3.53 -1.04 -0.77 -4.63 114.28 102.67 3ddh n THR 15 Ca -0.03 0.25 -0.15 0.00 -2.04 0.00 0.00 64.05 62.09 3ddh n THR 15 Cb 0.29 -1.59 -0.14 0.00 -1.82 0.00 0.00 70.33 67.07 3ddh n THR 15 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3ddh h LEU 16 N -0.05 0.25 -7.79 -4.42 3.38 -0.70 -3.43 115.31 102.56 3ddh h LEU 16 Ca -0.01 -0.46 -0.08 0.00 0.09 0.00 0.00 57.88 57.41 3ddh h LEU 16 Cb 0.39 -0.08 -0.13 0.00 0.09 0.00 0.00 40.66 40.92 3ddh h LEU 16 CO -0.01 1.40 -0.31 -1.66 0.09 0.00 0.00 178.44 177.95 3ddh s TRP 17 N -2.60 0.13 0.25 1.13 -2.14 -1.16 -1.24 118.94 113.32 3ddh s TRP 17 Ca -0.11 -0.54 -0.30 0.00 2.66 0.00 0.00 56.10 57.82 3ddh s TRP 17 Cb 0.07 -0.00 -0.09 0.00 -3.10 0.00 0.00 33.47 30.35 3ddh s TRP 17 CO 0.82 -0.60 1.16 0.45 -2.66 0.00 0.00 176.95 176.11 3ddh s SER 18 N -2.87 7.15 0.00 -2.66 0.15 -0.76 -0.14 113.70 114.56 3ddh s SER 18 Ca 0.07 2.30 0.00 0.00 0.70 0.00 0.00 55.95 59.01 3ddh s SER 18 Cb 0.04 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 3ddh s SER 18 CO -0.09 -0.27 0.00 -3.20 1.20 0.00 0.00 173.24 170.87 3ddh n ASN 19 N 1.68 0.04 -0.28 5.45 5.15 -1.26 -4.65 115.26 121.40 3ddh n ASN 19 Ca 0.01 0.00 0.02 0.00 -0.60 0.00 0.00 54.58 54.01 3ddh n ASN 19 Cb 0.44 0.00 0.23 0.00 -0.53 0.00 0.00 39.78 39.93 3ddh n ASN 19 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 3ddh h GLU 20 N 0.00 1.02 -0.69 1.20 4.57 -1.93 -2.16 114.58 116.58 3ddh h GLU 20 Ca 0.00 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 3ddh h GLU 20 Cb 0.14 -0.23 -0.03 0.00 -0.16 0.00 0.00 28.75 28.47 3ddh h GLU 20 CO 0.00 0.67 0.43 -1.35 -1.18 0.00 0.00 179.01 177.59 3ddh h PRO 21 N 1.05 0.92 -0.27 0.92 0.11 -1.98 0.78 132.00 133.53 3ddh h PRO 21 Ca 0.34 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.37 3ddh h PRO 21 Cb 0.06 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 30.95 3ddh h PRO 21 CO -0.11 0.64 0.14 0.35 -0.21 0.00 0.00 178.00 178.81 3ddh h PHE 22 N 0.94 0.39 -0.73 0.65 3.04 -1.78 -1.30 116.94 118.14 3ddh h PHE 22 Ca 0.25 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 62.21 3ddh h PHE 22 Cb -0.06 -0.12 -0.04 0.00 2.56 0.00 0.00 35.95 38.28 3ddh h PHE 22 CO -0.02 0.34 0.46 0.74 -2.02 0.00 0.00 178.31 177.81 3ddh h PHE 23 N 0.32 0.86 -0.57 0.41 -1.00 -1.16 -1.84 116.94 113.96 3ddh h PHE 23 Ca 0.10 0.02 -0.08 0.00 2.81 0.00 0.00 57.97 60.82 3ddh h PHE 23 Cb 0.09 -0.28 -0.02 0.00 3.61 0.00 0.00 35.95 39.35 3ddh h PHE 23 CO -0.03 0.49 0.03 1.96 -1.61 0.00 0.00 178.31 179.16 3ddh h GLN 24 N 0.90 0.96 -0.63 1.51 4.20 -0.52 -0.63 115.11 120.90 3ddh h GLN 24 Ca 0.29 -0.27 -0.07 0.00 0.06 0.00 0.00 58.65 58.66 3ddh h GLN 24 Cb 0.01 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 3ddh h GLN 24 CO -0.11 0.93 0.11 1.49 -0.67 0.00 0.00 178.83 180.57 3ddh h GLU 25 N 0.89 1.04 -0.35 1.46 4.57 -1.02 -0.79 114.58 120.37 3ddh h GLU 25 Ca 0.17 -0.28 0.01 0.00 -1.18 0.00 0.00 59.36 58.09 3ddh h GLU 25 Cb 0.48 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.92 3ddh h GLU 25 CO 0.02 0.96 0.20 0.28 -1.18 0.00 0.00 179.01 179.30 3ddh h VAL 26 N 0.95 1.04 -0.49 0.32 2.07 -1.01 -1.80 116.25 117.32 3ddh h VAL 26 Ca 0.19 -0.14 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 3ddh h VAL 26 Cb 0.43 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.75 3ddh h VAL 26 CO 0.01 0.08 0.23 -0.08 0.02 0.00 0.00 177.57 177.83 3ddh h GLU 27 N 0.42 0.68 0.02 1.57 4.81 -0.81 0.01 114.58 121.28 3ddh h GLU 27 Ca 0.14 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 3ddh h GLU 27 Cb 0.00 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.25 3ddh h GLU 27 CO -0.07 0.53 -0.01 -0.22 -0.73 0.00 0.00 179.01 178.51 3ddh h LYS 28 N 0.68 -0.03 -0.93 1.92 3.64 -0.91 -0.80 116.57 120.14 3ddh h LYS 28 Ca 0.17 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 59.57 3ddh h LYS 28 Cb 0.07 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 31.85 3ddh h LYS 28 CO -0.02 0.17 0.61 1.96 -2.27 0.00 0.00 179.45 179.90 3ddh h GLN 29 N -0.23 1.19 -0.11 1.90 4.20 -0.95 -1.10 115.11 120.01 3ddh h GLN 29 Ca -0.00 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.66 3ddh h GLN 29 Cb 0.21 -0.27 -0.02 0.00 0.30 0.00 0.00 27.48 27.70 3ddh h GLN 29 CO 0.01 0.79 -0.03 -0.92 -0.67 0.00 0.00 178.83 178.00 3ddh h TYR 30 N 1.22 -0.07 -0.04 2.96 3.20 -0.86 -2.55 116.97 120.84 3ddh h TYR 30 Ca 0.35 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.17 3ddh h TYR 30 Cb -0.08 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 3ddh h TYR 30 CO -0.01 -0.05 -0.27 1.79 -1.64 0.00 0.00 178.16 177.98 3ddh h THR 31 N -0.01 1.21 -0.50 1.81 1.35 -0.54 -0.92 112.91 115.31 3ddh h THR 31 Ca 0.05 -1.01 -0.00 0.00 -0.55 0.00 0.00 66.41 64.90 3ddh h THR 31 Cb 0.09 1.49 -0.02 0.00 -1.73 0.00 0.00 68.15 67.98 3ddh h THR 31 CO -0.12 0.29 0.29 0.44 -0.25 0.00 0.00 175.52 176.18 3ddh h ASP 32 N 0.06 0.59 0.86 5.36 3.32 -0.93 -2.50 116.42 123.18 3ddh h ASP 32 Ca 0.01 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 3ddh h ASP 32 Cb 0.52 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 3ddh h ASP 32 CO 0.04 0.46 -0.19 -0.07 -1.72 0.00 0.00 179.24 177.76 3ddh h LEU 33 N 0.68 0.00 -3.43 1.55 3.38 -0.76 -3.18 115.31 113.55 3ddh h LEU 33 Ca 0.18 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.03 3ddh h LEU 33 Cb -0.01 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.67 3ddh h LEU 33 CO -0.03 0.19 0.07 0.18 0.09 0.00 0.00 178.44 178.94 3ddh n LEU 34 N -3.39 4.63 -0.30 1.67 4.77 -0.96 -4.73 117.00 118.69 3ddh n LEU 34 Ca -0.00 -3.29 0.14 0.00 -0.03 0.00 0.00 56.01 52.83 3ddh n LEU 34 Cb 0.40 -0.63 0.31 0.00 -2.33 0.00 0.00 43.42 41.16 3ddh n LEU 34 CO 0.32 0.88 1.02 0.11 -1.33 0.00 0.00 177.39 178.39 3ddh h LYS 35 N 1.82 0.32 0.00 3.23 1.57 -1.51 -1.08 116.57 120.93 3ddh h LYS 35 Ca 0.15 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3ddh h LYS 35 Cb 1.78 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 34.02 3ddh h LYS 35 CO 0.43 0.21 0.07 -1.35 -0.57 0.00 0.00 179.45 178.25 3ddh h PRO 36 N 0.33 0.00 -0.20 3.15 0.11 -1.89 -3.10 132.00 130.40 3ddh h PRO 36 Ca 0.57 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.68 3ddh h PRO 36 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3ddh h PRO 36 CO -0.57 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 177.88 3ddh n TYR 37 N -2.81 0.25 0.00 0.65 4.01 -0.41 -5.06 117.16 113.79 3ddh n TYR 37 Ca -0.02 -0.22 0.00 0.00 -0.16 0.00 0.00 57.90 57.50 3ddh n TYR 37 Cb 0.13 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.15 3ddh n TYR 37 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ddh n GLY 38 N 0.77 2.69 3.69 2.72 0.00 -1.17 -4.90 105.19 108.99 3ddh n GLY 38 Ca 0.11 -1.19 -0.30 0.00 0.00 0.00 0.00 46.02 44.64 3ddh n GLY 38 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ddh s THR 39 N -2.00 2.56 0.18 2.61 -4.23 -1.26 -4.52 115.64 108.97 3ddh s THR 39 Ca 0.00 0.18 -0.14 0.00 -1.18 0.00 0.00 61.69 60.55 3ddh s THR 39 Cb 0.00 -2.59 0.07 0.00 1.34 0.00 0.00 72.50 71.31 3ddh s THR 39 CO 0.00 -0.24 1.84 -1.28 -0.54 0.00 0.00 174.62 174.40 3ddh h SER 40 N -1.67 0.61 -0.74 3.99 0.87 -1.97 0.09 113.55 114.73 3ddh h SER 40 Ca -0.50 -0.01 0.10 0.00 -1.23 0.00 0.00 61.79 60.15 3ddh h SER 40 Cb 1.29 -0.15 -0.07 0.00 -0.44 0.00 0.00 62.40 63.02 3ddh h SER 40 CO 0.53 0.44 0.37 0.50 -0.53 0.00 0.00 176.83 178.15 3ddh h LYS 41 N 0.72 0.60 -0.51 2.24 3.64 -1.99 0.15 116.57 121.43 3ddh h LYS 41 Ca 0.20 -0.04 -0.09 0.00 -1.27 0.00 0.00 60.65 59.45 3ddh h LYS 41 Cb -0.08 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.59 3ddh h LYS 41 CO -0.05 0.40 -0.04 0.93 -2.27 0.00 0.00 179.45 178.42 3ddh h GLU 42 N 0.62 0.92 -0.35 1.90 5.08 -1.67 -0.78 114.58 120.31 3ddh h GLU 42 Ca 0.37 -0.31 -0.10 0.00 -1.00 0.00 0.00 59.36 58.32 3ddh h GLU 42 Cb 0.41 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 3ddh h GLU 42 CO -0.28 0.97 -0.17 0.82 -1.00 0.00 0.00 179.01 179.35 3ddh h ILE 43 N 0.79 1.29 -0.48 3.13 1.08 -0.50 -1.41 117.51 121.40 3ddh h ILE 43 Ca 0.14 -1.28 -0.01 0.00 -0.39 0.00 0.00 64.86 63.32 3ddh h ILE 43 Cb 0.58 1.38 -0.02 0.00 -3.07 0.00 0.00 36.82 35.68 3ddh h ILE 43 CO 0.03 0.42 0.25 0.28 -0.69 0.00 0.00 178.15 178.44 3ddh h SER 44 N 0.50 0.58 -0.41 1.72 0.02 -0.86 -0.53 113.55 114.58 3ddh h SER 44 Ca 0.08 -0.04 -0.12 0.00 -0.84 0.00 0.00 61.79 60.87 3ddh h SER 44 Cb 0.70 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 63.08 3ddh h SER 44 CO 0.05 0.48 -0.20 0.00 -1.14 0.00 0.00 176.83 176.03 3ddh h ALA 45 N 1.61 0.57 -0.54 3.77 0.00 -0.86 -1.04 119.26 122.77 3ddh h ALA 45 Ca 0.17 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 3ddh h ALA 45 Cb 0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3ddh h ALA 45 CO -0.03 0.53 -0.13 0.00 0.00 0.00 0.00 179.25 179.63 3ddh h ALA 46 N 0.82 0.76 -0.48 0.00 0.00 -0.82 -1.82 119.26 117.72 3ddh h ALA 46 Ca 0.09 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 3ddh h ALA 46 Cb 0.75 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 3ddh h ALA 46 CO 0.06 0.67 0.15 1.25 0.00 0.00 0.00 179.25 181.38 3ddh h LEU 47 N 0.91 0.70 -0.73 0.00 5.85 -1.03 -2.10 115.31 118.91 3ddh h LEU 47 Ca 0.14 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.62 3ddh h LEU 47 Cb 0.70 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 3ddh h LEU 47 CO 0.05 0.72 0.36 0.15 -0.34 0.00 0.00 178.44 179.39 3ddh h PHE 48 N 0.64 1.04 -0.63 1.25 3.57 -1.07 -0.45 116.94 121.29 3ddh h PHE 48 Ca 0.15 -0.05 0.08 0.00 3.53 0.00 0.00 57.97 61.69 3ddh h PHE 48 Cb 0.28 -0.33 -0.06 0.00 2.79 0.00 0.00 35.95 38.63 3ddh h PHE 48 CO 0.01 0.76 0.29 0.37 -2.23 0.00 0.00 178.31 177.52 3ddh h GLN 49 N 1.02 0.51 -0.21 1.11 4.15 -1.17 -2.84 115.11 117.68 3ddh h GLN 49 Ca 0.25 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.62 3ddh h GLN 49 Cb 0.10 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 3ddh h GLN 49 CO -0.03 0.34 0.04 1.15 -1.93 0.00 0.00 178.83 178.40 3ddh h THR 50 N 0.53 1.22 0.00 2.39 2.02 -0.78 0.92 112.91 119.20 3ddh h THR 50 Ca 0.30 -0.70 0.00 0.00 0.77 0.00 0.00 66.41 66.78 3ddh h THR 50 Cb 0.30 1.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 3ddh h THR 50 CO -0.25 0.22 0.00 -0.62 0.37 0.00 0.00 175.52 175.24 3ddh n GLU 51 N -4.75 0.00 0.00 6.66 1.02 -0.23 -0.64 120.64 122.70 3ddh n GLU 51 Ca -0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.10 3ddh n GLU 51 Cb 0.18 -0.86 0.00 0.00 -0.02 0.00 0.00 31.44 30.74 3ddh n GLU 51 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3ddh n ASN 53 N 0.13 0.00 -0.58 1.62 3.02 0.31 -1.62 115.26 118.15 3ddh n ASN 53 Ca 0.00 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.68 3ddh n ASN 53 Cb 0.00 0.00 0.40 0.00 -0.61 0.00 0.00 39.78 39.57 3ddh n ASN 53 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3ddh n ASN 54 N 0.00 1.83 -0.23 6.41 3.02 0.19 -4.59 115.26 121.89 3ddh n ASN 54 Ca 0.00 -1.58 -0.06 0.00 -0.03 0.00 0.00 54.58 52.92 3ddh n ASN 54 Cb 0.00 0.02 0.04 0.00 -0.61 0.00 0.00 39.78 39.23 3ddh n ASN 54 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3ddh h LEU 55 N 2.83 0.75 -1.80 3.41 5.85 -1.56 0.12 115.31 124.90 3ddh h LEU 55 Ca 0.00 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.68 3ddh h LEU 55 Cb 0.62 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3ddh h LEU 55 CO 0.00 0.56 0.00 1.56 -0.34 0.00 0.00 178.44 180.22 3ddh h GLN 56 N 0.86 0.00 0.00 1.25 1.08 -1.89 -0.04 115.11 116.37 3ddh h GLN 56 Ca 0.23 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.28 3ddh h GLN 56 Cb -0.06 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.34 3ddh h GLN 56 CO -0.05 0.00 -1.56 0.44 -0.95 0.00 0.00 178.83 176.72 3ddh n ILE 57 N -3.06 0.56 -0.06 2.54 -5.35 -0.88 -4.77 119.36 108.34 3ddh n ILE 57 Ca -0.00 -0.33 -0.06 0.00 -0.27 0.00 0.00 62.75 62.09 3ddh n ILE 57 Cb 0.25 -0.80 -0.15 0.00 -1.74 0.00 0.00 39.64 37.20 3ddh n ILE 57 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 3ddh n LEU 58 N -2.36 0.20 0.00 7.28 4.77 0.35 -5.07 117.00 122.17 3ddh n LEU 58 Ca -0.14 0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 3ddh n LEU 58 Cb 0.75 0.34 0.00 0.00 -2.33 0.00 0.00 43.42 42.18 3ddh n LEU 58 CO 0.16 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 3ddh n GLY 59 N 1.62 2.18 3.71 -0.72 0.00 -0.03 -4.67 105.19 107.27 3ddh n GLY 59 Ca -0.24 -0.54 -0.23 0.00 0.00 0.00 0.00 46.02 45.01 3ddh n GLY 59 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ddh s TYR 60 N 0.00 2.75 0.00 1.61 2.02 -1.26 -4.81 117.35 117.66 3ddh s TYR 60 Ca 0.00 -0.29 0.00 0.00 -0.37 0.00 0.00 57.07 56.41 3ddh s TYR 60 Cb 0.00 -1.43 0.00 0.00 -0.40 0.00 0.00 41.96 40.13 3ddh s TYR 60 CO 0.00 0.48 0.00 0.41 -1.57 0.00 0.00 175.55 174.87 3ddh n GLY 61 N -1.05 1.76 0.30 0.71 0.00 -1.26 -4.29 105.19 101.36 3ddh n GLY 61 Ca -0.05 -2.16 -0.07 0.00 0.00 0.00 0.00 46.02 43.73 3ddh n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ddh h ALA 62 N 0.00 0.92 -0.26 4.61 0.00 -1.97 -0.01 119.26 122.56 3ddh h ALA 62 Ca 0.00 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 3ddh h ALA 62 Cb 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3ddh h ALA 62 CO 0.00 0.64 0.02 0.87 0.00 0.00 0.00 179.25 180.78 3ddh h LYS 63 N 0.88 0.45 -0.32 0.00 1.57 -1.91 -0.13 116.57 117.11 3ddh h LYS 63 Ca 0.16 -0.13 0.05 0.00 -1.87 0.00 0.00 60.65 58.85 3ddh h LYS 63 Cb 0.55 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.77 3ddh h LYS 63 CO 0.03 0.59 0.07 0.00 -0.57 0.00 0.00 179.45 179.57 3ddh h ALA 64 N 0.84 0.34 -0.60 3.86 0.00 -1.78 -1.81 119.26 120.11 3ddh h ALA 64 Ca 0.08 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.07 3ddh h ALA 64 Cb 0.38 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 3ddh h ALA 64 CO 0.01 -0.34 0.37 0.35 0.00 0.00 0.00 179.25 179.64 3ddh h PHE 65 N 0.18 0.69 -0.19 0.00 3.57 -0.78 -1.55 116.94 118.86 3ddh h PHE 65 Ca 0.15 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.67 3ddh h PHE 65 Cb 0.16 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.67 3ddh h PHE 65 CO -0.17 0.39 0.12 1.15 -2.23 0.00 0.00 178.31 177.57 3ddh h THR 66 N 0.72 1.04 -0.56 4.41 2.02 -0.78 -2.95 112.91 116.80 3ddh h THR 66 Ca 0.24 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.33 3ddh h THR 66 Cb 0.02 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 67.17 3ddh h THR 66 CO -0.10 0.04 0.35 0.40 0.37 0.00 0.00 175.52 176.58 3ddh h ILE 67 N 0.24 1.16 0.00 3.11 2.04 -1.01 -1.70 117.51 121.36 3ddh h ILE 67 Ca 0.07 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.58 3ddh h ILE 67 Cb -0.02 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.44 3ddh h ILE 67 CO -0.02 0.17 0.00 -1.20 0.00 0.00 0.00 178.15 177.09 3ddh n SER 68 N -4.66 1.16 0.00 1.72 7.64 -0.61 -0.98 113.62 117.89 3ddh n SER 68 Ca 0.03 -0.94 0.00 0.00 1.01 0.00 0.00 58.87 58.98 3ddh n SER 68 Cb 0.05 -0.22 0.00 0.00 -1.01 0.00 0.00 64.21 63.02 3ddh n SER 68 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3ddh n VAL 70 N 1.29 0.00 -0.21 0.44 0.31 -0.64 -0.85 118.33 118.67 3ddh n VAL 70 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 3ddh n VAL 70 Cb 0.14 0.00 0.05 0.00 -0.91 0.00 0.00 33.84 33.12 3ddh n VAL 70 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3ddh h GLU 71 N 0.00 0.73 -0.58 5.55 5.08 -1.33 -0.64 114.58 123.39 3ddh h GLU 71 Ca 0.00 -0.04 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 3ddh h GLU 71 Cb 0.00 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 3ddh h GLU 71 CO 0.00 0.49 0.00 1.15 -1.00 0.00 0.00 179.01 179.65 3ddh h THR 72 N 0.76 1.26 -0.32 1.13 2.02 -1.25 0.48 112.91 116.99 3ddh h THR 72 Ca 0.23 -1.12 0.00 0.00 0.77 0.00 0.00 66.41 66.29 3ddh h THR 72 Cb -0.02 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 3ddh h THR 72 CO -0.08 0.41 0.21 0.00 0.37 0.00 0.00 175.52 176.43 3ddh h ALA 73 N 1.06 0.41 -0.66 6.16 0.00 -1.70 0.65 119.26 125.19 3ddh h ALA 73 Ca 0.17 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 3ddh h ALA 73 Cb 0.54 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3ddh h ALA 73 CO 0.03 -0.13 0.28 -0.07 0.00 0.00 0.00 179.25 179.36 3ddh h LEU 74 N 0.44 0.89 0.13 0.00 3.38 -0.78 -2.59 115.31 116.78 3ddh h LEU 74 Ca 0.12 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 3ddh h LEU 74 Cb -0.05 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.47 3ddh h LEU 74 CO -0.03 0.80 -0.06 -0.61 0.09 0.00 0.00 178.44 178.63 3ddh h GLN 75 N 0.92 -0.17 0.00 1.13 5.75 -0.62 0.46 115.11 122.57 3ddh h GLN 75 Ca 0.22 0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.71 3ddh h GLN 75 Cb 0.17 0.04 -0.00 0.00 1.07 0.00 0.00 27.48 28.76 3ddh h GLN 75 CO -0.02 0.12 -0.10 0.97 -2.65 0.00 0.00 178.83 177.15 3ddh h ILE 76 N -0.47 0.27 -0.23 2.39 2.10 -0.88 -1.77 117.51 118.93 3ddh h ILE 76 Ca -0.02 -0.78 0.00 0.00 1.08 0.00 0.00 64.86 65.14 3ddh h ILE 76 Cb 0.38 1.61 0.00 0.00 -1.09 0.00 0.00 36.82 37.72 3ddh h ILE 76 CO 0.03 0.10 0.00 -1.54 -1.08 0.00 0.00 178.15 175.66 3ddh n SER 77 N -3.25 2.19 -4.05 2.19 3.41 -0.98 -4.94 113.62 108.20 3ddh n SER 77 Ca 0.00 -1.80 -0.32 0.00 -0.26 0.00 0.00 58.87 56.49 3ddh n SER 77 Cb 0.36 -0.14 -0.00 0.00 -0.26 0.00 0.00 64.21 64.16 3ddh n SER 77 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3ddh n ASN 78 N 0.67 -3.29 -1.05 4.04 3.02 -0.66 -2.22 115.26 115.77 3ddh n ASN 78 Ca 0.17 -0.92 -0.13 0.00 -0.03 0.00 0.00 54.58 53.67 3ddh n ASN 78 Cb 0.41 -3.28 -0.05 0.00 -0.61 0.00 0.00 39.78 36.25 3ddh n ASN 78 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ddh n GLY 79 N -1.60 1.31 0.13 7.41 0.00 0.16 -4.87 105.19 107.73 3ddh n GLY 79 Ca -0.01 -0.40 0.05 0.00 0.00 0.00 0.00 46.02 45.66 3ddh n GLY 79 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ddh n LYS 80 N -2.59 2.80 -1.63 1.61 4.76 -0.94 -5.04 118.16 117.13 3ddh n LYS 80 Ca -0.13 -0.34 -0.40 0.00 -2.87 0.00 0.00 58.31 54.57 3ddh n LYS 80 Cb 0.45 -1.04 0.03 0.00 -1.84 0.00 0.00 35.03 32.62 3ddh n LYS 80 CO 0.00 0.00 0.00 1.51 -1.37 0.00 0.00 177.40 177.54 3ddh n ILE 81 N -0.70 2.98 -2.07 -0.18 3.06 -1.26 -4.90 119.36 116.30 3ddh n ILE 81 Ca 0.03 -0.50 -0.40 0.00 -2.50 0.00 0.00 62.75 59.38 3ddh n ILE 81 Cb 0.19 -1.25 -0.01 0.00 0.54 0.00 0.00 39.64 39.11 3ddh n ILE 81 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 3ddh s ALA 82 N -1.36 3.36 0.34 1.51 0.00 -1.26 -4.90 121.76 119.45 3ddh s ALA 82 Ca 0.68 1.26 0.02 0.00 0.00 0.00 0.00 51.96 53.91 3ddh s ALA 82 Cb -0.49 -3.49 0.60 0.00 0.00 0.00 0.00 23.12 19.75 3ddh s ALA 82 CO 0.53 -0.77 1.98 0.00 0.00 0.00 0.00 175.76 177.51 3ddh h ALA 83 N 2.95 1.54 0.00 0.00 0.00 -2.00 -1.51 119.26 120.24 3ddh h ALA 83 Ca -0.49 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 3ddh h ALA 83 Cb 1.24 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 3ddh h ALA 83 CO 0.64 0.40 -0.07 0.22 0.00 0.00 0.00 179.25 180.44 3ddh h ASP 84 N 0.92 0.00 -0.40 0.00 3.58 -1.99 -0.59 116.42 117.94 3ddh h ASP 84 Ca 0.28 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.60 3ddh h ASP 84 Cb -0.02 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.02 3ddh h ASP 84 CO -0.07 0.07 -0.22 0.40 -2.88 0.00 0.00 179.24 176.55 3ddh h ILE 85 N 0.00 1.27 -0.89 2.25 1.08 -1.65 -1.64 117.51 117.93 3ddh h ILE 85 Ca -0.00 -1.36 -0.01 0.00 -0.39 0.00 0.00 64.86 63.10 3ddh h ILE 85 Cb 0.13 1.15 -0.04 0.00 -3.07 0.00 0.00 36.82 34.99 3ddh h ILE 85 CO 0.01 0.46 0.51 0.40 -0.69 0.00 0.00 178.15 178.84 3ddh h ILE 86 N 0.78 1.25 -0.53 -0.67 1.08 -1.00 -0.36 117.51 118.07 3ddh h ILE 86 Ca 0.10 -0.60 -0.03 0.00 -0.39 0.00 0.00 64.86 63.94 3ddh h ILE 86 Cb 0.77 0.03 -0.02 0.00 -3.07 0.00 0.00 36.82 34.52 3ddh h ILE 86 CO 0.06 0.28 0.21 -0.09 -0.69 0.00 0.00 178.15 177.92 3ddh h ARG 87 N 1.24 0.79 -0.86 2.37 2.43 -1.00 -1.30 114.38 118.06 3ddh h ARG 87 Ca 0.32 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 3ddh h ARG 87 Cb -0.00 -0.13 -0.04 0.00 -0.42 0.00 0.00 29.97 29.38 3ddh h ARG 87 CO -0.05 0.69 0.48 1.96 -1.51 0.00 0.00 179.97 181.54 3ddh h GLN 88 N 0.71 1.18 -0.47 0.20 4.20 -0.92 -1.34 115.11 118.69 3ddh h GLN 88 Ca 0.18 -0.13 -0.08 0.00 0.06 0.00 0.00 58.65 58.68 3ddh h GLN 88 Cb 0.20 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 3ddh h GLN 88 CO -0.01 0.86 -0.01 0.82 -0.67 0.00 0.00 178.83 179.81 3ddh h ILE 89 N 1.19 1.26 -0.70 2.54 2.04 -0.45 -0.53 117.51 122.87 3ddh h ILE 89 Ca 0.30 -1.08 -0.07 0.00 1.00 0.00 0.00 64.86 65.01 3ddh h ILE 89 Cb 0.01 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 3ddh h ILE 89 CO -0.05 0.37 0.16 0.58 0.00 0.00 0.00 178.15 179.21 3ddh h VAL 90 N 0.69 1.26 -0.89 1.67 2.07 -1.11 -1.87 116.25 118.07 3ddh h VAL 90 Ca 0.13 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.65 3ddh h VAL 90 Cb 0.52 0.56 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 3ddh h VAL 90 CO 0.03 0.38 0.52 0.44 0.02 0.00 0.00 177.57 178.95 3ddh h ASP 91 N 1.06 1.08 -0.51 0.57 3.32 -0.88 -1.58 116.42 119.49 3ddh h ASP 91 Ca 0.22 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 3ddh h ASP 91 Cb 0.39 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 3ddh h ASP 91 CO 0.01 0.84 0.28 -0.07 -1.72 0.00 0.00 179.24 178.58 3ddh h LEU 92 N 1.23 0.64 -0.53 1.55 3.38 -0.60 -1.24 115.31 119.74 3ddh h LEU 92 Ca 0.32 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.19 3ddh h LEU 92 Cb -0.02 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.54 3ddh h LEU 92 CO -0.06 0.54 0.33 1.23 0.09 0.00 0.00 178.44 180.57 3ddh h GLY 93 N 0.68 0.77 1.98 0.83 0.00 -1.10 -2.59 103.07 103.63 3ddh h GLY 93 Ca 0.18 -0.31 -0.07 0.00 0.00 0.00 0.00 47.33 47.12 3ddh h GLY 93 CO -0.03 0.30 -0.33 0.50 0.00 0.00 0.00 176.54 176.98 3ddh h LYS 94 N 0.71 0.03 -0.89 4.80 1.57 -1.10 -2.00 116.57 119.69 3ddh h LYS 94 Ca 0.19 -0.01 0.11 0.00 -1.87 0.00 0.00 60.65 59.07 3ddh h LYS 94 Cb -0.03 -0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.22 3ddh h LYS 94 CO -0.04 0.36 0.57 0.66 -0.57 0.00 0.00 179.45 180.43 3ddh h SER 95 N 0.02 0.77 -0.73 0.86 4.64 -0.83 -1.84 113.55 116.45 3ddh h SER 95 Ca 0.00 0.03 0.03 0.00 -0.47 0.00 0.00 61.79 61.38 3ddh h SER 95 Cb 0.60 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 62.52 3ddh h SER 95 CO 0.04 0.44 0.48 -0.07 -0.87 0.00 0.00 176.83 176.86 3ddh h LEU 96 N 0.85 0.78 0.00 5.97 3.38 -1.26 -1.48 115.31 123.55 3ddh h LEU 96 Ca 0.42 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3ddh h LEU 96 Cb 0.47 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3ddh h LEU 96 CO -0.19 0.54 0.00 0.18 0.09 0.00 0.00 178.44 179.06 3ddh n LEU 97 N -4.45 0.00 -4.03 1.67 4.77 -0.70 -4.99 117.00 109.26 3ddh n LEU 97 Ca 0.09 0.43 -0.31 0.00 -0.03 0.00 0.00 56.01 56.19 3ddh n LEU 97 Cb 0.11 -0.43 -0.16 0.00 -2.33 0.00 0.00 43.42 40.60 3ddh n LEU 97 CO 0.35 -0.14 -0.49 -0.54 -1.33 0.00 0.00 177.39 175.24 3ddh s LYS 98 N -2.86 2.40 0.08 3.23 1.02 -0.56 -5.00 119.74 118.06 3ddh s LYS 98 Ca 0.13 -0.62 0.08 0.00 0.02 0.00 0.00 55.97 55.57 3ddh s LYS 98 Cb 0.13 -2.20 -0.04 0.00 -0.52 0.00 0.00 37.83 35.20 3ddh s LYS 98 CO 0.34 -0.24 -0.17 -1.25 -0.92 0.00 0.00 175.35 173.11 3ddh s PRO 100 N 1.45 1.95 -0.32 -1.68 0.04 -1.26 -5.07 135.00 130.11 3ddh s PRO 100 Ca 0.05 -1.08 -0.15 0.00 0.04 0.00 0.00 61.00 59.87 3ddh s PRO 100 Cb -0.13 -2.17 -0.02 0.00 0.04 0.00 0.00 34.50 32.21 3ddh s PRO 100 CO -0.11 0.51 0.34 0.42 0.04 0.00 0.00 177.00 178.20 3ddh s ILE 101 N -1.07 5.19 -0.34 0.56 -1.09 -1.26 -4.99 121.20 118.20 3ddh s ILE 101 Ca 0.17 0.17 -0.02 0.00 -2.23 0.00 0.00 60.65 58.74 3ddh s ILE 101 Cb -0.11 -3.75 0.07 0.00 -1.58 0.00 0.00 42.46 37.09 3ddh s ILE 101 CO 0.09 0.01 0.08 -1.61 -1.23 0.00 0.00 174.94 172.27 3ddh s GLU 102 N 1.99 2.24 0.55 2.79 2.02 -1.26 -4.92 118.70 122.11 3ddh s GLU 102 Ca 0.12 -1.48 -0.21 0.00 0.02 0.00 0.00 54.97 53.42 3ddh s GLU 102 Cb -0.16 -3.34 -0.05 0.00 0.10 0.00 0.00 34.13 30.68 3ddh s GLU 102 CO 0.11 -0.79 1.27 -0.51 0.02 0.00 0.00 175.26 175.35 3ddh s LEU 103 N 1.20 3.81 0.63 1.80 1.43 -1.26 -1.84 118.68 124.45 3ddh s LEU 103 Ca 0.00 2.54 -0.09 0.00 -1.03 0.00 0.00 54.13 55.56 3ddh s LEU 103 Cb -0.21 -4.39 -0.00 0.00 0.03 0.00 0.00 46.19 41.62 3ddh s LEU 103 CO -0.02 -1.47 0.98 -0.76 0.23 0.00 0.00 176.35 175.31 3ddh s LEU 104 N -3.65 3.15 0.22 1.79 1.43 -0.37 -4.81 118.68 116.44 3ddh s LEU 104 Ca 0.73 1.00 -0.32 0.00 -1.03 0.00 0.00 54.13 54.51 3ddh s LEU 104 Cb -0.35 -3.86 -0.13 0.00 0.03 0.00 0.00 46.19 41.88 3ddh s LEU 104 CO 0.40 -1.09 1.47 -2.65 0.23 0.00 0.00 176.35 174.72 3ddh n PRO 105 N -2.73 2.12 -0.43 1.29 -0.02 -1.26 -2.45 135.00 131.51 3ddh n PRO 105 Ca 0.05 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.29 3ddh n PRO 105 Cb 0.57 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 3ddh n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ddh n GLY 106 N 2.54 1.76 0.18 -1.23 0.00 -1.26 -3.81 105.19 103.37 3ddh n GLY 106 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 3ddh n GLY 106 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ddh h VAL 107 N 0.00 0.78 -0.46 1.61 2.07 -1.83 -1.73 116.25 116.68 3ddh h VAL 107 Ca 0.00 -0.33 0.03 0.00 0.82 0.00 0.00 66.70 67.22 3ddh h VAL 107 Cb 0.00 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 30.70 3ddh h VAL 107 CO 0.00 0.07 0.24 0.50 0.02 0.00 0.00 177.57 178.40 3ddh h LYS 108 N -0.54 0.47 -0.36 1.57 3.64 -1.91 -1.77 116.57 117.68 3ddh h LYS 108 Ca -0.04 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.22 3ddh h LYS 108 Cb 0.40 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.09 3ddh h LYS 108 CO 0.06 0.31 -0.19 1.05 -2.27 0.00 0.00 179.45 178.41 3ddh h GLU 109 N 0.48 0.67 0.24 1.90 4.11 -1.95 -1.96 114.58 118.07 3ddh h GLU 109 Ca 0.20 -0.24 -0.01 0.00 0.07 0.00 0.00 59.36 59.37 3ddh h GLU 109 Cb 0.08 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.29 3ddh h GLU 109 CO -0.13 0.82 -0.11 1.15 0.07 0.00 0.00 179.01 180.81 3ddh h THR 110 N 0.60 0.82 -0.65 -1.06 2.02 -1.02 -1.67 112.91 111.96 3ddh h THR 110 Ca 0.09 -0.40 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 3ddh h THR 110 Cb 0.65 1.06 -0.03 0.00 -1.74 0.00 0.00 68.15 68.09 3ddh h THR 110 CO 0.05 0.09 0.26 -0.07 0.37 0.00 0.00 175.52 176.21 3ddh h LEU 111 N -0.52 0.90 -0.35 2.58 3.38 -1.27 -0.41 115.31 119.61 3ddh h LEU 111 Ca -0.03 -0.17 0.04 0.00 0.09 0.00 0.00 57.88 57.80 3ddh h LEU 111 Cb 0.39 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 3ddh h LEU 111 CO 0.05 0.83 0.12 0.50 0.09 0.00 0.00 178.44 180.03 3ddh h LYS 112 N 0.91 0.27 -0.52 1.13 3.64 -1.38 0.12 116.57 120.74 3ddh h LYS 112 Ca 0.22 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.54 3ddh h LYS 112 Cb 0.21 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 3ddh h LYS 112 CO -0.02 0.18 0.16 1.15 -2.27 0.00 0.00 179.45 178.65 3ddh h THR 113 N 0.27 1.23 -0.39 1.00 2.02 -0.93 -0.49 112.91 115.62 3ddh h THR 113 Ca 0.16 -0.78 -0.03 0.00 0.77 0.00 0.00 66.41 66.52 3ddh h THR 113 Cb 0.12 0.76 -0.02 0.00 -1.74 0.00 0.00 68.15 67.28 3ddh h THR 113 CO -0.16 0.29 0.12 -0.07 0.37 0.00 0.00 175.52 176.07 3ddh h LEU 114 N 0.71 0.58 -0.39 2.58 3.38 -0.85 -2.37 115.31 118.94 3ddh h LEU 114 Ca 0.17 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 57.98 3ddh h LEU 114 Cb 0.28 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 3ddh h LEU 114 CO -0.00 0.63 0.11 0.50 0.09 0.00 0.00 178.44 179.77 3ddh h LYS 115 N 0.49 0.25 0.00 1.13 1.63 -0.49 -2.56 116.57 117.01 3ddh h LYS 115 Ca 0.13 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.88 3ddh h LYS 115 Cb 0.27 -0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 31.84 3ddh h LYS 115 CO -0.00 0.16 -0.13 0.93 -3.45 0.00 0.00 179.45 176.96 3ddh h GLU 116 N 0.26 0.00 -0.21 1.90 5.08 -0.90 -0.87 114.58 119.83 3ddh h GLU 116 Ca 0.18 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.47 3ddh h GLU 116 Cb 0.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.42 3ddh h GLU 116 CO -0.21 0.13 -0.18 1.79 -1.00 0.00 0.00 179.01 179.54 3ddh h THR 117 N 0.00 1.23 -0.36 1.13 1.35 -1.00 -3.47 112.91 111.79 3ddh h THR 117 Ca -0.00 -1.03 -0.16 0.00 -0.55 0.00 0.00 66.41 64.67 3ddh h THR 117 Cb 0.39 1.26 -0.06 0.00 -1.73 0.00 0.00 68.15 68.01 3ddh h THR 117 CO 0.02 0.33 -0.14 0.61 -0.25 0.00 0.00 175.52 176.08 3ddh n GLY 118 N -0.63 0.86 0.09 5.82 0.00 -0.33 -4.88 105.19 106.13 3ddh n GLY 118 Ca -0.00 -0.18 -0.12 0.00 0.00 0.00 0.00 46.02 45.73 3ddh n GLY 118 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3ddh h LYS 119 N 0.15 0.07 -6.75 1.61 3.64 -1.84 -3.48 116.57 109.97 3ddh h LYS 119 Ca -0.16 -0.12 -0.69 0.00 -1.27 0.00 0.00 60.65 58.42 3ddh h LYS 119 Cb 0.83 0.04 -0.24 0.00 -0.41 0.00 0.00 32.23 32.46 3ddh h LYS 119 CO 0.23 0.68 -0.86 0.71 -2.27 0.00 0.00 179.45 177.95 3ddh s TYR 120 N -2.59 2.39 0.08 1.91 2.02 -1.26 -4.92 117.35 114.97 3ddh s TYR 120 Ca -0.09 -0.36 -0.28 0.00 -0.37 0.00 0.00 57.07 55.98 3ddh s TYR 120 Cb 0.08 -1.37 -0.06 0.00 -0.40 0.00 0.00 41.96 40.21 3ddh s TYR 120 CO 0.81 0.23 0.88 0.21 -1.57 0.00 0.00 175.55 176.11 3ddh s LYS 121 N -1.56 4.61 -0.15 -0.62 2.20 -0.04 -4.93 119.74 119.24 3ddh s LYS 121 Ca 0.13 1.28 0.01 0.00 -0.36 0.00 0.00 55.97 57.04 3ddh s LYS 121 Cb -0.10 -3.37 0.00 0.00 -1.51 0.00 0.00 37.83 32.85 3ddh s LYS 121 CO 0.04 0.24 -0.17 -0.51 -0.36 0.00 0.00 175.35 174.59 3ddh s LEU 122 N 0.01 2.35 0.12 5.43 1.43 -1.26 -0.63 118.68 126.12 3ddh s LEU 122 Ca 0.43 -0.52 0.04 0.00 -1.03 0.00 0.00 54.13 53.05 3ddh s LEU 122 Cb -0.22 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 3ddh s LEU 122 CO 0.27 0.07 -0.10 0.68 0.23 0.00 0.00 176.35 177.50 3ddh s VAL 123 N 0.87 1.00 -0.15 -1.59 -7.23 -0.67 0.14 120.40 112.78 3ddh s VAL 123 Ca -0.05 -1.84 -0.15 0.00 -1.81 0.00 0.00 61.98 58.13 3ddh s VAL 123 Cb -0.15 -1.59 -0.05 0.00 0.56 0.00 0.00 36.38 35.15 3ddh s VAL 123 CO -0.02 -0.67 0.34 -0.69 -0.31 0.00 0.00 175.10 173.76 3ddh s VAL 124 N -2.93 5.27 -0.30 1.32 1.01 -0.85 -0.40 120.40 123.52 3ddh s VAL 124 Ca 0.11 0.66 0.03 0.00 0.00 0.00 0.00 61.98 62.78 3ddh s VAL 124 Cb 0.00 -3.68 0.08 0.00 0.00 0.00 0.00 36.38 32.78 3ddh s VAL 124 CO -0.00 0.38 -0.03 0.00 0.00 0.00 0.00 175.10 175.44 3ddh s ALA 125 N 0.47 2.73 -0.01 5.51 0.00 0.46 -0.32 121.76 130.59 3ddh s ALA 125 Ca 0.19 -2.14 -0.05 0.00 0.00 0.00 0.00 51.96 49.96 3ddh s ALA 125 Cb -0.14 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.21 3ddh s ALA 125 CO 0.06 -1.44 0.10 -0.08 0.00 0.00 0.00 175.76 174.40 3ddh s THR 126 N 1.01 0.07 0.83 0.00 -1.32 -0.80 -3.93 115.64 111.48 3ddh s THR 126 Ca 0.01 -0.54 -0.12 0.00 -1.21 0.00 0.00 61.69 59.83 3ddh s THR 126 Cb -0.20 -0.33 0.11 0.00 -1.51 0.00 0.00 72.50 70.58 3ddh s THR 126 CO -0.07 -0.30 1.18 -0.54 -2.21 0.00 0.00 174.62 172.69 3ddh s LYS 127 N -1.00 1.62 0.00 7.08 1.02 -1.26 -4.17 119.74 123.03 3ddh s LYS 127 Ca -0.11 -0.16 0.00 0.00 0.02 0.00 0.00 55.97 55.72 3ddh s LYS 127 Cb -0.06 -1.98 0.00 0.00 -0.52 0.00 0.00 37.83 35.27 3ddh s LYS 127 CO 0.01 -1.75 0.00 0.41 -0.92 0.00 0.00 175.35 173.09 3ddh n GLY 128 N -3.35 -0.05 3.70 -3.33 0.00 -1.26 -4.96 105.19 95.94 3ddh n GLY 128 Ca 0.10 -2.28 -0.42 0.00 0.00 0.00 0.00 46.02 43.43 3ddh n GLY 128 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ddh s ASP 129 N -3.39 6.98 0.13 1.61 1.01 -1.26 -4.89 116.67 116.86 3ddh s ASP 129 Ca 0.00 2.04 -0.19 0.00 0.71 0.00 0.00 52.55 55.11 3ddh s ASP 129 Cb 0.00 -2.57 -0.01 0.00 1.01 0.00 0.00 42.92 41.35 3ddh s ASP 129 CO 0.00 -0.59 1.72 0.25 0.21 0.00 0.00 175.17 176.77 3ddh h LEU 130 N 7.53 -0.05 -0.60 1.23 5.85 -1.97 -1.18 115.31 126.11 3ddh h LEU 130 Ca -0.39 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.38 3ddh h LEU 130 Cb 1.19 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.27 3ddh h LEU 130 CO 0.86 0.01 0.37 0.25 -0.34 0.00 0.00 178.44 179.59 3ddh h LEU 131 N 0.10 0.72 0.13 2.25 5.85 -1.99 0.18 115.31 122.55 3ddh h LEU 131 Ca 0.11 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.78 3ddh h LEU 131 Cb 0.13 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.97 3ddh h LEU 131 CO -0.17 0.56 -0.10 -0.78 -0.34 0.00 0.00 178.44 177.61 3ddh h ASP 132 N 0.82 -0.26 -0.60 1.25 3.58 -1.90 0.92 116.42 120.22 3ddh h ASP 132 Ca 0.22 0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.68 3ddh h ASP 132 Cb -0.04 0.09 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 3ddh h ASP 132 CO -0.04 -0.16 0.33 1.56 -2.88 0.00 0.00 179.24 178.05 3ddh h GLN 133 N -0.24 0.83 -0.62 0.28 1.08 -1.10 0.15 115.11 115.50 3ddh h GLN 133 Ca -0.00 -0.09 0.06 0.00 -1.45 0.00 0.00 58.65 57.16 3ddh h GLN 133 Cb 0.22 -0.16 -0.05 0.00 -0.05 0.00 0.00 27.48 27.43 3ddh h GLN 133 CO -0.01 0.63 0.32 0.93 -0.95 0.00 0.00 178.83 179.75 3ddh h GLU 134 N 0.81 0.57 -0.30 1.46 5.08 -0.73 -1.74 114.58 119.73 3ddh h GLU 134 Ca 0.21 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.44 3ddh h GLU 134 Cb 0.04 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 3ddh h GLU 134 CO -0.03 0.38 -0.21 -0.91 -1.00 0.00 0.00 179.01 177.24 3ddh h ASN 135 N 0.59 0.70 -0.63 1.42 2.35 -0.36 -2.00 115.58 117.65 3ddh h ASN 135 Ca 0.28 -0.44 0.07 0.00 -0.55 0.00 0.00 56.30 55.66 3ddh h ASN 135 Cb 0.21 -0.20 -0.06 0.00 0.05 0.00 0.00 38.32 38.32 3ddh h ASN 135 CO -0.20 0.99 0.32 0.11 -1.65 0.00 0.00 177.43 177.01 3ddh h LYS 136 N 0.42 0.58 -0.40 0.81 1.57 -0.80 -1.36 116.57 117.38 3ddh h LYS 136 Ca 0.06 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 3ddh h LYS 136 Cb 0.75 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 3ddh h LYS 136 CO 0.06 0.38 0.22 1.25 -0.57 0.00 0.00 179.45 180.79 3ddh h LEU 137 N 0.59 0.49 -0.28 2.94 5.85 -1.12 -0.47 115.31 123.31 3ddh h LEU 137 Ca 0.29 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.94 3ddh h LEU 137 Cb 0.23 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.12 3ddh h LEU 137 CO -0.21 0.43 0.18 -0.08 -0.34 0.00 0.00 178.44 178.42 3ddh h GLU 138 N 0.51 0.35 0.00 1.25 4.57 -1.00 -2.39 114.58 117.88 3ddh h GLU 138 Ca 0.14 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.30 3ddh h GLU 138 Cb 0.04 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 28.55 3ddh h GLU 138 CO -0.02 0.23 0.00 2.89 -1.18 0.00 0.00 179.01 180.93 3ddh n ARG 139 N -4.91 0.07 0.26 1.92 1.85 -0.55 -2.67 116.66 112.63 3ddh n ARG 139 Ca -0.02 0.07 0.14 0.00 -1.00 0.00 0.00 57.85 57.04 3ddh n ARG 139 Cb 0.03 -1.58 0.70 0.00 -1.05 0.00 0.00 32.46 30.56 3ddh n ARG 139 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 3ddh h SER 140 N 0.00 0.00 0.00 2.89 4.64 -0.54 -3.47 113.55 117.07 3ddh h SER 140 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3ddh h SER 140 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 3ddh h SER 140 CO 0.00 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 176.69 3ddh n GLY 141 N -0.40 1.39 0.15 -0.77 0.00 -1.09 -4.94 105.19 99.53 3ddh n GLY 141 Ca -0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.15 3ddh n GLY 141 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3ddh n LEU 142 N 0.00 0.64 -0.24 0.99 4.77 -1.24 -4.44 117.00 117.47 3ddh n LEU 142 Ca 0.00 -0.07 0.19 0.00 -0.03 0.00 0.00 56.01 56.10 3ddh n LEU 142 Cb 0.00 -0.17 0.51 0.00 -2.33 0.00 0.00 43.42 41.42 3ddh n LEU 142 CO 0.00 0.12 1.22 0.77 -1.33 0.00 0.00 177.39 178.17 3ddh h SER 143 N 0.74 0.41 0.32 -1.43 4.64 -1.87 -1.96 113.55 114.40 3ddh h SER 143 Ca 0.00 0.04 -0.01 0.00 -0.47 0.00 0.00 61.79 61.35 3ddh h SER 143 Cb 0.41 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 3ddh h SER 143 CO 0.00 0.17 -0.03 -0.65 -0.87 0.00 0.00 176.83 175.44 3ddh h PRO 144 N 0.41 0.00 0.00 4.77 0.11 -1.96 -2.29 132.00 133.04 3ddh h PRO 144 Ca 0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.58 3ddh h PRO 144 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 3ddh h PRO 144 CO -0.18 0.03 -0.42 1.88 -0.21 0.00 0.00 178.00 179.11 3ddh h TYR 145 N 0.00 0.00 -3.28 0.65 0.05 -1.69 -3.47 116.97 109.23 3ddh h TYR 145 Ca -0.00 0.00 -0.64 0.00 0.05 0.00 0.00 58.73 58.14 3ddh h TYR 145 Cb 0.20 0.00 -0.17 0.00 1.01 0.00 0.00 36.73 37.77 3ddh h TYR 145 CO 0.00 0.00 -0.61 -0.06 -1.05 0.00 0.00 178.16 176.44 3ddh s PHE 146 N -3.19 3.16 0.02 4.88 0.08 -0.86 -4.73 117.98 117.33 3ddh s PHE 146 Ca 0.06 -0.00 -0.25 0.00 0.12 0.00 0.00 56.93 56.86 3ddh s PHE 146 Cb 0.11 -1.95 -0.18 0.00 -0.57 0.00 0.00 43.02 40.43 3ddh s PHE 146 CO 0.69 0.20 1.41 0.22 -0.10 0.00 0.00 175.22 177.65 3ddh h ASP 147 N 6.19 -0.08 -2.38 1.36 1.82 -0.61 -3.48 116.42 119.25 3ddh h ASP 147 Ca -0.39 -0.27 0.10 0.00 -0.39 0.00 0.00 57.03 56.07 3ddh h ASP 147 Cb 1.18 0.02 -0.02 0.00 0.68 0.00 0.00 39.33 41.20 3ddh h ASP 147 CO 0.63 0.23 0.45 0.00 -1.61 0.00 0.00 179.24 178.94 3ddh n HIS 148 N -4.99 -1.47 -4.06 0.28 1.44 -1.25 -5.07 115.22 100.10 3ddh n HIS 148 Ca -0.08 -1.22 -0.35 0.00 -2.01 0.00 0.00 57.72 54.06 3ddh n HIS 148 Cb 0.19 0.60 -0.11 0.00 0.12 0.00 0.00 29.99 30.79 3ddh n HIS 148 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 3ddh s ILE 149 N -2.15 4.54 -0.38 0.61 1.01 -1.26 -2.01 121.20 121.55 3ddh s ILE 149 Ca 0.18 -0.12 -0.10 0.00 0.00 0.00 0.00 60.65 60.61 3ddh s ILE 149 Cb -0.03 -3.05 0.04 0.00 0.01 0.00 0.00 42.46 39.43 3ddh s ILE 149 CO 0.06 0.45 0.21 -0.70 0.00 0.00 0.00 174.94 174.97 3ddh s GLU 150 N 0.53 2.77 0.69 2.79 2.56 0.57 -4.95 118.70 123.66 3ddh s GLU 150 Ca 0.02 -1.17 -0.03 0.00 0.00 0.00 0.00 54.97 53.79 3ddh s GLU 150 Cb -0.13 -3.73 0.09 0.00 2.00 0.00 0.00 34.13 32.36 3ddh s GLU 150 CO 0.01 -0.76 0.97 0.08 -0.56 0.00 0.00 175.26 175.00 3ddh s VAL 151 N 1.52 2.29 0.00 3.70 1.01 -1.26 -1.91 120.40 125.76 3ddh s VAL 151 Ca 0.02 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.50 3ddh s VAL 151 Cb -0.20 -2.79 0.00 0.00 0.00 0.00 0.00 36.38 33.39 3ddh s VAL 151 CO 0.06 0.00 0.00 -1.54 0.00 0.00 0.00 175.10 173.62 3ddh n SER 153 N -2.80 2.90 -3.50 3.32 3.41 -1.26 -4.94 113.62 110.76 3ddh n SER 153 Ca 0.12 -0.19 -0.05 0.00 -0.26 0.00 0.00 58.87 58.49 3ddh n SER 153 Cb 0.60 0.96 0.00 0.00 -0.26 0.00 0.00 64.21 65.52 3ddh n SER 153 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3ddh s ASP 154 N -1.54 -0.10 -0.56 4.04 -1.08 -1.26 -4.76 116.67 111.41 3ddh s ASP 154 Ca 0.00 -0.66 0.06 0.00 -0.52 0.00 0.00 52.55 51.43 3ddh s ASP 154 Cb 0.00 0.60 0.30 0.00 -1.46 0.00 0.00 42.92 42.36 3ddh s ASP 154 CO 0.00 -1.16 0.80 0.29 0.52 0.00 0.00 175.17 175.63 3ddh n LYS 155 N -0.54 2.45 -3.99 4.34 5.02 -1.26 -4.73 118.16 119.44 3ddh n LYS 155 Ca -0.05 -4.45 -0.25 0.00 -2.02 0.00 0.00 58.31 51.54 3ddh n LYS 155 Cb 0.60 -2.08 -0.05 0.00 -0.02 0.00 0.00 35.03 33.48 3ddh n LYS 155 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3ddh s THR 156 N -3.13 2.16 0.25 -0.18 -4.23 -1.26 -4.77 115.64 104.47 3ddh s THR 156 Ca 0.43 -1.59 -0.03 0.00 -1.18 0.00 0.00 61.69 59.32 3ddh s THR 156 Cb 0.23 -2.75 0.22 0.00 1.34 0.00 0.00 72.50 71.54 3ddh s THR 156 CO -0.08 0.00 1.79 -0.33 -0.54 0.00 0.00 174.62 175.46 3ddh h GLU 157 N 1.17 0.68 -0.52 3.99 5.08 -1.97 -1.95 114.58 121.07 3ddh h GLU 157 Ca -0.41 -0.04 0.10 0.00 -1.00 0.00 0.00 59.36 58.01 3ddh h GLU 157 Cb 1.27 -0.15 -0.10 0.00 0.50 0.00 0.00 28.75 30.26 3ddh h GLU 157 CO 0.64 0.45 -0.19 -0.22 -1.00 0.00 0.00 179.01 178.70 3ddh h LYS 158 N 0.70 -0.06 -0.16 2.33 3.64 -1.97 0.21 116.57 121.26 3ddh h LYS 158 Ca 0.42 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.67 3ddh h LYS 158 Cb 0.49 0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 3ddh h LYS 158 CO -0.30 -0.04 -0.50 0.93 -2.27 0.00 0.00 179.45 177.27 3ddh h GLU 159 N -0.07 0.43 -0.43 1.90 3.07 -1.69 -2.18 114.58 115.62 3ddh h GLU 159 Ca 0.24 -0.25 -0.10 0.00 -0.50 0.00 0.00 59.36 58.76 3ddh h GLU 159 Cb 0.44 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.36 3ddh h GLU 159 CO -0.57 0.83 -0.15 1.88 -1.40 0.00 0.00 179.01 179.61 3ddh h TYR 160 N 0.34 0.89 -0.79 4.33 0.05 -0.84 -1.13 116.97 119.82 3ddh h TYR 160 Ca 0.02 -0.18 -0.01 0.00 0.05 0.00 0.00 58.73 58.61 3ddh h TYR 160 Cb 0.99 -0.22 -0.04 0.00 1.01 0.00 0.00 36.73 38.47 3ddh h TYR 160 CO 0.03 0.89 0.46 -0.07 -1.05 0.00 0.00 178.16 178.43 3ddh h LEU 161 N 0.72 0.96 -0.38 3.88 3.38 -0.40 0.93 115.31 124.39 3ddh h LEU 161 Ca 0.11 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3ddh h LEU 161 Cb 0.64 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 3ddh h LEU 161 CO 0.05 0.75 0.06 -0.09 0.09 0.00 0.00 178.44 179.29 3ddh h ARG 162 N 1.10 0.64 -0.24 1.13 2.43 -1.07 -0.79 114.38 117.57 3ddh h ARG 162 Ca 0.28 -0.17 0.04 0.00 -0.81 0.00 0.00 59.98 59.32 3ddh h ARG 162 Cb -0.02 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.42 3ddh h ARG 162 CO -0.05 0.70 0.01 1.25 -1.51 0.00 0.00 179.97 180.37 3ddh h LEU 163 N 0.48 -0.08 -0.91 3.80 5.85 -0.70 -1.02 115.31 122.73 3ddh h LEU 163 Ca 0.12 0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.91 3ddh h LEU 163 Cb 0.38 0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.44 3ddh h LEU 163 CO 0.01 -0.01 0.60 -0.07 -0.34 0.00 0.00 178.44 178.63 3ddh h LEU 164 N 0.08 1.01 -0.27 2.25 3.38 -0.53 -1.48 115.31 119.75 3ddh h LEU 164 Ca 0.11 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.05 3ddh h LEU 164 Cb 0.14 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3ddh h LEU 164 CO -0.18 0.71 0.10 -1.28 0.09 0.00 0.00 178.44 177.88 3ddh h SER 165 N 1.18 0.37 -1.00 -0.43 0.87 -0.73 -0.58 113.55 113.23 3ddh h SER 165 Ca 0.35 -0.17 0.03 0.00 -1.23 0.00 0.00 61.79 60.77 3ddh h SER 165 Cb -0.05 -0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 61.76 3ddh h SER 165 CO -0.10 0.44 0.66 0.40 -0.53 0.00 0.00 176.83 177.70 3ddh h ILE 166 N 0.28 1.20 -0.00 2.23 2.04 -0.90 -0.42 117.51 121.95 3ddh h ILE 166 Ca 0.09 -0.45 0.00 0.00 1.00 0.00 0.00 64.86 65.50 3ddh h ILE 166 Cb 0.19 -0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.06 3ddh h ILE 166 CO -0.01 0.24 -0.03 0.18 0.00 0.00 0.00 178.15 178.53 3ddh n LEU 167 N -4.42 0.11 -3.61 1.44 4.77 -0.58 -4.93 117.00 109.79 3ddh n LEU 167 Ca 0.13 0.18 -0.24 0.00 -0.03 0.00 0.00 56.01 56.05 3ddh n LEU 167 Cb 0.06 -0.22 0.08 0.00 -2.33 0.00 0.00 43.42 41.01 3ddh n LEU 167 CO 0.35 0.02 0.23 0.00 -1.33 0.00 0.00 177.39 176.67 3ddh n GLN 168 N -1.17 -7.75 -4.30 3.23 6.02 -0.17 -5.01 117.38 108.24 3ddh n GLN 168 Ca 0.16 0.82 -0.16 0.00 -0.01 0.00 0.00 57.00 57.80 3ddh n GLN 168 Cb 0.23 -5.86 -0.10 0.00 1.02 0.00 0.00 30.24 25.53 3ddh n GLN 168 CO 0.00 0.00 0.00 0.96 -1.01 0.00 0.00 177.06 177.01 3ddh s ILE 169 N -3.32 0.75 0.45 5.09 -4.36 -0.74 -5.04 121.20 114.03 3ddh s ILE 169 Ca 0.56 -2.00 -0.03 0.00 -0.26 0.00 0.00 60.65 58.91 3ddh s ILE 169 Cb -0.25 -2.38 -0.03 0.00 1.25 0.00 0.00 42.46 41.06 3ddh s ILE 169 CO 0.74 -0.26 0.72 0.00 0.24 0.00 0.00 174.94 176.38 3ddh s ALA 170 N -3.61 3.51 0.37 2.27 0.00 -1.26 -4.44 121.76 118.60 3ddh s ALA 170 Ca 0.30 -0.69 0.13 0.00 0.00 0.00 0.00 51.96 51.70 3ddh s ALA 170 Cb 0.07 -2.42 0.93 0.00 0.00 0.00 0.00 23.12 21.70 3ddh s ALA 170 CO 0.09 -0.31 1.83 -1.35 0.00 0.00 0.00 175.76 176.02 3ddh h PRO 171 N 0.34 0.55 0.00 0.00 0.11 -1.89 -1.51 132.00 129.60 3ddh h PRO 171 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ddh h PRO 171 Cb 1.22 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.20 3ddh h PRO 171 CO 0.61 0.37 0.00 -1.13 -0.21 0.00 0.00 178.00 177.64 3ddh n SER 172 N -4.59 0.00 -1.01 -2.05 3.41 -1.24 -1.88 113.62 106.26 3ddh n SER 172 Ca 0.20 -0.01 0.12 0.00 -0.26 0.00 0.00 58.87 58.92 3ddh n SER 172 Cb 0.62 -0.28 0.21 0.00 -0.26 0.00 0.00 64.21 64.49 3ddh n SER 172 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3ddh n GLU 173 N -1.28 2.34 -4.33 4.33 1.02 -0.57 -4.40 120.64 117.74 3ddh n GLU 173 Ca 0.10 -2.00 -0.34 0.00 -0.02 0.00 0.00 57.16 54.90 3ddh n GLU 173 Cb 0.16 -1.49 -0.12 0.00 -0.02 0.00 0.00 31.44 29.98 3ddh n GLU 173 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 3ddh s LEU 174 N -1.70 3.33 0.00 -4.62 2.96 -0.79 -0.87 118.68 116.99 3ddh s LEU 174 Ca 0.35 -0.10 0.03 0.00 -0.22 0.00 0.00 54.13 54.18 3ddh s LEU 174 Cb 0.21 -1.81 0.03 0.00 0.50 0.00 0.00 46.19 45.13 3ddh s LEU 174 CO 0.31 0.17 0.27 -0.11 -1.32 0.00 0.00 176.35 175.66 3ddh n LEU 175 N 3.55 0.00 -3.29 -0.68 7.94 -0.57 -1.35 117.00 122.60 3ddh n LEU 175 Ca -0.17 -3.07 0.03 0.00 -1.11 0.00 0.00 56.01 51.69 3ddh n LEU 175 Cb 0.52 0.11 -0.04 0.00 0.53 0.00 0.00 43.42 44.54 3ddh n LEU 175 CO 0.33 -0.55 0.87 -0.69 -1.11 0.00 0.00 177.39 176.24 3ddh s VAL 177 N -2.83 -0.13 0.16 1.96 1.01 0.09 -0.45 120.40 120.21 3ddh s VAL 177 Ca 0.20 0.00 -0.24 0.00 0.00 0.00 0.00 61.98 61.94 3ddh s VAL 177 Cb -0.02 -1.00 0.07 0.00 0.00 0.00 0.00 36.38 35.43 3ddh s VAL 177 CO 0.13 0.00 1.00 -0.83 0.00 0.00 0.00 175.10 175.40 3ddh s GLY 178 N 1.98 -0.14 0.18 4.51 0.00 -0.69 -0.82 107.32 112.33 3ddh s GLY 178 Ca -0.01 0.02 0.23 0.00 0.00 0.00 0.00 44.72 44.95 3ddh s GLY 178 CO -0.16 0.63 1.10 3.45 0.00 0.00 0.00 173.10 178.12 3ddh h ASN 179 N 2.00 0.00 -3.64 1.64 -1.07 -1.82 -1.78 115.58 110.92 3ddh h ASN 179 Ca -0.26 -0.06 -0.69 0.00 0.07 0.00 0.00 56.30 55.36 3ddh h ASN 179 Cb 1.23 0.00 -0.20 0.00 -2.07 0.00 0.00 38.32 37.27 3ddh h ASN 179 CO 0.29 0.03 -0.47 -0.55 0.07 0.00 0.00 177.43 176.79 3ddh s SER 180 N -5.09 6.00 0.16 6.14 0.15 -1.26 -4.42 113.70 115.38 3ddh s SER 180 Ca 0.01 -0.61 -0.15 0.00 0.70 0.00 0.00 55.95 55.90 3ddh s SER 180 Cb 0.10 -2.12 0.04 0.00 -1.71 0.00 0.00 66.02 62.33 3ddh s SER 180 CO 0.78 -0.30 1.80 0.15 1.20 0.00 0.00 173.24 176.87 3ddh h PHE 181 N 8.51 0.63 -0.30 3.44 3.57 -1.95 0.22 116.94 131.06 3ddh h PHE 181 Ca -0.30 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.19 3ddh h PHE 181 Cb 1.14 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 3ddh h PHE 181 CO 0.62 0.43 0.15 -0.22 -2.23 0.00 0.00 178.31 177.06 3ddh h LYS 182 N 0.65 0.44 0.01 1.11 3.64 -1.93 0.27 116.57 120.75 3ddh h LYS 182 Ca 0.17 -0.06 -0.37 0.00 -1.27 0.00 0.00 60.65 59.12 3ddh h LYS 182 Cb -0.02 -0.08 -0.06 0.00 -0.41 0.00 0.00 32.23 31.66 3ddh h LYS 182 CO -0.03 0.41 -2.31 0.43 -2.27 0.00 0.00 179.45 175.67 3ddh n SER 183 N -4.78 1.17 -0.04 4.20 7.64 -1.19 -4.30 113.62 116.33 3ddh n SER 183 Ca -0.02 0.01 -0.07 0.00 1.01 0.00 0.00 58.87 59.80 3ddh n SER 183 Cb 0.10 0.09 -0.14 0.00 -1.01 0.00 0.00 64.21 63.25 3ddh n SER 183 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3ddh n ASP 184 N -3.08 0.53 -0.03 6.43 8.00 0.75 -4.72 116.55 124.43 3ddh n ASP 184 Ca -0.37 0.25 -0.05 0.00 0.71 0.00 0.00 54.79 55.33 3ddh n ASP 184 Cb 1.06 0.42 -0.02 0.00 -0.02 0.00 0.00 41.12 42.57 3ddh n ASP 184 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3ddh n ILE 185 N -2.89 1.32 -0.21 0.53 2.08 -1.03 -4.53 119.36 114.64 3ddh n ILE 185 Ca -0.21 0.25 -0.00 0.00 0.56 0.00 0.00 62.75 63.35 3ddh n ILE 185 Cb 1.04 -2.01 0.07 0.00 -0.75 0.00 0.00 39.64 37.99 3ddh n ILE 185 CO 0.00 0.00 0.00 1.56 0.56 0.00 0.00 176.55 178.67 3ddh h GLN 186 N -0.57 0.02 -0.56 0.38 4.20 -0.66 -0.87 115.11 117.04 3ddh h GLN 186 Ca 0.00 -0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 3ddh h GLN 186 Cb 0.57 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 3ddh h GLN 186 CO 0.00 0.01 0.06 -1.35 -0.67 0.00 0.00 178.83 176.88 3ddh h PRO 187 N 0.02 0.93 -0.31 1.46 0.11 -1.82 -0.51 132.00 131.88 3ddh h PRO 187 Ca 0.31 -0.24 -0.06 0.00 0.11 0.00 0.00 66.00 66.11 3ddh h PRO 187 Cb 0.49 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.47 3ddh h PRO 187 CO -0.63 0.89 -0.05 0.28 -0.21 0.00 0.00 178.00 178.27 3ddh h VAL 188 N 0.87 1.27 -0.47 3.15 2.07 -1.62 -2.36 116.25 119.16 3ddh h VAL 188 Ca 0.17 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.62 3ddh h VAL 188 Cb 0.43 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 3ddh h VAL 188 CO 0.01 0.35 0.29 -0.07 0.02 0.00 0.00 177.57 178.18 3ddh h LEU 189 N 0.37 0.56 -1.27 2.57 3.38 -0.99 0.37 115.31 120.29 3ddh h LEU 189 Ca 0.08 -0.04 0.11 0.00 0.09 0.00 0.00 57.88 58.12 3ddh h LEU 189 Cb 0.53 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.08 3ddh h LEU 189 CO 0.03 0.43 0.56 -1.28 0.09 0.00 0.00 178.44 178.27 3ddh h SER 190 N 0.63 0.72 1.67 -0.43 0.87 -0.98 -1.79 113.55 114.23 3ddh h SER 190 Ca 0.17 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.76 3ddh h SER 190 Cb -0.03 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 61.81 3ddh h SER 190 CO -0.03 0.41 0.00 -0.07 -0.53 0.00 0.00 176.83 176.61 3ddh h LEU 191 N 0.79 0.00 0.00 2.23 3.38 -1.01 -3.47 115.31 117.23 3ddh h LEU 191 Ca 0.41 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.38 3ddh h LEU 191 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3ddh h LEU 191 CO -0.17 0.00 0.00 0.61 0.09 0.00 0.00 178.44 178.97 3ddh n GLY 192 N 0.79 0.87 1.93 0.83 0.00 -0.67 -4.77 105.19 104.17 3ddh n GLY 192 Ca 0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.94 3ddh n GLY 192 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ddh n GLY 193 N 0.00 0.76 3.58 -0.02 0.00 0.08 -3.66 105.19 105.93 3ddh n GLY 193 Ca 0.00 -2.00 -0.30 0.00 0.00 0.00 0.00 46.02 43.71 3ddh n GLY 193 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ddh s TYR 194 N -1.39 2.77 0.02 1.61 1.51 -0.46 -4.26 117.35 117.14 3ddh s TYR 194 Ca 0.33 -0.13 0.03 0.00 -1.01 0.00 0.00 57.07 56.29 3ddh s TYR 194 Cb -0.02 -1.48 -0.01 0.00 -0.11 0.00 0.00 41.96 40.33 3ddh s TYR 194 CO 0.22 0.40 -0.10 0.20 -1.11 0.00 0.00 175.55 175.16 3ddh s GLY 195 N -1.94 0.54 -0.21 0.71 0.00 -0.28 -4.22 107.32 101.91 3ddh s GLY 195 Ca 0.20 -0.57 0.02 0.00 0.00 0.00 0.00 44.72 44.37 3ddh s GLY 195 CO 0.12 -0.53 -0.15 0.14 0.00 0.00 0.00 173.10 172.68 3ddh s VAL 196 N -0.59 1.99 -0.28 1.40 1.01 -1.26 -1.65 120.40 121.03 3ddh s VAL 196 Ca 0.00 -1.19 -0.16 0.00 0.00 0.00 0.00 61.98 60.63 3ddh s VAL 196 Cb -0.06 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 3ddh s VAL 196 CO 0.00 0.26 0.42 -2.28 0.00 0.00 0.00 175.10 173.50 3ddh s HIS 197 N 1.25 3.24 -0.51 5.22 2.46 0.28 -1.71 115.29 125.52 3ddh s HIS 197 Ca -0.01 0.44 0.04 0.00 0.47 0.00 0.00 55.06 55.99 3ddh s HIS 197 Cb -0.16 -2.65 0.13 0.00 -0.13 0.00 0.00 32.58 29.77 3ddh s HIS 197 CO -0.09 -0.28 0.25 0.42 -2.47 0.00 0.00 174.74 172.57 3ddh s ILE 198 N 2.16 2.61 0.45 0.89 1.01 -0.67 -1.41 121.20 126.26 3ddh s ILE 198 Ca 0.17 -3.24 -0.25 0.00 0.00 0.00 0.00 60.65 57.32 3ddh s ILE 198 Cb -0.16 -2.82 -0.08 0.00 0.01 0.00 0.00 42.46 39.42 3ddh s ILE 198 CO 0.10 -0.79 1.40 -2.84 0.00 0.00 0.00 174.94 172.81 3ddh s PRO 199 N -0.20 3.67 -0.25 2.79 0.02 -1.26 -3.92 135.00 135.85 3ddh s PRO 199 Ca 0.17 2.36 -0.09 0.00 0.02 0.00 0.00 61.00 63.46 3ddh s PRO 199 Cb -0.25 -2.63 -0.04 0.00 0.02 0.00 0.00 34.50 31.60 3ddh s PRO 199 CO -0.01 -0.81 0.12 0.12 -0.33 0.00 0.00 177.00 176.09 3ddh s PHE 200 N -1.22 3.19 -0.48 6.54 5.36 -1.26 -5.01 117.98 125.10 3ddh s PHE 200 Ca 0.62 -0.07 -0.14 0.00 -0.96 0.00 0.00 56.93 56.38 3ddh s PHE 200 Cb -0.43 -2.26 0.09 0.00 -0.34 0.00 0.00 43.02 40.09 3ddh s PHE 200 CO 0.54 -0.14 0.39 -1.21 -1.46 0.00 0.00 175.22 173.34 3ddh s GLU 201 N 1.35 2.86 -0.11 10.12 0.41 -1.26 -5.15 118.70 126.92 3ddh s GLU 201 Ca 0.06 -1.50 -0.11 0.00 -0.41 0.00 0.00 54.97 53.01 3ddh s GLU 201 Cb -0.15 -4.09 -0.05 0.00 -1.78 0.00 0.00 34.13 28.07 3ddh s GLU 201 CO 0.06 -1.10 0.24 -2.00 -0.49 0.00 0.00 175.26 171.96 3ddh s GLU 210 N 1.56 3.85 0.34 1.61 2.56 -1.26 -5.08 118.70 122.29 3ddh s GLU 210 Ca 0.04 0.03 0.04 0.00 0.00 0.00 0.00 54.97 55.08 3ddh s GLU 210 Cb -0.26 -3.29 -0.06 0.00 2.00 0.00 0.00 34.13 32.53 3ddh s GLU 210 CO 0.04 0.56 0.06 0.95 -0.56 0.00 0.00 175.26 176.31 3ddh s THR 211 N -0.47 1.15 0.04 -1.70 -4.23 -1.26 -4.92 115.64 104.24 3ddh s THR 211 Ca 0.16 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.67 3ddh s THR 211 Cb -0.13 -2.73 -0.03 0.00 1.34 0.00 0.00 72.50 70.95 3ddh s THR 211 CO 0.05 0.00 -0.04 0.72 -0.54 0.00 0.00 174.62 174.82 3ddh s PHE 212 N -3.25 0.41 0.62 3.99 -0.12 -1.26 -5.16 117.98 113.21 3ddh s PHE 212 Ca 0.34 -0.72 -0.14 0.00 -0.05 0.00 0.00 56.93 56.36 3ddh s PHE 212 Cb 0.08 -0.29 -0.03 0.00 -0.63 0.00 0.00 43.02 42.15 3ddh s PHE 212 CO 0.15 -0.24 1.04 0.00 -0.05 0.00 0.00 175.22 176.12 3ddh s ALA 213 N -2.35 2.81 -0.13 1.99 0.00 -1.26 -5.08 121.76 117.73 3ddh s ALA 213 Ca -0.07 0.20 -0.28 0.00 0.00 0.00 0.00 51.96 51.81 3ddh s ALA 213 Cb -0.03 -3.18 0.07 0.00 0.00 0.00 0.00 23.12 19.98 3ddh s ALA 213 CO -0.04 -0.86 0.67 -1.58 0.00 0.00 0.00 175.76 173.95 3ddh s HIS 214 N -2.77 -0.68 0.53 0.00 2.46 -1.26 -5.04 115.29 108.52 3ddh s HIS 214 Ca 0.60 1.38 0.18 0.00 0.47 0.00 0.00 55.06 57.69 3ddh s HIS 214 Cb -0.14 0.34 1.33 0.00 -0.13 0.00 0.00 32.58 33.99 3ddh s HIS 214 CO 0.44 -0.51 2.15 1.05 -2.47 0.00 0.00 174.74 175.41 3ddh h GLU 215 N 3.82 0.00 -0.70 2.88 4.11 -2.01 -1.12 114.58 121.55 3ddh h GLU 215 Ca -0.28 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.09 3ddh h GLU 215 Cb 1.15 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.36 3ddh h GLU 215 CO 0.27 0.00 0.08 0.54 0.07 0.00 0.00 179.01 179.96 3ddh n ARG 216 N -4.46 3.92 -4.66 1.06 1.74 -1.26 -4.91 116.66 108.10 3ddh n ARG 216 Ca -0.02 -2.58 -0.24 0.00 -0.77 0.00 0.00 57.85 54.24 3ddh n ARG 216 Cb 0.12 -2.11 -0.16 0.00 -1.02 0.00 0.00 32.46 29.29 3ddh n ARG 216 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3ddh s LEU 217 N -2.33 1.87 0.02 0.55 2.96 -0.43 -1.12 118.68 120.21 3ddh s LEU 217 Ca 0.45 -0.28 0.06 0.00 -0.22 0.00 0.00 54.13 54.14 3ddh s LEU 217 Cb 0.35 -0.80 -0.02 0.00 0.50 0.00 0.00 46.19 46.22 3ddh s LEU 217 CO 0.13 0.12 -0.18 -0.54 -1.32 0.00 0.00 176.35 174.56 3ddh s LYS 218 N 0.07 1.30 -0.15 1.98 -0.14 -0.66 -4.56 119.74 117.58 3ddh s LYS 218 Ca -0.03 -0.79 -0.03 0.00 -1.36 0.00 0.00 55.97 53.76 3ddh s LYS 218 Cb -0.10 -1.33 -0.03 0.00 -1.68 0.00 0.00 37.83 34.69 3ddh s LYS 218 CO 0.01 0.35 -0.04 -1.14 -0.76 0.00 0.00 175.35 173.77 3ddh s GLN 219 N -0.90 3.58 0.21 1.68 0.74 -1.26 -0.56 119.66 123.15 3ddh s GLN 219 Ca 0.06 -0.53 0.05 0.00 0.05 0.00 0.00 55.36 54.99 3ddh s GLN 219 Cb -0.08 -2.87 -0.05 0.00 1.10 0.00 0.00 33.01 31.11 3ddh s GLN 219 CO 0.01 0.29 -0.05 0.14 -0.55 0.00 0.00 175.29 175.12 3ddh s VAL 220 N 0.24 1.23 -0.04 1.34 -7.23 -0.50 -4.94 120.40 110.49 3ddh s VAL 220 Ca -0.03 -2.07 -0.16 0.00 -1.81 0.00 0.00 61.98 57.91 3ddh s VAL 220 Cb -0.14 -2.20 -0.31 0.00 0.56 0.00 0.00 36.38 34.29 3ddh s VAL 220 CO 0.03 -0.46 0.77 0.50 -0.31 0.00 0.00 175.10 175.63 3ddh h LYS 221 N 2.53 0.37 -4.17 4.82 3.64 -1.95 -3.37 116.57 118.44 3ddh h LYS 221 Ca -0.38 -0.64 -0.14 0.00 -1.27 0.00 0.00 60.65 58.22 3ddh h LYS 221 Cb 1.22 0.24 -0.17 0.00 -0.41 0.00 0.00 32.23 33.10 3ddh h LYS 221 CO 0.64 1.31 -0.69 -0.98 -2.27 0.00 0.00 179.45 177.46 3ddh s ARG 222 N -2.52 0.52 0.34 1.90 1.70 -1.26 -4.81 118.95 114.81 3ddh s ARG 222 Ca -0.15 -1.02 0.03 0.00 -0.47 0.00 0.00 55.73 54.13 3ddh s ARG 222 Cb 0.04 0.15 0.62 0.00 -0.57 0.00 0.00 34.95 35.19 3ddh s ARG 222 CO 0.85 -0.08 1.93 1.25 -1.08 0.00 0.00 175.30 178.17 3ddh h LEU 223 N 3.66 0.59 -2.36 -1.89 5.85 -1.88 -1.46 115.31 117.82 3ddh h LEU 223 Ca -0.33 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.32 3ddh h LEU 223 Cb 1.16 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 42.04 3ddh h LEU 223 CO 0.57 0.55 0.00 -2.24 -0.34 0.00 0.00 178.44 176.98 3ddh h ASP 224 N 0.65 0.00 0.58 1.25 2.03 -1.79 -0.62 116.42 118.52 3ddh h ASP 224 Ca 0.16 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.46 3ddh h ASP 224 Cb 0.15 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.65 3ddh h ASP 224 CO -0.01 0.00 -0.00 0.44 -1.03 0.00 0.00 179.24 178.64 3ddh h ASP 225 N 0.00 0.00 -0.96 4.15 3.32 -1.65 -2.18 116.42 119.11 3ddh h ASP 225 Ca 0.00 0.00 0.16 0.00 0.02 0.00 0.00 57.03 57.21 3ddh h ASP 225 Cb 0.11 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 39.58 3ddh h ASP 225 CO 0.00 0.00 0.60 0.25 -1.72 0.00 0.00 179.24 178.38 3ddh h LEU 226 N 0.00 0.74 -1.00 1.55 5.85 -1.26 -3.06 115.31 118.13 3ddh h LEU 226 Ca -0.00 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.75 3ddh h LEU 226 Cb 0.29 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.20 3ddh h LEU 226 CO 0.00 0.34 0.38 -0.07 -0.34 0.00 0.00 178.44 178.75 3ddh h LEU 227 N 0.76 0.99 -1.19 2.25 3.38 -1.59 -1.38 115.31 118.53 3ddh h LEU 227 Ca 0.50 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 58.29 3ddh h LEU 227 Cb 0.76 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3ddh h LEU 227 CO -0.27 0.82 -0.36 0.77 0.09 0.00 0.00 178.44 179.50 3ddh h SER 228 N 1.09 0.00 0.83 -0.43 4.64 -1.73 -2.89 113.55 115.06 3ddh h SER 228 Ca 0.27 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.55 3ddh h SER 228 Cb 0.09 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.17 3ddh h SER 228 CO -0.04 0.36 -0.17 -0.07 -0.87 0.00 0.00 176.83 176.04 3ddh h LEU 229 N 0.00 0.00 0.00 5.97 3.38 -1.29 -2.89 115.31 120.48 3ddh h LEU 229 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3ddh h LEU 229 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 3ddh h LEU 229 CO 0.05 0.17 -0.40 -0.07 0.09 0.00 0.00 178.44 178.28 3ddh h LEU 230 N 0.00 0.00 -1.68 1.67 3.38 -1.31 -3.50 115.31 113.87 3ddh h LEU 230 Ca -0.00 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.86 3ddh h LEU 230 Cb 0.63 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.38 3ddh h LEU 230 CO 0.02 0.05 0.00 0.61 0.09 0.00 0.00 178.44 179.22