#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d60 s LEU 3 N 0.00 4.46 0.48 2.39 1.02 -1.26 -5.08 118.68 120.69 2d60 s LEU 3 Ca 0.00 1.12 -0.22 0.00 0.02 0.00 0.00 54.13 55.05 2d60 s LEU 3 Cb 0.00 -2.91 -0.07 0.00 0.02 0.00 0.00 46.19 43.23 2d60 s LEU 3 CO 0.00 0.24 1.15 0.42 0.02 0.00 0.00 176.35 178.19 2d60 s THR 4 N -1.20 3.13 0.23 5.49 -4.23 -1.26 -4.76 115.64 113.04 2d60 s THR 4 Ca 0.30 0.81 -0.01 0.00 -1.18 0.00 0.00 61.69 61.61 2d60 s THR 4 Cb -0.17 -3.39 0.34 0.00 1.34 0.00 0.00 72.50 70.61 2d60 s THR 4 CO 0.18 -0.05 1.22 -2.65 -0.54 0.00 0.00 174.62 172.78 2d60 n PRO 5 N -0.68 -0.06 0.22 3.99 -0.02 -1.26 -0.48 135.00 136.71 2d60 n PRO 5 Ca 0.08 1.18 0.11 0.00 -2.02 0.00 0.00 63.50 62.86 2d60 n PRO 5 Cb 0.49 -1.84 0.34 0.00 -0.02 0.00 0.00 33.50 32.46 2d60 n PRO 5 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2d60 h GLU 6 N 0.00 0.00 0.07 -0.52 9.09 -1.99 -2.04 114.58 119.20 2d60 h GLU 6 Ca 0.44 0.00 -0.28 0.00 0.05 0.00 0.00 59.36 59.57 2d60 h GLU 6 Cb 0.85 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.97 2d60 h GLU 6 CO -0.75 0.13 -1.15 0.93 0.05 0.00 0.00 179.01 178.21 2d60 h GLU 7 N 0.00 0.59 -0.93 1.06 5.08 -1.14 -2.21 114.58 117.04 2d60 h GLU 7 Ca -0.00 -0.74 0.10 0.00 -1.00 0.00 0.00 59.36 57.72 2d60 h GLU 7 Cb 0.89 0.23 -0.08 0.00 0.50 0.00 0.00 28.75 30.29 2d60 h GLU 7 CO 0.02 1.32 0.57 0.87 -1.00 0.00 0.00 179.01 180.79 2d60 h LYS 8 N 0.29 0.92 0.00 2.33 1.57 -0.49 -2.09 116.57 119.10 2d60 h LYS 8 Ca -0.16 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2d60 h LYS 8 Cb 1.82 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.92 2d60 h LYS 8 CO 0.22 0.61 -0.56 0.66 -0.57 0.00 0.00 179.45 179.80 2d60 h SER 9 N 0.95 0.00 -0.40 0.86 4.64 -1.35 -0.95 113.55 117.29 2d60 h SER 9 Ca 0.44 -0.02 -0.14 0.00 -0.47 0.00 0.00 61.79 61.60 2d60 h SER 9 Cb 0.37 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 2d60 h SER 9 CO -0.24 0.01 -0.30 0.00 -0.87 0.00 0.00 176.83 175.44 2d60 h ALA 10 N 2.07 0.58 0.26 5.18 0.00 -1.17 -1.41 119.26 124.76 2d60 h ALA 10 Ca 0.00 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 2d60 h ALA 10 Cb 0.97 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2d60 h ALA 10 CO 0.00 0.62 -0.12 0.28 0.00 0.00 0.00 179.25 180.03 2d60 h VAL 11 N 0.74 0.77 -0.34 0.00 2.07 -1.26 -1.91 116.25 116.30 2d60 h VAL 11 Ca 0.08 -0.12 0.03 0.00 0.82 0.00 0.00 66.70 67.51 2d60 h VAL 11 Cb 0.88 0.83 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2d60 h VAL 11 CO 0.08 0.03 0.17 0.74 0.02 0.00 0.00 177.57 178.60 2d60 h THR 12 N -0.41 0.98 -0.37 2.57 2.02 -1.18 -1.49 112.91 115.03 2d60 h THR 12 Ca -0.04 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.02 2d60 h THR 12 Cb 0.31 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.30 2d60 h THR 12 CO 0.06 0.06 0.19 0.00 0.37 0.00 0.00 175.52 176.21 2d60 h ALA 13 N 1.18 0.47 -0.50 6.16 0.00 -1.23 -2.39 119.26 122.95 2d60 h ALA 13 Ca 0.15 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2d60 h ALA 13 Cb 0.06 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2d60 h ALA 13 CO -0.11 0.01 -0.02 1.25 0.00 0.00 0.00 179.25 180.39 2d60 h LEU 14 N 0.47 0.88 -1.55 0.00 5.85 -1.11 -3.08 115.31 116.77 2d60 h LEU 14 Ca 0.13 -0.32 -0.04 0.00 0.84 0.00 0.00 57.88 58.49 2d60 h LEU 14 Cb 0.08 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.86 2d60 h LEU 14 CO -0.02 0.98 -0.13 -0.25 -0.34 0.00 0.00 178.44 178.68 2d60 h TRP 15 N 0.76 0.12 -0.22 1.25 2.91 -1.09 -1.98 115.95 117.70 2d60 h TRP 15 Ca 0.14 -0.01 0.06 0.00 1.13 0.00 0.00 58.89 60.21 2d60 h TRP 15 Cb 0.54 -0.04 -0.01 0.00 -0.51 0.00 0.00 29.16 29.15 2d60 h TRP 15 CO 0.04 0.26 0.36 0.78 -1.03 0.00 0.00 178.44 178.85 2d60 h GLY 16 N 0.60 0.00 -1.86 2.65 0.00 -1.34 0.12 103.07 103.25 2d60 h GLY 16 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 2d60 h GLY 16 CO 0.02 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.84 2d60 n LYS 17 N -3.42 2.12 -2.90 4.80 5.02 -0.75 -4.95 118.16 118.08 2d60 n LYS 17 Ca 0.03 -1.92 -0.41 0.00 -2.02 0.00 0.00 58.31 53.99 2d60 n LYS 17 Cb 0.48 -1.43 -0.04 0.00 -0.02 0.00 0.00 35.03 34.01 2d60 n LYS 17 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2d60 s VAL 18 N -1.66 4.88 -0.44 -0.18 1.01 0.40 -4.98 120.40 119.43 2d60 s VAL 18 Ca 0.29 1.59 -0.29 0.00 0.00 0.00 0.00 61.98 63.56 2d60 s VAL 18 Cb 0.19 -4.12 0.02 0.00 0.00 0.00 0.00 36.38 32.47 2d60 s VAL 18 CO 0.28 0.00 1.34 0.21 0.00 0.00 0.00 175.10 176.93 2d60 s ASN 19 N 1.21 6.41 0.18 3.32 3.84 -1.26 -4.89 114.94 123.75 2d60 s ASN 19 Ca 0.37 0.71 -0.08 0.00 0.21 0.00 0.00 52.86 54.06 2d60 s ASN 19 Cb -0.16 -2.54 0.09 0.00 -0.55 0.00 0.00 41.25 38.08 2d60 s ASN 19 CO 0.11 -1.40 1.61 0.58 -2.79 0.00 0.00 177.10 175.21 2d60 h VAL 20 N 6.41 1.27 0.14 -5.21 2.07 -1.94 -1.54 116.25 117.44 2d60 h VAL 20 Ca -0.26 -1.28 -0.00 0.00 0.82 0.00 0.00 66.70 65.98 2d60 h VAL 20 Cb 1.09 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.87 2d60 h VAL 20 CO 1.10 0.45 -0.11 0.44 0.02 0.00 0.00 177.57 179.47 2d60 h ASP 21 N 0.86 -0.28 0.14 0.57 3.32 -1.90 -0.60 116.42 118.53 2d60 h ASP 21 Ca 0.13 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 2d60 h ASP 21 Cb 0.69 0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.33 2d60 h ASP 21 CO 0.05 -0.17 -0.07 -0.08 -1.72 0.00 0.00 179.24 177.25 2d60 h GLU 22 N -0.25 -0.19 -0.61 3.56 4.81 -1.92 -2.03 114.58 117.95 2d60 h GLU 22 Ca -0.00 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 2d60 h GLU 22 Cb 0.23 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 2d60 h GLU 22 CO -0.01 0.12 0.39 0.28 -0.73 0.00 0.00 179.01 179.06 2d60 h VAL 23 N -0.50 1.17 0.18 0.32 2.07 -1.32 -0.29 116.25 117.88 2d60 h VAL 23 Ca -0.02 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.16 2d60 h VAL 23 Cb 0.39 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 2d60 h VAL 23 CO 0.03 0.17 -0.24 1.23 0.02 0.00 0.00 177.57 178.78 2d60 h GLY 24 N 0.83 -0.49 0.20 2.17 0.00 -1.02 0.47 103.07 105.23 2d60 h GLY 24 Ca 0.22 0.28 0.14 0.00 0.00 0.00 0.00 47.33 47.97 2d60 h GLY 24 CO -0.04 -0.22 0.38 -1.33 0.00 0.00 0.00 176.54 175.33 2d60 h GLY 25 N -0.48 1.28 0.95 4.60 0.00 -1.30 -0.22 103.07 107.90 2d60 h GLY 25 Ca 0.01 -0.21 -0.08 0.00 0.00 0.00 0.00 47.33 47.05 2d60 h GLY 25 CO -0.09 -0.06 -0.08 -2.09 0.00 0.00 0.00 176.54 174.22 2d60 h GLU 26 N 0.55 0.70 -0.13 4.80 4.57 -0.19 -2.26 114.58 122.62 2d60 h GLU 26 Ca 0.44 -0.26 -0.17 0.00 -1.18 0.00 0.00 59.36 58.19 2d60 h GLU 26 Cb 0.64 -0.04 0.01 0.00 -0.16 0.00 0.00 28.75 29.20 2d60 h GLU 26 CO -0.38 0.85 -0.59 0.00 -1.18 0.00 0.00 179.01 177.71 2d60 h ALA 27 N 0.83 0.25 -0.75 2.92 0.00 0.33 -1.76 119.26 121.07 2d60 h ALA 27 Ca 0.09 -0.54 -0.03 0.00 0.00 0.00 0.00 54.91 54.43 2d60 h ALA 27 Cb 0.58 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2d60 h ALA 27 CO 0.03 0.50 0.33 1.25 0.00 0.00 0.00 179.25 181.37 2d60 h LEU 28 N 0.30 1.00 -0.17 0.00 5.85 -1.11 -1.00 115.31 120.17 2d60 h LEU 28 Ca -0.04 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.54 2d60 h LEU 28 Cb 1.23 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 42.00 2d60 h LEU 28 CO 0.12 0.86 0.04 1.23 -0.34 0.00 0.00 178.44 180.36 2d60 h GLY 29 N 1.12 0.30 0.93 3.75 0.00 -1.30 -2.42 103.07 105.46 2d60 h GLY 29 Ca 0.26 -0.19 0.02 0.00 0.00 0.00 0.00 47.33 47.42 2d60 h GLY 29 CO -0.03 0.18 0.64 3.21 0.00 0.00 0.00 176.54 180.54 2d60 h ARG 30 N 0.08 1.23 -0.54 4.80 3.08 -1.21 -0.69 114.38 121.13 2d60 h ARG 30 Ca 0.05 -0.07 0.10 0.00 0.07 0.00 0.00 59.98 60.13 2d60 h ARG 30 Cb 0.28 -0.28 -0.08 0.00 0.08 0.00 0.00 29.97 29.97 2d60 h ARG 30 CO 0.00 0.81 0.09 1.25 -1.07 0.00 0.00 179.97 181.05 2d60 h LEU 31 N 1.27 -0.05 -0.26 3.04 5.85 -0.88 0.48 115.31 124.76 2d60 h LEU 31 Ca 0.37 0.11 -0.05 0.00 0.84 0.00 0.00 57.88 59.15 2d60 h LEU 31 Cb -0.07 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.11 2d60 h LEU 31 CO -0.10 -0.00 -0.25 -0.07 -0.34 0.00 0.00 178.44 177.67 2d60 h LEU 32 N 0.22 0.00 0.02 2.25 4.07 -0.88 0.39 115.31 121.38 2d60 h LEU 32 Ca 0.28 0.00 -0.14 0.00 0.08 0.00 0.00 57.88 58.10 2d60 h LEU 32 Cb 0.40 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.13 2d60 h LEU 32 CO -0.38 0.25 -0.75 0.58 -1.08 0.00 0.00 178.44 177.05 2d60 h VAL 33 N 0.00 1.31 -0.01 1.22 2.07 -0.64 -3.31 116.25 116.90 2d60 h VAL 33 Ca -0.00 -2.29 -0.15 0.00 0.82 0.00 0.00 66.70 65.08 2d60 h VAL 33 Cb 1.10 2.79 -0.02 0.00 -1.52 0.00 0.00 31.29 33.64 2d60 h VAL 33 CO 0.03 0.50 -0.72 0.58 0.02 0.00 0.00 177.57 177.98 2d60 h VAL 34 N -0.89 1.50 -2.27 2.57 2.07 0.00 -3.35 116.25 115.88 2d60 h VAL 34 Ca -0.19 -2.41 -0.58 0.00 0.82 0.00 0.00 66.70 64.33 2d60 h VAL 34 Cb 1.25 2.30 -0.40 0.00 -1.52 0.00 0.00 31.29 32.92 2d60 h VAL 34 CO -0.08 0.69 -0.89 -1.22 0.02 0.00 0.00 177.57 176.10 2d60 n TYR 35 N -3.71 0.91 0.29 1.57 4.01 0.12 -5.00 117.16 115.36 2d60 n TYR 35 Ca -0.01 -3.74 0.17 0.00 -0.16 0.00 0.00 57.90 54.16 2d60 n TYR 35 Cb 0.70 -0.29 0.82 0.00 -0.31 0.00 0.00 39.34 40.26 2d60 n TYR 35 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2d60 h PRO 36 N 4.61 0.00 0.00 -0.72 0.13 -1.71 -0.49 132.00 133.82 2d60 h PRO 36 Ca 0.16 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.28 2d60 h PRO 36 Cb 0.82 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.95 2d60 h PRO 36 CO 0.56 0.00 -0.06 0.11 -0.23 0.00 0.00 178.00 178.39 2d60 h TRP 37 N 0.00 0.00 0.00 1.56 0.09 -1.91 -2.11 115.95 113.58 2d60 h TRP 37 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 2d60 h TRP 37 Cb 0.19 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.43 2d60 h TRP 37 CO 0.00 0.06 0.00 1.79 0.09 0.00 0.00 178.44 180.38 2d60 h THR 38 N 0.00 0.00 0.00 0.12 1.35 -1.39 -1.86 112.91 111.13 2d60 h THR 38 Ca -0.00 -0.11 0.00 0.00 -0.55 0.00 0.00 66.41 65.75 2d60 h THR 38 Cb 0.17 0.90 0.00 0.00 -1.73 0.00 0.00 68.15 67.49 2d60 h THR 38 CO 0.01 0.00 0.03 0.00 -0.25 0.00 0.00 175.52 175.31 2d60 n GLN 39 N -2.70 0.12 0.33 4.72 6.02 -0.79 -2.64 117.38 122.44 2d60 n GLN 39 Ca -0.01 0.62 0.21 0.00 -0.01 0.00 0.00 57.00 57.81 2d60 n GLN 39 Cb 0.11 -1.94 1.14 0.00 1.02 0.00 0.00 30.24 30.58 2d60 n GLN 39 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 2d60 h ARG 40 N 0.00 0.00 -0.01 -1.09 0.11 -1.56 -0.01 114.38 111.82 2d60 h ARG 40 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2d60 h ARG 40 Cb 0.06 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.14 2d60 h ARG 40 CO 0.00 0.00 -0.29 1.19 0.10 0.00 0.00 179.97 180.97 2d60 n PHE 41 N -3.27 0.00 -2.35 4.08 3.01 -1.08 -4.33 117.46 113.52 2d60 n PHE 41 Ca -0.03 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.32 2d60 n PHE 41 Cb 0.08 -0.11 0.04 0.00 -0.01 0.00 0.00 39.48 39.48 2d60 n PHE 41 CO 0.00 0.00 0.00 1.19 1.01 0.00 0.00 176.76 178.96 2d60 n PHE 42 N -0.59 1.85 -0.21 1.38 3.01 -0.02 -4.84 117.46 118.04 2d60 n PHE 42 Ca 0.12 -2.06 0.19 0.00 1.01 0.00 0.00 57.45 56.70 2d60 n PHE 42 Cb 0.36 -0.28 0.53 0.00 -0.01 0.00 0.00 39.48 40.08 2d60 n PHE 42 CO 0.00 0.00 0.00 0.93 1.01 0.00 0.00 176.76 178.70 2d60 h GLU 43 N 2.23 0.36 -0.25 -1.08 4.39 -1.75 -1.82 114.58 116.66 2d60 h GLU 43 Ca 0.11 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.79 2d60 h GLU 43 Cb 1.42 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.98 2d60 h GLU 43 CO 0.45 0.24 0.00 -1.13 -1.16 0.00 0.00 179.01 177.41 2d60 n SER 44 N -4.48 1.80 -0.17 1.42 3.41 -1.26 -4.36 113.62 109.97 2d60 n SER 44 Ca 0.18 -1.83 0.14 0.00 -0.26 0.00 0.00 58.87 57.10 2d60 n SER 44 Cb 0.67 -0.16 0.59 0.00 -0.26 0.00 0.00 64.21 65.05 2d60 n SER 44 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 2d60 n PHE 45 N 0.43 0.00 -1.07 7.33 0.99 -0.68 -5.01 117.46 119.44 2d60 n PHE 45 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.60 2d60 n PHE 45 Cb 0.32 -0.14 0.00 0.00 -1.00 0.00 0.00 39.48 38.66 2d60 n PHE 45 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2d60 n GLY 46 N 1.26 -0.15 3.67 1.37 0.00 -1.26 -4.67 105.19 105.41 2d60 n GLY 46 Ca 0.15 -1.64 -0.42 0.00 0.00 0.00 0.00 46.02 44.11 2d60 n GLY 46 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2d60 s ASP 47 N -4.00 6.88 -0.05 1.61 3.68 -1.26 -4.89 116.67 118.64 2d60 s ASP 47 Ca 0.00 1.95 0.14 0.00 2.13 0.00 0.00 52.55 56.78 2d60 s ASP 47 Cb 0.00 -2.55 0.27 0.00 -1.45 0.00 0.00 42.92 39.20 2d60 s ASP 47 CO 0.00 -0.75 1.12 0.18 0.13 0.00 0.00 175.17 175.85 2d60 n LEU 48 N 6.09 1.14 0.19 -1.34 4.77 -1.26 -4.25 117.00 122.35 2d60 n LEU 48 Ca 0.14 -2.14 0.09 0.00 -0.03 0.00 0.00 56.01 54.07 2d60 n LEU 48 Cb 0.44 -0.14 0.13 0.00 -2.33 0.00 0.00 43.42 41.52 2d60 n LEU 48 CO 0.58 0.60 0.70 0.77 -1.33 0.00 0.00 177.39 178.70 2d60 h SER 49 N 0.55 0.00 -5.14 -1.43 4.64 -1.92 -3.44 113.55 106.81 2d60 h SER 49 Ca -0.09 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.09 2d60 h SER 49 Cb 1.48 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.41 2d60 h SER 49 CO 0.04 0.18 -0.68 0.42 -0.87 0.00 0.00 176.83 175.91 2d60 s THR 50 N -3.14 0.28 0.23 2.95 -4.23 -1.26 -5.04 115.64 105.44 2d60 s THR 50 Ca 0.06 -1.80 -0.10 0.00 -1.18 0.00 0.00 61.69 58.68 2d60 s THR 50 Cb 0.06 -1.50 0.25 0.00 1.34 0.00 0.00 72.50 72.65 2d60 s THR 50 CO 0.69 -0.96 1.64 -0.65 -0.54 0.00 0.00 174.62 174.80 2d60 h PRO 51 N 3.18 0.08 -0.34 3.99 0.11 -1.98 0.47 132.00 137.51 2d60 h PRO 51 Ca -0.34 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.68 2d60 h PRO 51 Cb 1.15 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2d60 h PRO 51 CO 0.65 0.05 -0.14 -0.44 -0.21 0.00 0.00 178.00 177.91 2d60 h ASP 52 N 0.08 0.58 -0.21 -2.05 3.32 -1.99 0.58 116.42 116.74 2d60 h ASP 52 Ca 0.36 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 57.18 2d60 h ASP 52 Cb 0.61 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 39.99 2d60 h ASP 52 CO -0.63 0.75 -0.13 0.00 -1.72 0.00 0.00 179.24 177.51 2d60 h ALA 53 N 1.31 0.30 0.07 3.45 0.00 -1.75 -1.84 119.26 120.80 2d60 h ALA 53 Ca 0.09 -0.31 0.01 0.00 0.00 0.00 0.00 54.91 54.70 2d60 h ALA 53 Cb 0.56 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2d60 h ALA 53 CO 0.04 0.17 -0.09 0.28 0.00 0.00 0.00 179.25 179.64 2d60 h VAL 54 N 0.15 0.78 -0.44 0.00 2.07 -0.48 -1.21 116.25 117.11 2d60 h VAL 54 Ca 0.04 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.46 2d60 h VAL 54 Cb 0.64 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 2d60 h VAL 54 CO 0.04 0.00 -0.15 0.24 0.02 0.00 0.00 177.57 177.71 2d60 h MET 55 N -0.20 0.83 -0.00 1.57 2.07 -0.82 -2.81 114.93 115.57 2d60 h MET 55 Ca 0.01 -0.31 0.00 0.00 -2.07 0.00 0.00 59.70 57.33 2d60 h MET 55 Cb 0.20 -0.05 0.00 0.00 -1.87 0.00 0.00 31.60 29.88 2d60 h MET 55 CO -0.04 0.93 -0.17 0.41 1.07 0.00 0.00 176.91 179.11 2d60 n GLY 56 N -0.32 -0.97 3.64 8.32 0.00 -0.70 -4.81 105.19 110.35 2d60 n GLY 56 Ca 0.01 -0.29 -0.46 0.00 0.00 0.00 0.00 46.02 45.28 2d60 n GLY 56 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2d60 n ASN 57 N -1.01 3.45 0.04 1.61 2.85 -0.46 -4.88 115.26 116.86 2d60 n ASN 57 Ca 0.12 0.77 0.03 0.00 -0.11 0.00 0.00 54.58 55.39 2d60 n ASN 57 Cb 0.30 -1.42 0.40 0.00 1.24 0.00 0.00 39.78 40.29 2d60 n ASN 57 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2d60 h PRO 58 N 10.83 0.44 -0.16 1.20 0.13 -1.90 -1.17 132.00 141.38 2d60 h PRO 58 Ca -0.45 -0.06 -0.15 0.00 -0.87 0.00 0.00 66.00 64.46 2d60 h PRO 58 Cb 1.26 -0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 2d60 h PRO 58 CO 0.96 0.39 -0.54 0.87 -0.23 0.00 0.00 178.00 179.45 2d60 h LYS 59 N 0.44 0.48 -0.24 0.86 1.57 -1.90 -0.14 116.57 117.64 2d60 h LYS 59 Ca 0.11 -0.30 -0.01 0.00 -1.87 0.00 0.00 60.65 58.58 2d60 h LYS 59 Cb 0.14 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 2d60 h LYS 59 CO -0.01 0.90 0.12 0.28 -0.57 0.00 0.00 179.45 180.17 2d60 h VAL 60 N 0.37 1.14 -0.72 0.50 2.07 -1.77 -0.97 116.25 116.87 2d60 h VAL 60 Ca 0.01 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 2d60 h VAL 60 Cb 1.07 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 31.76 2d60 h VAL 60 CO 0.10 0.13 0.38 0.11 0.02 0.00 0.00 177.57 178.32 2d60 h LYS 61 N 0.26 1.02 -0.14 1.57 1.57 -1.09 0.16 116.57 119.92 2d60 h LYS 61 Ca 0.08 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 2d60 h LYS 61 Cb 0.11 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 2d60 h LYS 61 CO -0.01 0.77 0.04 0.00 -0.57 0.00 0.00 179.45 179.68 2d60 h ALA 62 N 1.19 0.19 -0.30 3.86 0.00 -0.89 -1.15 119.26 122.16 2d60 h ALA 62 Ca 0.25 -0.14 -0.17 0.00 0.00 0.00 0.00 54.91 54.86 2d60 h ALA 62 Cb 0.06 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 2d60 h ALA 62 CO -0.04 -0.18 -0.48 1.25 0.00 0.00 0.00 179.25 179.81 2d60 h HIS 63 N 0.04 0.99 -0.79 0.00 -0.00 -0.97 -2.47 115.15 111.96 2d60 h HIS 63 Ca 0.05 -0.33 0.09 0.00 -0.00 0.00 0.00 60.37 60.18 2d60 h HIS 63 Cb 0.25 -0.20 -0.07 0.00 -0.00 0.00 0.00 27.41 27.39 2d60 h HIS 63 CO 0.01 1.13 0.44 0.78 -0.00 0.00 0.00 177.93 180.28 2d60 h GLY 64 N 0.83 1.21 0.90 5.26 0.00 -0.52 -0.05 103.07 110.71 2d60 h GLY 64 Ca 0.03 -0.29 0.03 0.00 0.00 0.00 0.00 47.33 47.10 2d60 h GLY 64 CO 0.10 0.11 0.59 0.50 0.00 0.00 0.00 176.54 177.85 2d60 h LYS 65 N 0.74 1.13 -0.03 4.80 1.57 -0.90 -2.06 116.57 121.80 2d60 h LYS 65 Ca 0.38 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 59.08 2d60 h LYS 65 Cb 0.36 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.41 2d60 h LYS 65 CO -0.25 0.75 -0.01 0.87 -0.57 0.00 0.00 179.45 180.23 2d60 h LYS 66 N 1.16 0.07 0.08 3.15 1.57 -0.79 -0.48 116.57 121.33 2d60 h LYS 66 Ca 0.36 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 59.13 2d60 h LYS 66 Cb -0.03 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.24 2d60 h LYS 66 CO -0.11 0.45 -0.27 0.28 -0.57 0.00 0.00 179.45 179.23 2d60 h VAL 67 N -0.31 0.41 0.00 0.50 2.07 -1.04 -2.18 116.25 115.70 2d60 h VAL 67 Ca 0.01 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.47 2d60 h VAL 67 Cb 0.42 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2d60 h VAL 67 CO 0.00 0.00 -0.29 0.25 0.02 0.00 0.00 177.57 177.55 2d60 h LEU 68 N -0.46 0.00 -0.42 2.57 6.46 -1.43 -0.55 115.31 121.48 2d60 h LEU 68 Ca 0.04 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.79 2d60 h LEU 68 Cb 0.50 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.41 2d60 h LEU 68 CO -0.18 0.29 0.22 1.23 -0.62 0.00 0.00 178.44 179.38 2d60 h GLY 69 N 1.79 0.64 1.01 3.75 0.00 -0.90 0.20 103.07 109.56 2d60 h GLY 69 Ca -0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 2d60 h GLY 69 CO 0.04 0.29 0.22 0.00 0.00 0.00 0.00 176.54 177.09 2d60 h ALA 70 N 1.07 0.81 -0.54 3.60 0.00 -0.73 -1.39 119.26 122.08 2d60 h ALA 70 Ca 0.15 -0.19 0.08 0.00 0.00 0.00 0.00 54.91 54.95 2d60 h ALA 70 Cb 0.08 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.57 2d60 h ALA 70 CO -0.02 0.45 0.19 0.35 0.00 0.00 0.00 179.25 180.22 2d60 h PHE 71 N 0.87 0.34 0.16 0.00 3.57 -0.91 -2.06 116.94 118.91 2d60 h PHE 71 Ca 0.20 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.73 2d60 h PHE 71 Cb 0.25 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 2d60 h PHE 71 CO 0.02 0.10 -0.11 1.03 -2.23 0.00 0.00 178.31 177.11 2d60 h SER 72 N 0.37 -0.28 -0.85 0.41 0.87 -0.04 -1.09 113.55 112.94 2d60 h SER 72 Ca 0.27 0.02 0.16 0.00 -1.23 0.00 0.00 61.79 61.01 2d60 h SER 72 Cb 0.31 0.09 -0.10 0.00 -0.44 0.00 0.00 62.40 62.25 2d60 h SER 72 CO -0.27 -0.18 0.41 0.44 -0.53 0.00 0.00 176.83 176.70 2d60 h ASP 73 N -0.27 0.45 -0.03 6.23 3.32 -1.11 -1.19 116.42 123.82 2d60 h ASP 73 Ca -0.01 0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 2d60 h ASP 73 Cb 0.24 0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 2d60 h ASP 73 CO 0.00 0.16 -0.00 1.23 -1.72 0.00 0.00 179.24 178.91 2d60 h GLY 74 N 0.55 0.10 2.00 2.75 0.00 -0.48 -2.17 103.07 105.82 2d60 h GLY 74 Ca 0.48 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.76 2d60 h GLY 74 CO -0.41 0.04 0.00 1.04 0.00 0.00 0.00 176.54 177.22 2d60 n LEU 75 N -4.47 0.52 -0.31 3.11 4.77 -0.45 -0.95 117.00 119.22 2d60 n LEU 75 Ca -0.02 0.68 0.12 0.00 -0.03 0.00 0.00 56.01 56.76 2d60 n LEU 75 Cb 0.13 -0.66 0.57 0.00 -2.33 0.00 0.00 43.42 41.12 2d60 n LEU 75 CO 0.35 -0.68 0.89 0.00 -1.33 0.00 0.00 177.39 176.61 2d60 n ALA 76 N -1.73 2.59 -2.71 -1.18 0.00 -0.82 -4.18 120.51 112.49 2d60 n ALA 76 Ca 0.01 -0.36 -0.07 0.00 0.00 0.00 0.00 53.44 53.02 2d60 n ALA 76 Cb 0.13 -1.24 0.04 0.00 0.00 0.00 0.00 19.45 18.38 2d60 n ALA 76 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2d60 n HIS 77 N -0.20 0.98 0.29 0.00 8.25 -0.12 -4.92 115.22 119.50 2d60 n HIS 77 Ca 0.18 -2.58 0.17 0.00 -0.26 0.00 0.00 57.72 55.23 2d60 n HIS 77 Cb 0.24 -0.24 0.91 0.00 1.12 0.00 0.00 29.99 32.02 2d60 n HIS 77 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2d60 h LEU 78 N 2.84 0.00 0.00 2.41 3.38 -1.72 -0.16 115.31 122.06 2d60 h LEU 78 Ca -0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2d60 h LEU 78 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2d60 h LEU 78 CO 0.39 0.05 -0.21 0.47 0.09 0.00 0.00 178.44 179.22 2d60 n ASP 79 N -3.45 0.41 -3.16 -0.43 8.00 -1.26 -4.33 116.55 112.33 2d60 n ASP 79 Ca -0.02 0.29 -0.20 0.00 0.71 0.00 0.00 54.79 55.56 2d60 n ASP 79 Cb 0.16 -0.29 -0.04 0.00 -0.02 0.00 0.00 41.12 40.93 2d60 n ASP 79 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2d60 n ASN 80 N -1.77 0.24 0.07 -2.24 5.15 -0.08 -4.94 115.26 111.69 2d60 n ASN 80 Ca 0.06 -2.88 0.02 0.00 -0.60 0.00 0.00 54.58 51.17 2d60 n ASN 80 Cb 0.38 -0.44 0.36 0.00 -0.53 0.00 0.00 39.78 39.54 2d60 n ASN 80 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2d60 h LEU 81 N 3.55 0.34 0.67 1.20 3.38 -1.73 -1.61 115.31 121.11 2d60 h LEU 81 Ca 0.07 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 2d60 h LEU 81 Cb 0.93 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.60 2d60 h LEU 81 CO 0.46 0.44 -0.32 0.11 0.09 0.00 0.00 178.44 179.23 2d60 h LYS 82 N 0.35 -0.86 -0.91 1.13 1.57 -1.89 -1.74 116.57 114.22 2d60 h LYS 82 Ca 0.08 0.06 0.09 0.00 -1.87 0.00 0.00 60.65 59.00 2d60 h LYS 82 Cb 0.33 0.20 -0.07 0.00 0.08 0.00 0.00 32.23 32.76 2d60 h LYS 82 CO 0.01 -0.54 0.56 0.78 -0.57 0.00 0.00 179.45 179.70 2d60 h GLY 83 N -1.06 1.42 1.20 3.86 0.00 -1.94 -2.00 103.07 104.55 2d60 h GLY 83 Ca -0.09 -0.39 -0.04 0.00 0.00 0.00 0.00 47.33 46.80 2d60 h GLY 83 CO 0.15 0.21 0.26 -0.84 0.00 0.00 0.00 176.54 176.32 2d60 h THR 84 N 0.96 1.24 -0.55 4.70 2.02 -1.22 -3.21 112.91 116.85 2d60 h THR 84 Ca 0.42 -0.77 0.00 0.00 0.77 0.00 0.00 66.41 66.83 2d60 h THR 84 Cb 0.31 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.16 2d60 h THR 84 CO -0.22 0.31 0.00 0.49 0.37 0.00 0.00 175.52 176.47 2d60 n PHE 85 N -4.29 0.73 -0.12 3.16 3.01 -0.66 -4.67 117.46 114.62 2d60 n PHE 85 Ca 0.06 -0.47 -0.06 0.00 1.01 0.00 0.00 57.45 57.99 2d60 n PHE 85 Cb 0.19 -0.01 0.02 0.00 -0.01 0.00 0.00 39.48 39.67 2d60 n PHE 85 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2d60 h ALA 86 N 3.42 0.49 -0.19 4.37 0.00 -1.37 0.51 119.26 126.50 2d60 h ALA 86 Ca 0.00 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 2d60 h ALA 86 Cb 0.88 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 2d60 h ALA 86 CO 0.00 -0.17 -0.05 1.79 0.00 0.00 0.00 179.25 180.82 2d60 h THR 87 N 0.40 1.29 -0.13 0.00 1.35 -1.83 -0.38 112.91 113.60 2d60 h THR 87 Ca 0.17 -1.04 -0.04 0.00 -0.55 0.00 0.00 66.41 64.96 2d60 h THR 87 Cb 0.08 1.58 -0.01 0.00 -1.73 0.00 0.00 68.15 68.07 2d60 h THR 87 CO -0.12 0.31 -0.10 -0.07 -0.25 0.00 0.00 175.52 175.29 2d60 h LEU 88 N 0.09 0.18 0.14 3.87 3.38 -1.82 -1.29 115.31 119.85 2d60 h LEU 88 Ca 0.05 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2d60 h LEU 88 Cb 0.50 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.20 2d60 h LEU 88 CO 0.02 0.31 -0.07 -1.28 0.09 0.00 0.00 178.44 177.51 2d60 h SER 89 N 0.18 -0.16 -0.92 -0.43 0.87 0.45 0.58 113.55 114.13 2d60 h SER 89 Ca 0.04 0.00 0.07 0.00 -1.23 0.00 0.00 61.79 60.67 2d60 h SER 89 Cb 0.30 0.04 -0.07 0.00 -0.44 0.00 0.00 62.40 62.24 2d60 h SER 89 CO 0.02 -0.11 0.58 -0.33 -0.53 0.00 0.00 176.83 176.46 2d60 h GLU 90 N -0.19 1.02 -0.19 2.24 5.08 -0.84 -1.30 114.58 120.40 2d60 h GLU 90 Ca -0.02 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2d60 h GLU 90 Cb 0.14 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2d60 h GLU 90 CO 0.03 0.67 0.08 1.25 -1.00 0.00 0.00 179.01 180.04 2d60 h LEU 91 N 1.05 0.26 -1.30 1.33 5.85 -0.97 0.23 115.31 121.76 2d60 h LEU 91 Ca 0.40 -0.16 -0.07 0.00 0.84 0.00 0.00 57.88 58.89 2d60 h LEU 91 Cb 0.19 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2d60 h LEU 91 CO -0.18 0.35 -0.34 0.45 -0.34 0.00 0.00 178.44 178.37 2d60 h HIS 92 N 0.16 0.02 0.02 1.25 3.86 -0.43 -0.84 115.15 119.19 2d60 h HIS 92 Ca 0.06 -0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.27 2d60 h HIS 92 Cb 0.16 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.63 2d60 h HIS 92 CO -0.01 0.36 -0.01 0.00 0.86 0.00 0.00 177.93 179.12 2d60 h ASP 94 N -1.00 0.49 0.03 0.00 3.32 -0.55 -3.17 116.42 115.53 2d60 h ASP 94 Ca -0.00 -0.53 -0.39 0.00 0.02 0.00 0.00 57.03 56.13 2d60 h ASP 94 Cb 0.21 -0.16 -0.06 0.00 0.22 0.00 0.00 39.33 39.54 2d60 h ASP 94 CO 0.00 1.41 -2.35 0.29 -1.72 0.00 0.00 179.24 176.88 2d60 n LYS 95 N -3.56 0.66 0.02 3.56 4.76 -0.52 -4.69 118.16 118.39 2d60 n LYS 95 Ca -0.10 0.20 0.11 0.00 -2.87 0.00 0.00 58.31 55.65 2d60 n LYS 95 Cb 1.04 -1.56 -0.06 0.00 -1.84 0.00 0.00 35.03 32.60 2d60 n LYS 95 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 2d60 n LEU 96 N -3.46 0.48 -3.80 -0.35 4.77 -0.44 -4.99 117.00 109.21 2d60 n LEU 96 Ca -0.44 -0.01 -0.24 0.00 -0.03 0.00 0.00 56.01 55.29 2d60 n LEU 96 Cb 0.98 -0.05 0.02 0.00 -2.33 0.00 0.00 43.42 42.04 2d60 n LEU 96 CO 0.26 0.02 -0.06 1.41 -1.33 0.00 0.00 177.39 177.69 2d60 n HIS 97 N -2.12 -1.95 -3.37 -1.77 8.25 -0.67 -4.96 115.22 108.63 2d60 n HIS 97 Ca -0.00 0.84 -0.41 0.00 -0.26 0.00 0.00 57.72 57.89 2d60 n HIS 97 Cb 0.49 -4.16 -0.09 0.00 1.12 0.00 0.00 29.99 27.35 2d60 n HIS 97 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2d60 s VAL 98 N -3.63 5.14 -0.04 1.59 1.01 -0.50 -5.04 120.40 118.94 2d60 s VAL 98 Ca 0.17 0.15 -0.34 0.00 0.00 0.00 0.00 61.98 61.96 2d60 s VAL 98 Cb -0.08 -3.83 -0.12 0.00 0.00 0.00 0.00 36.38 32.34 2d60 s VAL 98 CO 0.83 -0.09 1.83 -0.67 0.00 0.00 0.00 175.10 177.00 2d60 n ASP 99 N 5.44 3.41 0.18 3.32 4.64 -1.26 -4.73 116.55 127.55 2d60 n ASP 99 Ca -0.08 0.99 0.12 0.00 -1.38 0.00 0.00 54.79 54.44 2d60 n ASP 99 Cb 0.49 -1.39 0.64 0.00 -1.04 0.00 0.00 41.12 39.82 2d60 n ASP 99 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 2d60 h PRO 100 N 8.66 0.00 -0.44 -0.67 0.11 -1.96 -1.45 132.00 136.25 2d60 h PRO 100 Ca -0.48 0.00 0.13 0.00 0.11 0.00 0.00 66.00 65.76 2d60 h PRO 100 Cb 1.27 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.36 2d60 h PRO 100 CO 0.94 0.00 0.40 1.49 -0.21 0.00 0.00 178.00 180.61 2d60 h GLU 101 N 0.00 0.00 -0.01 1.05 4.57 -1.98 -1.47 114.58 116.74 2d60 h GLU 101 Ca 0.00 0.00 -0.06 0.00 -1.18 0.00 0.00 59.36 58.12 2d60 h GLU 101 Cb 0.04 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.62 2d60 h GLU 101 CO 0.00 0.00 -0.26 -0.91 -1.18 0.00 0.00 179.01 176.66 2d60 h ASN 102 N 0.00 0.01 -0.45 1.04 2.35 -1.63 -2.05 115.58 114.86 2d60 h ASN 102 Ca 0.21 -0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.91 2d60 h ASN 102 Cb 1.00 -0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.34 2d60 h ASN 102 CO -0.00 0.28 0.13 -0.26 -1.65 0.00 0.00 177.43 175.93 2d60 h PHE 103 N 0.01 0.78 0.12 1.19 0.04 -1.46 -0.34 116.94 117.28 2d60 h PHE 103 Ca -0.00 -0.06 -0.01 0.00 2.80 0.00 0.00 57.97 60.70 2d60 h PHE 103 Cb 0.47 -0.23 0.00 0.00 2.20 0.00 0.00 35.95 38.39 2d60 h PHE 103 CO 0.00 0.66 -0.06 0.00 -0.60 0.00 0.00 178.31 178.31 2d60 h ARG 104 N 0.74 -0.16 -0.68 1.51 3.08 -1.51 -0.21 114.38 117.15 2d60 h ARG 104 Ca 0.17 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.28 2d60 h ARG 104 Cb 0.26 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.30 2d60 h ARG 104 CO -0.00 0.11 0.39 -0.07 -1.07 0.00 0.00 179.97 179.32 2d60 h LEU 105 N -0.42 0.59 -1.07 3.04 3.38 -1.22 -1.31 115.31 118.31 2d60 h LEU 105 Ca -0.02 0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 2d60 h LEU 105 Cb 0.34 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 2d60 h LEU 105 CO 0.03 0.39 0.25 0.25 0.09 0.00 0.00 178.44 179.44 2d60 h LEU 106 N 0.72 0.83 -0.67 1.67 5.85 -0.96 -1.60 115.31 121.16 2d60 h LEU 106 Ca 0.30 -0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.97 2d60 h LEU 106 Cb 0.15 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 2d60 h LEU 106 CO -0.17 0.75 0.36 1.23 -0.34 0.00 0.00 178.44 180.27 2d60 h GLY 107 N 1.00 0.99 1.57 3.75 0.00 -0.22 -0.04 103.07 110.12 2d60 h GLY 107 Ca 0.21 -0.25 -0.23 0.00 0.00 0.00 0.00 47.33 47.07 2d60 h GLY 107 CO -0.02 0.13 -0.96 3.43 0.00 0.00 0.00 176.54 179.12 2d60 h ASN 108 N 0.66 0.50 -0.55 0.19 2.35 -0.64 -1.91 115.58 116.18 2d60 h ASN 108 Ca 0.31 -0.41 0.03 0.00 -0.55 0.00 0.00 56.30 55.67 2d60 h ASN 108 Cb 0.23 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.41 2d60 h ASN 108 CO -0.20 1.22 0.32 0.58 -1.65 0.00 0.00 177.43 177.70 2d60 h VAL 109 N 0.21 1.04 -0.36 2.81 2.07 -1.19 -2.15 116.25 118.68 2d60 h VAL 109 Ca -0.08 -0.22 0.02 0.00 0.82 0.00 0.00 66.70 67.24 2d60 h VAL 109 Cb 1.61 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 2d60 h VAL 109 CO 0.16 0.12 0.21 0.25 0.02 0.00 0.00 177.57 178.33 2d60 h LEU 110 N 0.63 0.33 -0.71 2.57 5.85 -0.80 -0.46 115.31 122.71 2d60 h LEU 110 Ca 0.22 0.00 0.12 0.00 0.84 0.00 0.00 57.88 59.06 2d60 h LEU 110 Cb 0.04 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 40.93 2d60 h LEU 110 CO -0.11 0.24 0.30 0.58 -0.34 0.00 0.00 178.44 179.11 2d60 h VAL 111 N 0.42 0.74 -0.32 1.05 2.07 -1.23 -0.35 116.25 118.63 2d60 h VAL 111 Ca 0.14 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 67.43 2d60 h VAL 111 Cb 0.01 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 2d60 h VAL 111 CO -0.07 0.09 -0.06 0.00 0.02 0.00 0.00 177.57 177.55 2d60 h VAL 113 N 0.49 1.27 -0.93 0.00 2.07 0.37 -0.07 116.25 119.45 2d60 h VAL 113 Ca 0.10 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.65 2d60 h VAL 113 Cb 0.41 1.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.55 2d60 h VAL 113 CO 0.02 0.30 0.60 -0.07 0.02 0.00 0.00 177.57 178.44 2d60 h LEU 114 N 0.21 1.08 0.10 2.57 3.38 -0.96 0.49 115.31 122.18 2d60 h LEU 114 Ca 0.07 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2d60 h LEU 114 Cb 0.46 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2d60 h LEU 114 CO 0.02 0.80 -0.05 0.00 0.09 0.00 0.00 178.44 179.30 2d60 h ALA 115 N 1.33 -0.14 -0.42 1.53 0.00 -1.28 0.51 119.26 120.79 2d60 h ALA 115 Ca 0.34 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.15 2d60 h ALA 115 Cb -0.12 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 2d60 h ALA 115 CO -0.07 -0.45 0.17 1.25 0.00 0.00 0.00 179.25 180.16 2d60 h HIS 116 N -0.40 0.32 -0.09 0.00 -0.00 -0.67 0.82 115.15 115.13 2d60 h HIS 116 Ca -0.01 0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.30 2d60 h HIS 116 Cb 0.33 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 27.66 2d60 h HIS 116 CO 0.01 0.14 -0.23 1.25 -0.00 0.00 0.00 177.93 179.10 2d60 h HIS 117 N 0.36 0.40 0.00 5.26 6.17 -0.00 -3.33 115.15 124.01 2d60 h HIS 117 Ca 0.19 -0.15 0.00 0.00 0.71 0.00 0.00 60.37 61.12 2d60 h HIS 117 Cb 0.14 -0.07 0.00 0.00 2.52 0.00 0.00 27.41 30.00 2d60 h HIS 117 CO -0.13 0.84 -0.61 1.19 0.71 0.00 0.00 177.93 179.93 2d60 n PHE 118 N -4.51 0.08 0.00 5.26 3.01 0.16 -5.03 117.46 116.44 2d60 n PHE 118 Ca -0.08 0.02 0.00 0.00 1.01 0.00 0.00 57.45 58.41 2d60 n PHE 118 Cb 0.44 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 2d60 n PHE 118 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2d60 n GLY 119 N 1.47 3.28 0.25 1.37 0.00 0.28 -2.95 105.19 108.89 2d60 n GLY 119 Ca 0.05 -0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.16 2d60 n GLY 119 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2d60 h LYS 120 N 0.00 0.00 -0.03 1.61 2.10 -1.96 0.18 116.57 118.47 2d60 h LYS 120 Ca 0.00 0.00 0.01 0.00 -2.00 0.00 0.00 60.65 58.66 2d60 h LYS 120 Cb 0.00 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2d60 h LYS 120 CO 0.00 0.16 0.07 1.49 -2.00 0.00 0.00 179.45 179.18 2d60 h GLU 121 N 0.00 0.00 -3.62 0.07 4.81 -1.93 -3.27 114.58 110.64 2d60 h GLU 121 Ca -0.00 0.00 -0.73 0.00 -0.13 0.00 0.00 59.36 58.50 2d60 h GLU 121 Cb 0.44 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 29.73 2d60 h GLU 121 CO 0.02 0.00 2.69 0.34 -0.73 0.00 0.00 179.01 181.33 2d60 n PHE 122 N -3.33 3.13 -1.34 0.92 7.35 0.62 -4.93 117.46 119.89 2d60 n PHE 122 Ca -0.02 -2.90 -0.30 0.00 -0.76 0.00 0.00 57.45 53.48 2d60 n PHE 122 Cb 0.15 -2.25 0.13 0.00 0.35 0.00 0.00 39.48 37.85 2d60 n PHE 122 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2d60 s THR 123 N 1.67 2.69 0.19 -2.13 -4.23 -1.24 -4.65 115.64 107.94 2d60 s THR 123 Ca 0.46 0.23 -0.11 0.00 -1.18 0.00 0.00 61.69 61.08 2d60 s THR 123 Cb 0.13 -2.81 0.11 0.00 1.34 0.00 0.00 72.50 71.26 2d60 s THR 123 CO -0.05 -0.29 1.80 -0.65 -0.54 0.00 0.00 174.62 174.89 2d60 h PRO 124 N -1.42 0.58 -0.61 3.99 0.11 -1.93 0.18 132.00 132.89 2d60 h PRO 124 Ca -0.49 -0.03 0.06 0.00 0.11 0.00 0.00 66.00 65.65 2d60 h PRO 124 Cb 1.29 -0.13 -0.06 0.00 0.11 0.00 0.00 31.00 32.21 2d60 h PRO 124 CO 0.57 0.38 0.31 -1.35 -0.21 0.00 0.00 178.00 177.70 2d60 h PRO 125 N 0.60 0.56 -0.63 1.05 0.11 -1.99 -1.27 132.00 130.42 2d60 h PRO 125 Ca 0.26 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.35 2d60 h PRO 125 Cb 0.14 -0.13 -0.04 0.00 0.11 0.00 0.00 31.00 31.09 2d60 h PRO 125 CO -0.16 0.37 0.40 0.28 -0.21 0.00 0.00 178.00 178.68 2d60 h VAL 126 N 0.57 1.11 -0.27 3.15 2.07 -1.82 -1.95 116.25 119.11 2d60 h VAL 126 Ca 0.28 -0.27 0.04 0.00 0.82 0.00 0.00 66.70 67.57 2d60 h VAL 126 Cb 0.22 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 30.19 2d60 h VAL 126 CO -0.20 0.15 0.04 -0.61 0.02 0.00 0.00 177.57 176.96 2d60 h GLN 127 N 0.80 0.13 -0.84 1.57 4.15 -0.29 -1.48 115.11 119.14 2d60 h GLN 127 Ca 0.24 -0.01 0.13 0.00 0.77 0.00 0.00 58.65 59.79 2d60 h GLN 127 Cb -0.02 -0.03 -0.09 0.00 0.21 0.00 0.00 27.48 27.55 2d60 h GLN 127 CO -0.08 0.08 0.45 0.00 -1.93 0.00 0.00 178.83 177.35 2d60 h ALA 128 N 1.21 1.25 -0.13 3.38 0.00 -0.99 0.21 119.26 124.19 2d60 h ALA 128 Ca 0.13 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2d60 h ALA 128 Cb 0.14 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2d60 h ALA 128 CO -0.18 -0.03 -0.01 0.00 0.00 0.00 0.00 179.25 179.03 2d60 h ALA 129 N 1.53 0.17 -0.90 0.00 0.00 -0.66 -2.62 119.26 116.78 2d60 h ALA 129 Ca 0.44 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 55.20 2d60 h ALA 129 Cb 0.56 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 2d60 h ALA 129 CO -0.33 -0.13 0.59 1.88 0.00 0.00 0.00 179.25 181.27 2d60 h TYR 130 N -0.05 1.08 -0.85 0.00 0.05 -0.39 -2.03 116.97 114.79 2d60 h TYR 130 Ca 0.04 0.03 0.10 0.00 0.05 0.00 0.00 58.73 58.95 2d60 h TYR 130 Cb 0.38 -0.36 -0.08 0.00 1.01 0.00 0.00 36.73 37.68 2d60 h TYR 130 CO 0.04 0.61 0.48 1.96 -1.05 0.00 0.00 178.16 180.20 2d60 h GLN 131 N 1.11 0.76 -0.20 4.88 1.08 -0.44 0.17 115.11 122.47 2d60 h GLN 131 Ca 0.37 -0.05 -0.09 0.00 -1.45 0.00 0.00 58.65 57.43 2d60 h GLN 131 Cb 0.06 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.30 2d60 h GLN 131 CO -0.12 0.50 -0.26 0.87 -0.95 0.00 0.00 178.83 178.88 2d60 h LYS 132 N 0.79 0.37 -0.06 1.46 1.57 -1.01 -1.93 116.57 117.76 2d60 h LYS 132 Ca 0.42 -0.13 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 2d60 h LYS 132 Cb 0.42 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 2d60 h LYS 132 CO -0.27 0.61 -0.05 0.28 -0.57 0.00 0.00 179.45 179.45 2d60 h VAL 133 N 0.33 1.37 0.00 0.50 2.07 -0.54 -1.39 116.25 118.59 2d60 h VAL 133 Ca 0.05 -1.19 -0.07 0.00 0.82 0.00 0.00 66.70 66.31 2d60 h VAL 133 Cb 0.64 2.05 -0.01 0.00 -1.52 0.00 0.00 31.29 32.44 2d60 h VAL 133 CO 0.05 0.33 -0.34 -0.37 0.02 0.00 0.00 177.57 177.26 2d60 h VAL 134 N -0.30 0.85 -0.19 2.57 -1.51 -0.63 0.62 116.25 117.66 2d60 h VAL 134 Ca 0.01 -1.37 -0.21 0.00 -1.23 0.00 0.00 66.70 63.90 2d60 h VAL 134 Cb 0.55 1.83 0.01 0.00 -2.13 0.00 0.00 31.29 31.55 2d60 h VAL 134 CO 0.01 0.33 -0.72 0.00 -1.23 0.00 0.00 177.57 175.96 2d60 h ALA 135 N 1.66 0.35 -0.17 5.19 0.00 -1.33 -1.99 119.26 122.99 2d60 h ALA 135 Ca -0.00 -0.58 -0.00 0.00 0.00 0.00 0.00 54.91 54.33 2d60 h ALA 135 Cb 0.81 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2d60 h ALA 135 CO 0.04 0.68 0.09 0.78 0.00 0.00 0.00 179.25 180.85 2d60 h GLY 136 N 0.60 0.25 0.68 0.00 0.00 -0.48 0.84 103.07 104.95 2d60 h GLY 136 Ca -0.04 -0.11 0.02 0.00 0.00 0.00 0.00 47.33 47.21 2d60 h GLY 136 CO 0.15 0.11 -0.11 -2.08 0.00 0.00 0.00 176.54 174.60 2d60 h VAL 137 N 0.17 0.71 -0.44 4.60 2.07 -0.95 0.19 116.25 122.60 2d60 h VAL 137 Ca 0.06 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 2d60 h VAL 137 Cb 0.06 0.71 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 2d60 h VAL 137 CO -0.01 0.00 0.24 0.00 0.02 0.00 0.00 177.57 177.82 2d60 h ALA 138 N 0.83 0.57 -0.48 1.67 0.00 -1.23 0.97 119.26 121.58 2d60 h ALA 138 Ca 0.05 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 54.92 2d60 h ALA 138 Cb 0.24 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2d60 h ALA 138 CO -0.14 0.10 0.22 -0.91 0.00 0.00 0.00 179.25 178.52 2d60 h ASN 139 N 0.58 0.29 -0.66 0.00 2.35 -0.67 0.11 115.58 117.57 2d60 h ASN 139 Ca 0.16 0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.86 2d60 h ASN 139 Cb 0.06 -0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.39 2d60 h ASN 139 CO -0.02 0.20 0.09 0.00 -1.65 0.00 0.00 177.43 176.05 2d60 h ALA 140 N 1.28 0.90 0.00 -0.83 0.00 -0.26 -2.05 119.26 118.30 2d60 h ALA 140 Ca 0.22 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.78 2d60 h ALA 140 Cb 0.16 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2d60 h ALA 140 CO -0.18 0.67 -0.32 -0.07 0.00 0.00 0.00 179.25 179.36 2d60 h LEU 141 N 1.04 0.00 -0.17 0.00 3.38 -0.36 -2.45 115.31 116.76 2d60 h LEU 141 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 2d60 h LEU 141 Cb 0.47 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.22 2d60 h LEU 141 CO 0.02 0.32 0.00 0.00 0.09 0.00 0.00 178.44 178.86 2d60 n ALA 142 N -2.37 2.10 0.03 1.53 0.00 0.32 -4.41 120.51 117.71 2d60 n ALA 142 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 53.44 53.38 2d60 n ALA 142 Cb 0.40 -1.43 0.20 0.00 0.00 0.00 0.00 19.45 18.62 2d60 n ALA 142 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2d60 h HIS 143 N 0.00 0.49 -0.60 0.00 6.17 -0.87 -2.74 115.15 117.60 2d60 h HIS 143 Ca 0.00 -0.11 0.00 0.00 0.71 0.00 0.00 60.37 60.97 2d60 h HIS 143 Cb 0.57 -0.12 0.00 0.00 2.52 0.00 0.00 27.41 30.38 2d60 h HIS 143 CO 0.00 0.69 0.00 1.63 0.71 0.00 0.00 177.93 180.96 2d60 n LYS 144 N -4.09 2.81 -2.13 5.26 4.76 -1.26 -4.95 118.16 118.57 2d60 n LYS 144 Ca -0.01 -2.33 -0.36 0.00 -2.87 0.00 0.00 58.31 52.75 2d60 n LYS 144 Cb 0.44 -1.62 0.02 0.00 -1.84 0.00 0.00 35.03 32.03 2d60 n LYS 144 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2d60 s TYR 145 N -1.43 2.52 0.00 2.13 4.12 -1.04 -4.71 117.35 118.94 2d60 s TYR 145 Ca 0.43 1.53 0.00 0.00 0.02 0.00 0.00 57.07 59.04 2d60 s TYR 145 Cb 0.24 -3.39 0.00 0.00 -1.52 0.00 0.00 41.96 37.29 2d60 s TYR 145 CO 0.25 -1.91 0.00 -2.39 0.02 0.00 0.00 175.55 171.52