#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2mob n ASN 36 N 0.00 0.00 -3.97 6.43 4.13 -1.26 -4.64 115.26 115.94 2mob n ASN 36 Ca 0.00 0.00 -0.41 0.00 1.68 0.00 0.00 54.58 55.85 2mob n ASN 36 Cb 0.00 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.23 2mob n ASN 36 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2mob n ALA 37 N 7.34 -2.80 -2.72 5.41 0.00 -1.26 -4.42 120.51 122.06 2mob n ALA 37 Ca 0.00 0.24 -0.34 0.00 0.00 0.00 0.00 53.44 53.33 2mob n ALA 37 Cb 0.00 -1.40 -0.11 0.00 0.00 0.00 0.00 19.45 17.94 2mob n ALA 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2mob s VAL 38 N -1.26 4.05 -0.09 0.00 0.11 -0.31 -4.76 120.40 118.14 2mob s VAL 38 Ca 0.56 -0.33 0.01 0.00 -2.93 0.00 0.00 61.98 59.29 2mob s VAL 38 Cb -0.70 -2.71 -0.02 0.00 -1.53 0.00 0.00 36.38 31.42 2mob s VAL 38 CO 0.55 0.57 -0.11 0.54 -3.33 0.00 0.00 175.10 173.32 2mob s VAL 39 N -0.52 3.29 -0.06 2.04 0.11 -1.25 0.09 120.40 124.09 2mob s VAL 39 Ca 0.08 -0.61 -0.02 0.00 -2.93 0.00 0.00 61.98 58.50 2mob s VAL 39 Cb -0.12 -2.35 -0.04 0.00 -1.53 0.00 0.00 36.38 32.35 2mob s VAL 39 CO 0.02 0.56 0.05 -0.22 -3.33 0.00 0.00 175.10 172.18 2mob s LEU 40 N -0.34 3.79 -0.07 2.54 2.96 0.25 -4.28 118.68 123.53 2mob s LEU 40 Ca 0.04 0.19 -0.03 0.00 -0.22 0.00 0.00 54.13 54.11 2mob s LEU 40 Cb -0.13 -1.99 0.04 0.00 0.50 0.00 0.00 46.19 44.61 2mob s LEU 40 CO 0.02 0.35 0.14 -0.69 -1.32 0.00 0.00 176.35 174.85 2mob s VAL 41 N -1.00 -0.11 0.00 1.68 1.01 -1.26 -0.21 120.40 120.50 2mob s VAL 41 Ca 0.16 0.23 0.00 0.00 0.00 0.00 0.00 61.98 62.38 2mob s VAL 41 Cb -0.12 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.02 2mob s VAL 41 CO 0.06 0.10 0.00 0.18 0.00 0.00 0.00 175.10 175.44 2mob n LEU 42 N 4.52 0.00 -4.93 3.92 7.99 -0.83 -3.73 117.00 123.94 2mob n LEU 42 Ca -0.21 0.00 -0.20 0.00 -0.01 0.00 0.00 56.01 55.60 2mob n LEU 42 Cb 0.51 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.80 2mob n LEU 42 CO 0.14 0.00 0.03 0.00 -1.51 0.00 0.00 177.39 176.05 2mob s MET 43 N -1.54 2.80 -0.60 3.23 0.23 -1.26 -2.31 119.30 119.86 2mob s MET 43 Ca 0.00 -1.27 -0.31 0.00 -1.03 0.00 0.00 55.69 53.09 2mob s MET 43 Cb 0.00 -2.61 -0.13 0.00 -1.53 0.00 0.00 34.83 30.56 2mob s MET 43 CO 0.00 -0.07 2.43 1.63 -2.03 0.00 0.00 175.02 176.98 2mob n LYS 44 N -1.59 0.74 0.00 3.16 5.02 -1.26 -3.84 118.16 120.39 2mob n LYS 44 Ca 0.02 0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 2mob n LYS 44 Cb 0.60 -2.54 0.00 0.00 -0.02 0.00 0.00 35.03 33.06 2mob n LYS 44 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2mob n SER 45 N 12.33 0.00 0.00 4.39 2.88 -1.26 -4.96 113.62 127.00 2mob n SER 45 Ca 0.47 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.01 2mob n SER 45 Cb 0.29 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.75 2mob n SER 45 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2mob n ASP 46 N 0.00 0.00 -2.04 -3.46 8.00 -1.26 -4.92 116.55 112.87 2mob n ASP 46 Ca 0.00 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.27 2mob n ASP 46 Cb 0.00 0.02 0.09 0.00 -0.02 0.00 0.00 41.12 41.21 2mob n ASP 46 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2mob n GLU 47 N -1.50 2.13 0.09 -1.24 1.02 -1.26 -4.69 120.64 115.18 2mob n GLU 47 Ca 0.00 -2.39 -0.06 0.00 -0.02 0.00 0.00 57.16 54.69 2mob n GLU 47 Cb 0.00 -1.94 -0.04 0.00 -0.02 0.00 0.00 31.44 29.45 2mob n GLU 47 CO 0.00 0.00 0.00 -0.84 1.18 0.00 0.00 177.13 177.47 2mob h ILE 48 N 0.89 0.00 -1.00 -3.67 -2.65 -1.96 2.21 117.51 111.34 2mob h ILE 48 Ca 0.47 0.00 0.38 0.00 1.03 0.00 0.00 64.86 66.74 2mob h ILE 48 Cb 1.55 0.00 -0.17 0.00 -2.05 0.00 0.00 36.82 36.15 2mob h ILE 48 CO 1.04 0.00 0.50 -2.24 0.03 0.00 0.00 178.15 177.49 2mob h ASP 49 N -0.33 0.30 0.01 2.16 3.04 -1.97 2.74 116.42 122.37 2mob h ASP 49 Ca -0.02 0.24 -0.00 0.00 -3.24 0.00 0.00 57.03 54.02 2mob h ASP 49 Cb 0.30 0.25 0.00 0.00 -1.04 0.00 0.00 39.33 38.85 2mob h ASP 49 CO -0.05 -0.36 -0.00 0.00 -2.04 0.00 0.00 179.24 176.79 2mob h ALA 50 N 1.96 -0.01 -0.01 4.15 0.00 -1.52 -2.49 119.26 121.34 2mob h ALA 50 Ca 0.80 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 55.35 2mob h ALA 50 Cb 2.02 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.81 2mob h ALA 50 CO -0.74 -0.14 -0.02 -0.84 0.00 0.00 0.00 179.25 177.50 2mob h ILE 51 N -0.74 1.48 -1.07 0.00 3.07 0.72 -1.52 117.51 119.45 2mob h ILE 51 Ca -0.00 -1.44 0.30 0.00 1.55 0.00 0.00 64.86 65.28 2mob h ILE 51 Cb 0.71 2.43 -0.12 0.00 -0.27 0.00 0.00 36.82 39.57 2mob h ILE 51 CO 0.00 0.38 0.66 0.40 -1.05 0.00 0.00 178.15 178.54 2mob h ILE 52 N -0.56 0.40 0.58 0.16 1.08 0.45 4.89 117.51 124.50 2mob h ILE 52 Ca -0.00 -0.13 -0.03 0.00 -0.39 0.00 0.00 64.86 64.32 2mob h ILE 52 Cb 0.63 0.00 0.01 0.00 -3.07 0.00 0.00 36.82 34.39 2mob h ILE 52 CO 0.00 0.07 -0.28 -0.08 -0.69 0.00 0.00 178.15 177.17 2mob h GLU 53 N 0.36 -0.74 0.00 2.37 4.81 -1.15 3.11 114.58 123.34 2mob h GLU 53 Ca 0.68 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.96 2mob h GLU 53 Cb 1.67 0.17 0.00 0.00 0.63 0.00 0.00 28.75 31.22 2mob h GLU 53 CO -0.44 -0.50 0.00 -3.47 -0.73 0.00 0.00 179.01 173.87 2mob n ASP 54 N -4.51 0.22 -0.08 1.04 2.03 -0.25 -1.21 116.55 113.79 2mob n ASP 54 Ca -0.10 0.52 -0.09 0.00 0.52 0.00 0.00 54.79 55.65 2mob n ASP 54 Cb 0.30 -0.58 -0.10 0.00 -0.72 0.00 0.00 41.12 40.02 2mob n ASP 54 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2mob n ILE 55 N -1.70 0.99 -0.02 5.18 0.13 1.58 -4.18 119.36 121.35 2mob n ILE 55 Ca 0.07 -0.53 -0.03 0.00 -1.10 0.00 0.00 62.75 61.16 2mob n ILE 55 Cb 0.36 -0.80 -0.01 0.00 -0.84 0.00 0.00 39.64 38.35 2mob n ILE 55 CO 0.00 0.00 0.00 0.52 2.80 0.00 0.00 176.55 179.87 2mob n VAL 56 N -2.69 0.18 -0.30 9.51 0.31 0.73 -3.13 118.33 122.93 2mob n VAL 56 Ca -0.26 -0.06 -0.05 0.00 -0.01 0.00 0.00 64.34 63.96 2mob n VAL 56 Cb 0.92 -1.04 0.07 0.00 -0.91 0.00 0.00 33.84 32.89 2mob n VAL 56 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 2mob h LEU 57 N -0.05 1.04 0.07 7.52 6.46 0.55 1.50 115.31 132.39 2mob h LEU 57 Ca -0.08 -0.11 -0.35 0.00 -0.12 0.00 0.00 57.88 57.23 2mob h LEU 57 Cb 1.09 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 40.72 2mob h LEU 57 CO -0.03 0.85 -1.94 0.29 -0.62 0.00 0.00 178.44 177.00 2mob n LYS 58 N -4.38 0.68 -0.03 1.25 5.02 -0.35 -3.06 118.16 117.29 2mob n LYS 58 Ca 0.08 0.32 -0.13 0.00 -2.02 0.00 0.00 58.31 56.56 2mob n LYS 58 Cb 0.10 -1.67 -0.11 0.00 -0.02 0.00 0.00 35.03 33.33 2mob n LYS 58 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2mob h GLY 59 N 0.56 -0.03 0.55 0.72 0.00 -1.56 -2.90 103.07 100.41 2mob h GLY 59 Ca -0.45 0.01 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 2mob h GLY 59 CO -0.05 -0.01 -0.26 -1.33 0.00 0.00 0.00 176.54 174.89 2mob h GLY 60 N -0.78 -0.77 -0.03 4.60 0.00 0.20 -3.10 103.07 103.18 2mob h GLY 60 Ca -0.00 0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2mob h GLY 60 CO 0.00 -0.28 0.00 1.17 0.00 0.00 0.00 176.54 177.44 2mob n LYS 61 N -5.26 0.25 0.05 4.80 0.00 0.71 -3.51 118.16 115.20 2mob n LYS 61 Ca -0.09 0.00 -0.10 0.00 0.00 0.00 0.00 58.31 58.12 2mob n LYS 61 Cb 0.29 -1.00 -0.06 0.00 0.00 0.00 0.00 35.03 34.26 2mob n LYS 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2mob h ALA 62 N 1.49 -0.79 0.00 3.14 0.00 -1.43 -3.13 119.26 118.54 2mob h ALA 62 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2mob h ALA 62 Cb 0.00 0.76 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2mob h ALA 62 CO 0.00 -0.88 -1.77 1.63 0.00 0.00 0.00 179.25 178.23 2mob n LYS 63 N -4.28 0.53 -2.15 0.00 5.02 -1.25 -4.94 118.16 111.09 2mob n LYS 63 Ca -0.05 -0.15 -0.41 0.00 -2.02 0.00 0.00 58.31 55.68 2mob n LYS 63 Cb 0.24 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.72 2mob n LYS 63 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2mob s ASN 64 N -4.15 6.82 0.18 4.39 0.01 -1.18 -4.94 114.94 116.07 2mob s ASN 64 Ca -0.04 2.55 -0.12 0.00 -0.71 0.00 0.00 52.86 54.54 2mob s ASN 64 Cb 0.14 -2.63 0.09 0.00 0.41 0.00 0.00 41.25 39.27 2mob s ASN 64 CO 0.89 -0.54 1.77 1.55 -1.51 0.00 0.00 177.10 179.26 2mob h PRO 65 N 4.49 0.90 0.00 -0.60 0.13 -1.83 -3.42 132.00 131.66 2mob h PRO 65 Ca -0.47 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.54 2mob h PRO 65 Cb 1.22 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2mob h PRO 65 CO 0.72 0.71 0.00 0.43 -0.23 0.00 0.00 178.00 179.63 2mob n SER 66 N -4.51 0.00 -4.87 1.44 7.64 -1.26 -5.08 113.62 106.98 2mob n SER 66 Ca 0.04 0.00 -0.32 0.00 1.01 0.00 0.00 58.87 59.60 2mob n SER 66 Cb 0.12 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.26 2mob n SER 66 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2mob s ILE 67 N 0.00 5.15 0.15 0.44 1.09 -1.26 -4.31 121.20 122.46 2mob s ILE 67 Ca 0.00 -0.37 0.07 0.00 -1.10 0.00 0.00 60.65 59.25 2mob s ILE 67 Cb 0.00 -3.44 -0.04 0.00 -1.06 0.00 0.00 42.46 37.92 2mob s ILE 67 CO 0.00 0.24 -0.02 0.54 -0.10 0.00 0.00 174.94 175.60 2mob s VAL 68 N -1.37 3.71 -0.32 2.92 0.11 -0.85 -4.98 120.40 119.62 2mob s VAL 68 Ca 0.29 -1.33 0.02 0.00 -2.93 0.00 0.00 61.98 58.03 2mob s VAL 68 Cb -0.13 -2.83 0.08 0.00 -1.53 0.00 0.00 36.38 31.98 2mob s VAL 68 CO 0.21 -0.04 0.01 -0.69 -3.33 0.00 0.00 175.10 171.26 2mob s VAL 69 N -1.58 2.49 -1.44 2.04 1.01 -1.26 -0.96 120.40 120.69 2mob s VAL 69 Ca 0.26 -1.93 -0.10 0.00 0.00 0.00 0.00 61.98 60.21 2mob s VAL 69 Cb -0.10 -2.64 0.05 0.00 0.00 0.00 0.00 36.38 33.69 2mob s VAL 69 CO 0.18 -0.35 2.40 -0.62 0.00 0.00 0.00 175.10 176.70 2mob n GLU 70 N 4.41 3.61 -3.20 2.72 -0.58 0.85 -4.92 120.64 123.53 2mob n GLU 70 Ca -0.05 -2.85 -0.41 0.00 -0.42 0.00 0.00 57.16 53.42 2mob n GLU 70 Cb 0.42 -2.94 -0.07 0.00 -0.57 0.00 0.00 31.44 28.28 2mob n GLU 70 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2mob s ASP 71 N 1.84 6.40 -0.06 1.62 -1.08 -1.23 -1.66 116.67 122.49 2mob s ASP 71 Ca 0.53 0.28 -0.09 0.00 -0.52 0.00 0.00 52.55 52.75 2mob s ASP 71 Cb 0.15 -2.29 0.02 0.00 -1.46 0.00 0.00 42.92 39.34 2mob s ASP 71 CO -0.06 -0.42 0.24 -0.75 0.52 0.00 0.00 175.17 174.70 2mob s LYS 72 N 2.44 0.39 -0.94 4.34 2.20 -1.06 -5.02 119.74 122.09 2mob s LYS 72 Ca 0.21 0.12 -0.23 0.00 -0.36 0.00 0.00 55.97 55.71 2mob s LYS 72 Cb -0.15 0.18 -0.24 0.00 -1.51 0.00 0.00 37.83 36.11 2mob s LYS 72 CO 0.12 -0.07 2.48 0.00 -0.36 0.00 0.00 175.35 177.51 2mob n ALA 73 N 2.39 0.61 0.00 3.13 0.00 -1.26 -1.69 120.51 123.70 2mob n ALA 73 Ca -0.16 -0.58 0.00 0.00 0.00 0.00 0.00 53.44 52.70 2mob n ALA 73 Cb 0.57 -2.46 0.00 0.00 0.00 0.00 0.00 19.45 17.56 2mob n ALA 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2mob n GLY 74 N 6.15 1.55 3.15 0.00 0.00 -1.26 -5.12 105.19 109.65 2mob n GLY 74 Ca 0.63 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 46.45 2mob n GLY 74 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2mob s PHE 75 N 0.00 0.65 -0.72 1.61 -0.12 -0.68 -4.02 117.98 114.70 2mob s PHE 75 Ca 0.00 -1.09 0.04 0.00 -0.05 0.00 0.00 56.93 55.83 2mob s PHE 75 Cb 0.00 -0.38 0.21 0.00 -0.63 0.00 0.00 43.02 42.22 2mob s PHE 75 CO 0.00 -0.49 0.68 1.87 -0.05 0.00 0.00 175.22 177.23 2mob n TRP 76 N -0.03 3.50 -3.69 3.49 -0.00 -0.98 -2.56 117.44 117.18 2mob n TRP 76 Ca -0.09 -4.16 -0.32 0.00 -0.00 0.00 0.00 57.50 52.93 2mob n TRP 76 Cb 0.63 -0.69 -0.05 0.00 -0.00 0.00 0.00 31.31 31.20 2mob n TRP 76 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 177.69 176.11 2mob s TRP 77 N -1.93 3.50 -0.11 5.87 0.52 -0.66 -1.96 118.94 124.16 2mob s TRP 77 Ca 0.32 0.56 -0.06 0.00 0.02 0.00 0.00 56.10 56.94 2mob s TRP 77 Cb 0.04 -2.00 0.05 0.00 -1.15 0.00 0.00 33.47 30.40 2mob s TRP 77 CO -0.09 0.47 0.26 0.42 0.02 0.00 0.00 176.95 178.02 2mob s ILE 78 N -1.59 -0.04 0.33 2.03 1.09 0.70 0.29 121.20 124.01 2mob s ILE 78 Ca 0.39 0.14 0.02 0.00 -1.10 0.00 0.00 60.65 60.10 2mob s ILE 78 Cb -0.12 -0.39 -0.03 0.00 -1.06 0.00 0.00 42.46 40.85 2mob s ILE 78 CO 0.23 0.06 0.51 -0.75 -0.10 0.00 0.00 174.94 174.89 2mob s LYS 79 N 1.24 3.41 -0.12 2.79 2.20 -0.13 0.86 119.74 129.98 2mob s LYS 79 Ca -0.09 -0.49 -0.13 0.00 -0.36 0.00 0.00 55.97 54.90 2mob s LYS 79 Cb -0.10 -2.71 0.03 0.00 -1.51 0.00 0.00 37.83 33.54 2mob s LYS 79 CO -0.09 0.17 0.36 0.00 -0.36 0.00 0.00 175.35 175.43 2mob s ALA 80 N -2.26 -0.89 -0.71 3.13 0.00 0.11 -2.01 121.76 119.14 2mob s ALA 80 Ca 0.40 0.93 0.01 0.00 0.00 0.00 0.00 51.96 53.30 2mob s ALA 80 Cb -0.09 -0.50 0.37 0.00 0.00 0.00 0.00 23.12 22.90 2mob s ALA 80 CO 0.34 -0.19 1.69 -3.47 0.00 0.00 0.00 175.76 174.13 2mob n ASP 81 N 2.64 6.49 0.00 0.00 -0.08 -1.26 -1.16 116.55 123.18 2mob n ASP 81 Ca -0.14 -3.79 0.00 0.00 -1.51 0.00 0.00 54.79 49.35 2mob n ASP 81 Cb 0.57 -0.85 0.00 0.00 2.34 0.00 0.00 41.12 43.18 2mob n ASP 81 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2mob n GLY 82 N -0.50 -0.02 3.26 0.27 0.00 -1.26 -4.59 105.19 102.34 2mob n GLY 82 Ca 0.48 0.53 -0.27 0.00 0.00 0.00 0.00 46.02 46.76 2mob n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2mob s ALA 83 N -1.00 1.83 0.08 4.61 0.00 -1.26 -3.62 121.76 122.39 2mob s ALA 83 Ca 0.00 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 50.87 2mob s ALA 83 Cb 0.00 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 22.70 2mob s ALA 83 CO 0.00 0.43 0.07 -1.50 0.00 0.00 0.00 175.76 174.75 2mob s ILE 84 N -0.71 0.18 -0.10 0.00 1.10 -0.93 -4.97 121.20 115.76 2mob s ILE 84 Ca 0.08 -1.57 0.00 0.00 -0.51 0.00 0.00 60.65 58.65 2mob s ILE 84 Cb -0.09 -1.51 0.02 0.00 0.15 0.00 0.00 42.46 41.03 2mob s ILE 84 CO 0.01 -0.80 -0.08 -1.61 -2.11 0.00 0.00 174.94 170.34 2mob s GLU 85 N -3.91 1.52 0.73 3.50 2.02 -1.26 -1.27 118.70 120.02 2mob s GLU 85 Ca 0.08 -0.28 -0.12 0.00 0.02 0.00 0.00 54.97 54.68 2mob s GLU 85 Cb 0.07 -1.50 0.03 0.00 0.10 0.00 0.00 34.13 32.82 2mob s GLU 85 CO -0.09 -0.19 1.11 0.42 0.02 0.00 0.00 175.26 176.53 2mob s ILE 86 N 1.44 3.22 -0.22 -1.63 -1.09 -0.17 -4.90 121.20 117.86 2mob s ILE 86 Ca -0.00 0.40 -0.19 0.00 -2.23 0.00 0.00 60.65 58.62 2mob s ILE 86 Cb -0.13 -3.37 0.06 0.00 -1.58 0.00 0.00 42.46 37.43 2mob s ILE 86 CO -0.05 -0.52 0.57 -1.81 -1.23 0.00 0.00 174.94 171.90 2mob s ASP 87 N -4.36 -0.60 0.00 3.58 1.01 -1.26 -1.88 116.67 113.16 2mob s ASP 87 Ca 0.59 1.16 0.00 0.00 0.71 0.00 0.00 52.55 55.01 2mob s ASP 87 Cb -0.11 1.16 0.00 0.00 1.01 0.00 0.00 42.92 44.98 2mob s ASP 87 CO 0.52 -0.20 0.00 0.00 0.21 0.00 0.00 175.17 175.70 2mob n ALA 88 N 2.86 0.49 -0.26 5.23 0.00 -1.26 -4.86 120.51 122.71 2mob n ALA 88 Ca -0.14 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.28 2mob n ALA 88 Cb 0.56 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.06 2mob n ALA 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2mob h ALA 89 N 0.00 0.20 -0.60 0.00 0.00 -1.79 1.92 119.26 118.99 2mob h ALA 89 Ca 0.00 0.24 0.04 0.00 0.00 0.00 0.00 54.91 55.19 2mob h ALA 89 Cb 0.00 0.76 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 2mob h ALA 89 CO 0.00 -0.57 0.35 1.05 0.00 0.00 0.00 179.25 180.08 2mob h GLU 90 N -0.07 0.66 -0.29 0.00 4.11 -1.92 0.44 114.58 117.51 2mob h GLU 90 Ca 0.31 -0.04 -0.08 0.00 0.07 0.00 0.00 59.36 59.62 2mob h GLU 90 Cb 0.57 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 2mob h GLU 90 CO -0.79 0.44 -0.16 0.00 0.07 0.00 0.00 179.01 178.57 2mob h ALA 91 N 1.28 1.19 0.38 1.06 0.00 -0.19 -1.30 119.26 121.68 2mob h ALA 91 Ca 0.25 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2mob h ALA 91 Cb 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2mob h ALA 91 CO -0.13 0.52 -0.18 0.78 0.00 0.00 0.00 179.25 180.24 2mob h GLY 92 N 0.96 -0.53 1.47 0.00 0.00 0.42 -1.89 103.07 103.50 2mob h GLY 92 Ca 0.08 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.61 2mob h GLY 92 CO 0.04 -0.19 0.26 1.05 0.00 0.00 0.00 176.54 177.69 2mob h GLU 93 N -0.97 0.00 0.05 4.80 4.11 -0.14 1.78 114.58 124.21 2mob h GLU 93 Ca -0.05 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.38 2mob h GLU 93 Cb 0.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.78 2mob h GLU 93 CO 0.09 0.00 -0.02 1.25 0.07 0.00 0.00 179.01 180.39 2mob h LEU 94 N 0.00 -0.06 0.05 3.06 6.46 -0.85 -3.40 115.31 120.58 2mob h LEU 94 Ca 0.00 0.00 -0.15 0.00 -0.12 0.00 0.00 57.88 57.62 2mob h LEU 94 Cb 0.52 0.01 0.01 0.00 -0.73 0.00 0.00 40.66 40.48 2mob h LEU 94 CO 0.00 0.34 -0.60 0.17 -0.62 0.00 0.00 178.44 177.73 2mob h LEU 95 N -0.84 0.44 0.00 2.25 8.10 -0.94 -3.47 115.31 120.85 2mob h LEU 95 Ca -0.01 -0.85 0.00 0.00 0.11 0.00 0.00 57.88 57.13 2mob h LEU 95 Cb 0.05 -0.14 0.00 0.00 -0.44 0.00 0.00 40.66 40.13 2mob h LEU 95 CO 0.01 1.24 0.00 0.61 -4.11 0.00 0.00 178.44 176.19 2mob n GLY 96 N 1.32 -0.63 0.00 0.17 0.00 0.27 -5.09 105.19 101.22 2mob n GLY 96 Ca -0.12 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2mob n GLY 96 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2mob n LYS 97 N -1.72 0.00 0.25 1.61 4.81 0.53 -4.18 118.16 119.46 2mob n LYS 97 Ca 0.00 0.00 0.14 0.00 -0.87 0.00 0.00 58.31 57.58 2mob n LYS 97 Cb 0.00 0.00 0.49 0.00 0.02 0.00 0.00 35.03 35.54 2mob n LYS 97 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 2mob h PRO 98 N 0.00 0.00 -0.49 1.64 0.13 -1.95 -3.23 132.00 128.10 2mob h PRO 98 Ca 0.00 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.23 2mob h PRO 98 Cb 0.00 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 31.04 2mob h PRO 98 CO 0.00 0.08 -0.13 0.35 -0.23 0.00 0.00 178.00 178.07 2mob h PHE 99 N 0.00 -0.27 -0.07 1.56 3.04 -1.92 -2.67 116.94 116.61 2mob h PHE 99 Ca -0.00 0.04 0.01 0.00 3.98 0.00 0.00 57.97 62.00 2mob h PHE 99 Cb 0.72 0.20 -0.01 0.00 2.56 0.00 0.00 35.95 39.41 2mob h PHE 99 CO 0.00 -0.22 -0.04 -1.13 -2.02 0.00 0.00 178.31 174.90 2mob n SER 100 N -5.36 -0.08 0.16 0.41 3.41 -1.22 0.69 113.62 111.63 2mob n SER 100 Ca 0.04 0.63 -0.12 0.00 -0.26 0.00 0.00 58.87 59.17 2mob n SER 100 Cb 0.26 -0.27 -0.07 0.00 -0.26 0.00 0.00 64.21 63.87 2mob n SER 100 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 2mob h VAL 101 N 0.00 0.53 -0.99 -3.33 2.07 -1.76 -1.11 116.25 111.66 2mob h VAL 101 Ca 0.01 -0.71 0.27 0.00 0.82 0.00 0.00 66.70 67.09 2mob h VAL 101 Cb 0.03 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 30.56 2mob h VAL 101 CO -0.07 0.11 0.69 0.22 0.02 0.00 0.00 177.57 178.55 2mob h TYR 102 N -0.92 0.20 0.00 1.57 5.03 -1.12 2.06 116.97 123.80 2mob h TYR 102 Ca -0.05 0.01 -0.15 0.00 2.58 0.00 0.00 58.73 61.12 2mob h TYR 102 Cb 0.52 -0.06 -0.02 0.00 1.55 0.00 0.00 36.73 38.72 2mob h TYR 102 CO 0.03 0.03 -0.73 0.22 -1.32 0.00 0.00 178.16 176.39 2mob h ASP 103 N 0.13 0.00 -0.08 -2.11 1.82 0.34 -2.82 116.42 113.70 2mob h ASP 103 Ca 0.50 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 57.13 2mob h ASP 103 Cb 1.73 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 41.73 2mob h ASP 103 CO -0.09 0.73 0.01 0.17 -1.61 0.00 0.00 179.24 178.45 2mob h LEU 104 N 0.00 0.14 -2.05 2.28 8.10 0.46 1.51 115.31 125.75 2mob h LEU 104 Ca -0.01 -0.29 -0.01 0.00 0.11 0.00 0.00 57.88 57.68 2mob h LEU 104 Cb 1.40 -0.04 -0.00 0.00 -0.44 0.00 0.00 40.66 41.58 2mob h LEU 104 CO 0.10 0.39 -0.07 -0.07 -4.11 0.00 0.00 178.44 174.68 2mob h LEU 105 N -0.13 0.00 0.00 0.17 3.38 -1.05 2.55 115.31 120.23 2mob h LEU 105 Ca 0.02 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 2mob h LEU 105 Cb 0.32 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2mob h LEU 105 CO 0.00 0.07 -1.78 -0.38 0.09 0.00 0.00 178.44 176.44 2mob n ILE 106 N -3.41 0.57 -0.05 1.22 -0.00 -0.93 -4.40 119.36 112.36 2mob n ILE 106 Ca -0.02 -0.61 -0.04 0.00 -0.00 0.00 0.00 62.75 62.09 2mob n ILE 106 Cb 0.22 -0.27 -0.09 0.00 -0.00 0.00 0.00 39.64 39.49 2mob n ILE 106 CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 176.55 176.09 2mob n ASN 107 N -2.53 2.10 0.00 4.38 0.23 0.51 -4.41 115.26 115.53 2mob n ASN 107 Ca -0.09 0.00 0.08 0.00 -0.53 0.00 0.00 54.58 54.04 2mob n ASN 107 Cb 0.72 0.89 0.48 0.00 -2.08 0.00 0.00 39.78 39.78 2mob n ASN 107 CO 0.00 0.00 0.00 0.55 -0.93 0.00 0.00 177.26 176.88 2mob n VAL 108 N -2.37 0.00 -0.33 3.53 3.14 0.85 -4.00 118.33 119.15 2mob n VAL 108 Ca -0.17 0.00 0.31 0.00 -2.96 0.00 0.00 64.34 61.52 2mob n VAL 108 Cb 0.81 -0.70 0.47 0.00 -1.06 0.00 0.00 33.84 33.37 2mob n VAL 108 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 2mob n SER 109 N -0.97 0.00 -1.13 6.55 2.88 -1.26 0.05 113.62 119.75 2mob n SER 109 Ca 0.12 0.69 0.00 0.00 -1.33 0.00 0.00 58.87 58.35 2mob n SER 109 Cb 0.06 -0.28 0.00 0.00 -0.75 0.00 0.00 64.21 63.23 2mob n SER 109 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2mob n SER 110 N -3.14 3.32 -2.36 -3.46 3.41 -1.26 -4.28 113.62 105.86 2mob n SER 110 Ca 0.26 -1.98 -0.29 0.00 -0.26 0.00 0.00 58.87 56.60 2mob n SER 110 Cb 1.41 -0.61 0.03 0.00 -0.26 0.00 0.00 64.21 64.78 2mob n SER 110 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2mob n THR 111 N 0.77 3.31 -0.21 6.66 -2.24 0.11 -3.96 114.28 118.72 2mob n THR 111 Ca 0.00 -2.86 0.00 0.00 -2.27 0.00 0.00 64.05 58.92 2mob n THR 111 Cb 0.47 -1.33 0.24 0.00 -2.10 0.00 0.00 70.33 67.60 2mob n THR 111 CO 0.00 0.00 0.00 -0.37 -0.57 0.00 0.00 175.07 174.13 2mob h VAL 112 N 1.44 1.20 0.00 2.28 -1.51 -1.85 -3.32 116.25 114.49 2mob h VAL 112 Ca 0.46 -0.42 0.00 0.00 -1.23 0.00 0.00 66.70 65.51 2mob h VAL 112 Cb 0.66 0.17 0.00 0.00 -2.13 0.00 0.00 31.29 29.99 2mob h VAL 112 CO 1.16 0.20 0.00 0.61 -1.23 0.00 0.00 177.57 178.31 2mob n GLY 113 N -1.34 -0.01 0.26 5.19 0.00 -1.26 -5.01 105.19 103.02 2mob n GLY 113 Ca 0.08 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.08 2mob n GLY 113 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2mob n ARG 114 N -1.23 0.05 -2.72 1.61 0.63 -0.97 -4.83 116.66 109.20 2mob n ARG 114 Ca 0.00 -0.23 -0.05 0.00 -0.92 0.00 0.00 57.85 56.64 2mob n ARG 114 Cb 0.00 0.21 0.04 0.00 0.45 0.00 0.00 32.46 33.16 2mob n ARG 114 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2mob n ALA 115 N -2.82 -2.38 -2.66 5.13 0.00 -1.19 -4.30 120.51 112.29 2mob n ALA 115 Ca -0.01 -0.82 -0.42 0.00 0.00 0.00 0.00 53.44 52.18 2mob n ALA 115 Cb 0.05 -2.07 -0.03 0.00 0.00 0.00 0.00 19.45 17.39 2mob n ALA 115 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 2mob s TYR 116 N 0.70 3.38 0.48 0.00 5.04 0.27 -4.73 117.35 122.49 2mob s TYR 116 Ca 0.29 1.41 -0.11 0.00 -2.44 0.00 0.00 57.07 56.22 2mob s TYR 116 Cb 0.13 -3.18 -0.06 0.00 0.35 0.00 0.00 41.96 39.20 2mob s TYR 116 CO -0.13 -0.39 0.87 0.99 -1.34 0.00 0.00 175.55 175.55 2mob s THR 117 N 2.78 4.73 -0.26 4.34 2.01 -1.26 0.22 115.64 128.21 2mob s THR 117 Ca 0.43 0.74 0.14 0.00 0.31 0.00 0.00 61.69 63.30 2mob s THR 117 Cb -0.16 -3.77 0.47 0.00 0.01 0.00 0.00 72.50 69.05 2mob s THR 117 CO 0.09 -0.72 1.16 0.18 -0.69 0.00 0.00 174.62 174.65 2mob n LEU 118 N -1.76 3.37 0.00 4.42 4.32 0.36 -4.84 117.00 122.88 2mob n LEU 118 Ca 0.04 -3.93 0.00 0.00 -0.02 0.00 0.00 56.01 52.10 2mob n LEU 118 Cb 0.54 -0.06 0.00 0.00 -1.62 0.00 0.00 43.42 42.28 2mob n LEU 118 CO 0.50 1.59 0.00 0.61 -1.22 0.00 0.00 177.39 178.87 2mob n GLY 119 N -0.64 0.63 0.00 -0.72 0.00 -1.26 -2.51 105.19 100.69 2mob n GLY 119 Ca 0.27 -0.01 0.02 0.00 0.00 0.00 0.00 46.02 46.30 2mob n GLY 119 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2mob n THR 120 N 0.00 0.00 -3.71 2.61 -2.24 -1.26 -4.99 114.28 104.69 2mob n THR 120 Ca 0.00 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2mob n THR 120 Cb 0.00 0.83 0.00 0.00 -2.10 0.00 0.00 70.33 69.06 2mob n THR 120 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2mob n LYS 121 N -1.27 2.37 -3.77 -0.78 4.01 -1.04 -3.02 118.16 114.66 2mob n LYS 121 Ca 0.00 0.00 -0.10 0.00 -0.51 0.00 0.00 58.31 57.71 2mob n LYS 121 Cb 0.10 0.00 -0.04 0.00 -0.51 0.00 0.00 35.03 34.57 2mob n LYS 121 CO 0.00 0.00 0.00 0.12 -1.11 0.00 0.00 177.40 176.41 2mob s PHE 122 N -0.53 -0.03 0.02 2.13 2.19 -0.78 -0.48 117.98 120.50 2mob s PHE 122 Ca 0.00 -0.32 -0.15 0.00 0.33 0.00 0.00 56.93 56.80 2mob s PHE 122 Cb 0.00 0.29 0.02 0.00 -1.31 0.00 0.00 43.02 42.02 2mob s PHE 122 CO 0.00 -0.85 0.32 0.99 1.83 0.00 0.00 175.22 177.50 2mob s THR 123 N -3.88 0.07 0.00 0.12 2.01 0.61 -1.00 115.64 113.56 2mob s THR 123 Ca 0.10 -0.59 -0.02 0.00 0.31 0.00 0.00 61.69 61.49 2mob s THR 123 Cb 0.00 -0.82 -0.01 0.00 0.01 0.00 0.00 72.50 71.68 2mob s THR 123 CO -0.03 -0.32 0.03 -0.63 -0.69 0.00 0.00 174.62 172.98 2mob s ILE 124 N -2.09 0.06 0.27 1.82 1.09 -0.40 0.97 121.20 122.92 2mob s ILE 124 Ca -0.08 -0.47 0.03 0.00 -1.10 0.00 0.00 60.65 59.03 2mob s ILE 124 Cb -0.02 -0.21 -0.04 0.00 -1.06 0.00 0.00 42.46 41.13 2mob s ILE 124 CO -0.00 -0.26 0.19 0.28 -0.10 0.00 0.00 174.94 175.05 2mob s THR 125 N -0.79 0.09 0.00 2.92 -1.32 -1.26 -2.19 115.64 113.09 2mob s THR 125 Ca -0.09 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.39 2mob s THR 125 Cb -0.05 -2.50 0.00 0.00 -1.51 0.00 0.00 72.50 68.43 2mob s THR 125 CO -0.00 0.00 0.00 -1.54 -2.21 0.00 0.00 174.62 170.87 2mob n SER 126 N -0.87 0.00 -4.72 8.08 3.41 -1.24 -2.29 113.62 115.99 2mob n SER 126 Ca 0.04 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.24 2mob n SER 126 Cb 0.64 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 64.55 2mob n SER 126 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2mob s GLU 127 N 1.13 4.56 0.00 4.33 0.41 -1.26 -4.79 118.70 123.07 2mob s GLU 127 Ca 0.00 1.26 0.00 0.00 -0.41 0.00 0.00 54.97 55.82 2mob s GLU 127 Cb 0.00 -3.42 0.00 0.00 -1.78 0.00 0.00 34.13 28.93 2mob s GLU 127 CO 0.00 0.10 0.00 1.47 -0.49 0.00 0.00 175.26 176.34