#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 -3.75 -3.46 3.02 -1.26 -4.73 115.26 105.08 2mob n ASN 36 Ca 0.00 0.00 -0.34 0.00 -0.03 0.00 0.00 54.58 54.21 2mob n ASN 36 Cb 0.00 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.20 2mob n ASN 36 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2mob n ALA 37 N 5.67 -4.81 -3.41 5.41 0.00 -1.26 -4.68 120.51 117.42 2mob n ALA 37 Ca 0.00 -0.52 -0.22 0.00 0.00 0.00 0.00 53.44 52.71 2mob n ALA 37 Cb 0.00 -1.11 -0.16 0.00 0.00 0.00 0.00 19.45 18.18 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 -1.85 0.84 0.56 0.00 0.11 -0.88 -4.93 120.40 114.25 2mob s VAL 38 Ca 0.40 -0.33 -0.01 0.00 -2.93 0.00 0.00 61.98 59.12 2mob s VAL 38 Cb -0.23 -0.79 0.03 0.00 -1.53 0.00 0.00 36.38 33.86 2mob s VAL 38 CO 0.74 0.28 0.81 0.54 -3.33 0.00 0.00 175.10 174.14 2mob s VAL 39 N 0.62 2.93 -0.03 2.04 0.11 -1.26 -2.04 120.40 122.78 2mob s VAL 39 Ca -0.11 -0.51 0.02 0.00 -2.93 0.00 0.00 61.98 58.45 2mob s VAL 39 Cb -0.14 -3.13 0.01 0.00 -1.53 0.00 0.00 36.38 31.59 2mob s VAL 39 CO 0.02 -0.10 -0.06 -0.22 -3.33 0.00 0.00 175.10 171.40 2mob s LEU 40 N -4.83 1.64 -0.04 2.54 2.96 0.52 -4.45 118.68 117.03 2mob s LEU 40 Ca 0.56 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 54.33 2mob s LEU 40 Cb -0.10 -0.43 0.03 0.00 0.50 0.00 0.00 46.19 46.19 2mob s LEU 40 CO 0.40 0.01 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.75 2mob s VAL 41 N 0.43 0.25 0.17 1.68 1.01 -1.26 0.25 120.40 122.93 2mob s VAL 41 Ca -0.06 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.02 2mob s VAL 41 Cb -0.10 -0.36 -0.01 0.00 0.00 0.00 0.00 36.38 35.92 2mob s VAL 41 CO 0.00 0.18 0.07 0.18 0.00 0.00 0.00 175.10 175.53 2mob n LEU 42 N 4.36 0.00 -4.87 3.92 7.99 -0.88 -4.04 117.00 123.48 2mob n LEU 42 Ca -0.21 -1.32 -0.30 0.00 -0.01 0.00 0.00 56.01 54.16 2mob n LEU 42 Cb 0.50 0.46 -0.01 0.00 -0.11 0.00 0.00 43.42 44.26 2mob n LEU 42 CO 0.19 -0.21 0.61 0.00 -1.51 0.00 0.00 177.39 176.48 2mob s MET 43 N -2.65 3.69 -0.88 3.23 0.23 -1.26 -1.80 119.30 119.85 2mob s MET 43 Ca 0.09 0.63 -0.21 0.00 -1.03 0.00 0.00 55.69 55.17 2mob s MET 43 Cb 0.00 -2.21 -0.22 0.00 -1.53 0.00 0.00 34.83 30.87 2mob s MET 43 CO 0.07 -0.34 2.40 0.36 -2.03 0.00 0.00 175.02 175.48 2mob n LYS 44 N -2.16 0.27 0.00 3.16 2.85 -1.23 -3.64 118.16 117.41 2mob n LYS 44 Ca 0.04 -0.17 0.08 0.00 -1.05 0.00 0.00 58.31 57.22 2mob n LYS 44 Cb 0.54 -2.05 0.49 0.00 -0.65 0.00 0.00 35.03 33.36 2mob n LYS 44 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 177.40 177.78 2mob n SER 45 N 11.17 0.00 0.00 -5.58 7.64 -1.26 -4.88 113.62 120.71 2mob n SER 45 Ca 0.59 -1.29 0.00 0.00 1.01 0.00 0.00 58.87 59.18 2mob n SER 45 Cb 0.23 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 2mob n SER 45 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2mob n ASP 46 N -0.79 0.00 -0.36 6.43 8.00 -1.26 -4.09 116.55 124.48 2mob n ASP 46 Ca 0.13 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.63 2mob n ASP 46 Cb 0.06 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.16 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 0.00 1.05 0.07 -1.24 1.02 -1.26 -4.36 120.64 115.92 2mob n GLU 47 Ca 0.00 -0.05 -0.03 0.00 -0.02 0.00 0.00 57.16 57.06 2mob n GLU 47 Cb 0.00 -1.35 -0.01 0.00 -0.02 0.00 0.00 31.44 30.06 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 0.07 0.00 -1.70 -3.67 -2.65 -1.97 1.26 117.51 108.85 2mob h ILE 48 Ca 0.00 -0.05 0.51 0.00 1.03 0.00 0.00 64.86 66.36 2mob h ILE 48 Cb 0.36 0.00 -0.09 0.00 -2.05 0.00 0.00 36.82 35.04 2mob h ILE 48 CO 0.01 0.00 1.20 -0.67 0.03 0.00 0.00 178.15 178.71 2mob n ASP 49 N -2.60 0.05 -0.04 2.16 2.03 -1.26 0.31 116.55 117.20 2mob n ASP 49 Ca -0.02 1.02 -0.05 0.00 0.52 0.00 0.00 54.79 56.26 2mob n ASP 49 Cb 0.07 -0.51 -0.05 0.00 -0.72 0.00 0.00 41.12 39.91 2mob n ASP 49 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2mob h ALA 50 N 1.07 -0.03 -0.17 -1.67 0.00 -1.73 -2.62 119.26 114.12 2mob h ALA 50 Ca 0.86 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 55.47 2mob h ALA 50 Cb 3.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 21.11 2mob h ALA 50 CO -0.12 -0.04 -0.43 -0.84 0.00 0.00 0.00 179.25 177.82 2mob h ILE 51 N -1.00 1.34 -0.51 0.00 3.07 0.74 -0.18 117.51 120.97 2mob h ILE 51 Ca -0.00 -1.68 0.09 0.00 1.55 0.00 0.00 64.86 64.81 2mob h ILE 51 Cb 0.36 1.97 -0.07 0.00 -0.27 0.00 0.00 36.82 38.80 2mob h ILE 51 CO 0.01 0.52 0.08 0.40 -1.05 0.00 0.00 178.15 178.10 2mob h ILE 52 N 0.24 0.68 0.54 0.16 1.08 0.48 3.70 117.51 124.39 2mob h ILE 52 Ca -0.01 -0.07 -0.02 0.00 -0.39 0.00 0.00 64.86 64.38 2mob h ILE 52 Cb 1.04 0.46 -0.01 0.00 -3.07 0.00 0.00 36.82 35.24 2mob h ILE 52 CO 0.09 0.04 -0.37 -0.08 -0.69 0.00 0.00 178.15 177.14 2mob h GLU 53 N 0.20 -0.85 0.00 2.37 4.22 -1.29 3.29 114.58 122.52 2mob h GLU 53 Ca 0.26 0.06 -0.01 0.00 0.08 0.00 0.00 59.36 59.75 2mob h GLU 53 Cb 0.36 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 2mob h GLU 53 CO -0.36 -0.56 -0.03 0.22 -2.18 0.00 0.00 179.01 176.10 2mob h ASP 54 N -0.88 0.00 0.00 1.04 1.82 -0.23 -1.34 116.42 116.83 2mob h ASP 54 Ca -0.06 0.00 -0.26 0.00 -0.39 0.00 0.00 57.03 56.32 2mob h ASP 54 Cb 0.73 0.00 -0.05 0.00 0.68 0.00 0.00 39.33 40.69 2mob h ASP 54 CO 0.03 0.03 -1.96 -0.38 -1.61 0.00 0.00 179.24 175.35 2mob n ILE 55 N -3.11 0.96 -0.03 2.25 2.08 1.22 -3.96 119.36 118.77 2mob n ILE 55 Ca 0.03 -0.59 -0.05 0.00 0.56 0.00 0.00 62.75 62.71 2mob n ILE 55 Cb 0.50 -0.65 -0.03 0.00 -0.75 0.00 0.00 39.64 38.72 2mob n ILE 55 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 2mob n VAL 56 N -2.54 0.36 0.14 1.39 0.31 0.89 -0.01 118.33 118.86 2mob n VAL 56 Ca -0.23 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 63.98 2mob n VAL 56 Cb 0.95 -0.91 0.29 0.00 -0.91 0.00 0.00 33.84 33.27 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 0.12 0.00 7.52 7.12 0.53 2.40 115.31 132.94 2mob h LEU 57 Ca -0.14 -0.04 -0.26 0.00 0.13 0.00 0.00 57.88 57.56 2mob h LEU 57 Cb 1.20 -0.03 -0.04 0.00 -0.53 0.00 0.00 40.66 41.25 2mob h LEU 57 CO -0.04 0.50 -1.94 0.29 -0.13 0.00 0.00 178.44 177.12 2mob n LYS 58 N -4.06 0.39 0.02 1.25 5.02 -0.56 -4.15 118.16 116.07 2mob n LYS 58 Ca -0.02 0.12 -0.21 0.00 -2.02 0.00 0.00 58.31 56.18 2mob n LYS 58 Cb 0.44 -1.24 -0.14 0.00 -0.02 0.00 0.00 35.03 34.07 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 0.52 0.31 0.28 0.72 0.00 -1.66 -3.25 103.07 99.99 2mob h GLY 59 Ca -0.39 -0.80 -0.01 0.00 0.00 0.00 0.00 47.33 46.12 2mob h GLY 59 CO -0.14 0.70 -0.13 -1.33 0.00 0.00 0.00 176.54 175.64 2mob h GLY 60 N 0.03 -0.39 0.64 4.60 0.00 0.21 -3.16 103.07 105.00 2mob h GLY 60 Ca -0.28 0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.20 2mob h GLY 60 CO 0.09 -0.14 0.00 1.17 0.00 0.00 0.00 176.54 177.66 2mob n LYS 61 N -3.72 0.00 0.18 4.80 0.00 0.78 -3.06 118.16 117.14 2mob n LYS 61 Ca -0.05 0.00 -0.11 0.00 0.00 0.00 0.00 58.31 58.16 2mob n LYS 61 Cb 0.15 -1.32 -0.06 0.00 0.00 0.00 0.00 35.03 33.80 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 1.63 -1.00 0.00 3.14 0.00 -1.58 -3.14 119.26 118.30 2mob h ALA 62 Ca 0.00 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 2mob h ALA 62 Cb 0.00 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2mob h ALA 62 CO 0.00 -1.02 -1.29 1.63 0.00 0.00 0.00 179.25 178.57 2mob n LYS 63 N -4.16 0.62 -2.19 0.00 5.02 -1.23 -4.87 118.16 111.35 2mob n LYS 63 Ca -0.07 0.16 -0.41 0.00 -2.02 0.00 0.00 58.31 55.97 2mob n LYS 63 Cb 0.27 -1.80 -0.03 0.00 -0.02 0.00 0.00 35.03 33.46 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 -5.55 6.86 0.13 4.39 0.01 -1.17 -4.94 114.94 114.67 2mob s ASN 64 Ca -0.02 2.45 -0.16 0.00 -0.71 0.00 0.00 52.86 54.41 2mob s ASN 64 Cb 0.09 -2.61 -0.01 0.00 0.41 0.00 0.00 41.25 39.13 2mob s ASN 64 CO 0.81 -0.54 1.69 1.55 -1.51 0.00 0.00 177.10 179.09 2mob h PRO 65 N 5.22 0.57 0.00 -0.60 0.13 -1.90 -3.42 132.00 132.00 2mob h PRO 65 Ca -0.45 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 2mob h PRO 65 Cb 1.22 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2mob h PRO 65 CO 0.77 0.53 0.00 0.45 -0.23 0.00 0.00 178.00 179.52 2mob n SER 66 N -4.67 0.00 -4.84 1.44 2.88 -1.26 -5.07 113.62 102.09 2mob n SER 66 Ca -0.00 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.17 2mob n SER 66 Cb 0.13 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.53 2mob n SER 66 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2mob s ILE 67 N 0.00 5.25 -0.14 2.46 1.09 -1.26 -4.40 121.20 124.20 2mob s ILE 67 Ca 0.00 0.10 -0.13 0.00 -1.10 0.00 0.00 60.65 59.53 2mob s ILE 67 Cb 0.00 -3.28 -0.05 0.00 -1.06 0.00 0.00 42.46 38.07 2mob s ILE 67 CO 0.00 0.61 0.27 -0.69 -0.10 0.00 0.00 174.94 175.03 2mob s VAL 68 N -1.01 5.31 -0.56 2.92 1.01 -0.14 -4.88 120.40 123.06 2mob s VAL 68 Ca 0.15 0.50 -0.01 0.00 0.00 0.00 0.00 61.98 62.62 2mob s VAL 68 Cb -0.12 -3.59 0.14 0.00 0.00 0.00 0.00 36.38 32.81 2mob s VAL 68 CO 0.04 0.45 0.35 -0.69 0.00 0.00 0.00 175.10 175.25 2mob s VAL 69 N 0.02 3.38 -1.29 2.92 1.01 -1.26 0.18 120.40 125.36 2mob s VAL 69 Ca 0.16 -2.84 -0.12 0.00 0.00 0.00 0.00 61.98 59.19 2mob s VAL 69 Cb -0.13 -3.25 0.14 0.00 0.00 0.00 0.00 36.38 33.14 2mob s VAL 69 CO 0.05 -0.82 1.82 -0.62 0.00 0.00 0.00 175.10 175.53 2mob n GLU 70 N 3.65 3.42 -2.76 2.72 -0.58 0.58 -4.97 120.64 122.70 2mob n GLU 70 Ca 0.05 -3.44 -0.42 0.00 -0.42 0.00 0.00 57.16 52.93 2mob n GLU 70 Cb 0.38 -3.05 -0.03 0.00 -0.57 0.00 0.00 31.44 28.17 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 1.89 7.06 -0.02 1.62 -1.08 -1.26 -0.42 116.67 124.46 2mob s ASP 71 Ca 0.42 1.31 0.02 0.00 -0.52 0.00 0.00 52.55 53.79 2mob s ASP 71 Cb 0.07 -2.51 0.00 0.00 -1.46 0.00 0.00 42.92 39.03 2mob s ASP 71 CO -0.00 -0.51 -0.08 -0.54 0.52 0.00 0.00 175.17 174.55 2mob s LYS 72 N 2.55 0.89 0.59 4.34 -0.14 0.20 -4.95 119.74 123.22 2mob s LYS 72 Ca 0.42 -0.28 0.32 0.00 -1.36 0.00 0.00 55.97 55.08 2mob s LYS 72 Cb -0.16 -0.84 1.23 0.00 -1.68 0.00 0.00 37.83 36.37 2mob s LYS 72 CO 0.11 0.10 1.51 0.00 -0.76 0.00 0.00 175.35 176.31 2mob h ALA 73 N 6.40 3.00 0.00 5.17 0.00 -1.99 0.33 119.26 132.17 2mob h ALA 73 Ca -0.33 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.52 2mob h ALA 73 Cb 1.17 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 2mob h ALA 73 CO 0.49 -1.66 -0.10 0.78 0.00 0.00 0.00 179.25 178.76 2mob h GLY 74 N 0.00 0.00 -3.50 0.00 0.00 -1.97 -3.44 103.07 94.16 2mob h GLY 74 Ca 0.53 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.75 2mob h GLY 74 CO -0.01 0.00 -0.48 -1.36 0.00 0.00 0.00 176.54 174.70 2mob s PHE 75 N -2.22 0.23 -0.78 5.60 0.40 0.12 -3.48 117.98 117.85 2mob s PHE 75 Ca -0.19 -0.63 -0.04 0.00 -0.60 0.00 0.00 56.93 55.47 2mob s PHE 75 Cb -0.02 -0.15 0.20 0.00 0.51 0.00 0.00 43.02 43.56 2mob s PHE 75 CO 0.67 -0.45 0.64 -0.46 0.70 0.00 0.00 175.22 176.32 2mob s TRP 76 N -3.38 3.67 -0.16 0.36 -0.00 -0.75 0.61 118.94 119.30 2mob s TRP 76 Ca 0.01 -2.76 -0.25 0.00 -0.00 0.00 0.00 56.10 53.11 2mob s TRP 76 Cb 0.03 -3.31 -0.02 0.00 -0.00 0.00 0.00 33.47 30.17 2mob s TRP 76 CO -0.08 -0.82 0.79 -1.58 -0.00 0.00 0.00 176.95 175.26 2mob s TRP 77 N -0.61 3.44 0.27 5.86 0.52 0.44 -2.07 118.94 126.79 2mob s TRP 77 Ca 0.22 1.22 0.11 0.00 0.02 0.00 0.00 56.10 57.67 2mob s TRP 77 Cb -0.13 -2.96 -0.05 0.00 -1.15 0.00 0.00 33.47 29.17 2mob s TRP 77 CO -0.08 -0.19 -0.08 0.42 0.02 0.00 0.00 176.95 177.04 2mob s ILE 78 N 1.93 3.03 0.00 2.03 -1.09 0.68 0.22 121.20 128.00 2mob s ILE 78 Ca 0.37 -2.12 -0.01 0.00 -2.23 0.00 0.00 60.65 56.67 2mob s ILE 78 Cb -0.17 -2.62 -0.00 0.00 -1.58 0.00 0.00 42.46 38.08 2mob s ILE 78 CO 0.13 -0.38 0.01 -0.75 -1.23 0.00 0.00 174.94 172.73 2mob s LYS 79 N -3.61 0.14 -0.16 2.79 2.47 0.48 0.20 119.74 122.05 2mob s LYS 79 Ca 0.31 -0.19 -0.15 0.00 -1.56 0.00 0.00 55.97 54.38 2mob s LYS 79 Cb -0.06 0.05 0.04 0.00 -1.46 0.00 0.00 37.83 36.41 2mob s LYS 79 CO 0.18 -0.02 0.43 0.00 0.16 0.00 0.00 175.35 176.10 2mob s ALA 80 N -0.53 -1.07 -1.14 3.13 0.00 -0.86 -0.96 121.76 120.32 2mob s ALA 80 Ca -0.06 1.24 -0.04 0.00 0.00 0.00 0.00 51.96 53.10 2mob s ALA 80 Cb -0.04 -0.72 0.17 0.00 0.00 0.00 0.00 23.12 22.53 2mob s ALA 80 CO -0.00 -0.21 2.28 -3.47 0.00 0.00 0.00 175.76 174.36 2mob n ASP 81 N 2.90 7.70 -0.47 0.00 -0.08 -1.26 -2.06 116.55 123.28 2mob n ASP 81 Ca -0.14 -3.31 0.00 0.00 -1.51 0.00 0.00 54.79 49.84 2mob n ASP 81 Cb 0.57 -1.29 0.00 0.00 2.34 0.00 0.00 41.12 42.74 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 1.12 1.66 3.71 0.27 0.00 -1.26 -4.86 105.19 105.82 2mob n GLY 82 Ca 0.57 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 45.38 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 3.56 0.22 4.61 0.00 -1.26 -4.42 121.76 123.47 2mob s ALA 83 Ca 0.00 1.06 0.09 0.00 0.00 0.00 0.00 51.96 53.11 2mob s ALA 83 Cb 0.00 -3.52 -0.05 0.00 0.00 0.00 0.00 23.12 19.55 2mob s ALA 83 CO 0.00 -0.59 -0.16 -1.50 0.00 0.00 0.00 175.76 173.51 2mob s ILE 84 N 1.14 1.91 0.13 0.00 1.10 -0.83 -5.02 121.20 119.63 2mob s ILE 84 Ca 0.64 -2.26 0.05 0.00 -0.51 0.00 0.00 60.65 58.56 2mob s ILE 84 Cb -0.35 -2.10 -0.04 0.00 0.15 0.00 0.00 42.46 40.11 2mob s ILE 84 CO 0.30 -0.55 -0.11 -1.61 -2.11 0.00 0.00 174.94 170.86 2mob s GLU 85 N -3.61 0.99 0.17 3.50 2.02 -1.26 -1.37 118.70 119.14 2mob s GLU 85 Ca 0.24 -1.31 0.06 0.00 0.02 0.00 0.00 54.97 53.98 2mob s GLU 85 Cb -0.02 -0.68 -0.04 0.00 0.10 0.00 0.00 34.13 33.48 2mob s GLU 85 CO 0.09 0.11 -0.13 0.42 0.02 0.00 0.00 175.26 175.77 2mob s ILE 86 N -2.74 1.45 0.05 -1.63 -1.09 -1.08 -4.95 121.20 111.22 2mob s ILE 86 Ca 0.11 -2.09 -0.22 0.00 -2.23 0.00 0.00 60.65 56.23 2mob s ILE 86 Cb -0.01 -1.90 0.05 0.00 -1.58 0.00 0.00 42.46 39.02 2mob s ILE 86 CO 0.01 -0.64 0.51 -1.81 -1.23 0.00 0.00 174.94 171.78 2mob s ASP 87 N -3.15 -0.42 0.00 3.58 1.11 -1.26 -1.59 116.67 114.94 2mob s ASP 87 Ca 0.18 0.15 0.00 0.00 0.18 0.00 0.00 52.55 53.06 2mob s ASP 87 Cb 0.00 0.49 0.00 0.00 1.07 0.00 0.00 42.92 44.48 2mob s ASP 87 CO 0.04 -0.72 0.00 0.00 1.18 0.00 0.00 175.17 175.67 2mob n ALA 88 N 0.39 0.17 -0.34 5.23 0.00 -1.26 -4.93 120.51 119.78 2mob n ALA 88 Ca -0.18 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.28 2mob n ALA 88 Cb 0.60 0.00 0.09 0.00 0.00 0.00 0.00 19.45 20.14 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 0.40 -1.04 0.00 0.00 -1.85 2.13 119.26 118.91 2mob h ALA 89 Ca 0.00 0.32 0.27 0.00 0.00 0.00 0.00 54.91 55.49 2mob h ALA 89 Cb 0.00 0.83 -0.11 0.00 0.00 0.00 0.00 17.79 18.51 2mob h ALA 89 CO 0.00 -0.50 0.65 1.49 0.00 0.00 0.00 179.25 180.89 2mob h GLU 90 N -0.01 0.43 0.00 0.00 4.81 -1.91 2.20 114.58 120.10 2mob h GLU 90 Ca 0.40 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.50 2mob h GLU 90 Cb 0.64 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.91 2mob h GLU 90 CO -0.95 0.28 -0.66 0.00 -0.73 0.00 0.00 179.01 176.95 2mob h ALA 91 N 1.66 0.12 -1.00 2.92 0.00 0.24 -1.02 119.26 122.18 2mob h ALA 91 Ca 0.62 -0.76 0.21 0.00 0.00 0.00 0.00 54.91 54.98 2mob h ALA 91 Cb 1.46 0.43 -0.11 0.00 0.00 0.00 0.00 17.79 19.57 2mob h ALA 91 CO -0.36 0.41 0.60 0.78 0.00 0.00 0.00 179.25 180.68 2mob h GLY 92 N -1.00 1.83 1.73 0.00 0.00 0.27 0.83 103.07 106.73 2mob h GLY 92 Ca -0.15 -0.34 -0.20 0.00 0.00 0.00 0.00 47.33 46.64 2mob h GLY 92 CO -0.09 -0.14 -0.85 0.83 0.00 0.00 0.00 176.54 176.29 2mob h GLU 93 N 0.69 0.25 0.04 4.80 5.08 0.35 2.23 114.58 128.02 2mob h GLU 93 Ca 0.60 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 2mob h GLU 93 Cb 1.02 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 2mob h GLU 93 CO -0.42 0.96 -0.16 1.25 -1.00 0.00 0.00 179.01 179.64 2mob h LEU 94 N 0.14 -0.49 0.17 1.33 6.46 0.20 -3.26 115.31 119.86 2mob h LEU 94 Ca -0.05 0.05 -0.01 0.00 -0.12 0.00 0.00 57.88 57.76 2mob h LEU 94 Cb 1.47 0.18 0.00 0.00 -0.73 0.00 0.00 40.66 41.58 2mob h LEU 94 CO 0.13 -0.18 -0.08 -0.07 -0.62 0.00 0.00 178.44 177.63 2mob h LEU 95 N -0.24 -0.19 0.00 2.25 4.07 -1.23 -3.48 115.31 116.48 2mob h LEU 95 Ca -0.00 -0.06 0.00 0.00 0.08 0.00 0.00 57.88 57.90 2mob h LEU 95 Cb 0.24 0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.03 2mob h LEU 95 CO -0.09 0.31 0.00 0.61 -1.08 0.00 0.00 178.44 178.19 2mob n GLY 96 N 1.16 1.45 0.00 0.83 0.00 0.75 -5.07 105.19 104.31 2mob n GLY 96 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.77 1.84 0.00 1.61 4.81 -1.19 -4.93 118.16 119.53 2mob n LYS 97 Ca 0.00 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.49 2mob n LYS 97 Cb 0.00 0.00 0.31 0.00 0.02 0.00 0.00 35.03 35.36 2mob n LYS 97 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 2mob n PRO 98 N -0.54 0.31 -0.15 1.64 -0.04 -1.26 -3.92 135.00 131.04 2mob n PRO 98 Ca 0.00 0.03 -0.04 0.00 -0.04 0.00 0.00 63.50 63.45 2mob n PRO 98 Cb 0.00 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 31.93 2mob n PRO 98 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2mob n PHE 99 N -1.05 -0.15 0.00 0.54 -0.00 -1.26 0.39 117.46 115.93 2mob n PHE 99 Ca 0.08 0.43 0.00 0.00 -0.00 0.00 0.00 57.45 57.96 2mob n PHE 99 Cb 0.05 -0.47 0.00 0.00 -0.00 0.00 0.00 39.48 39.06 2mob n PHE 99 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.76 177.19 2mob n SER 100 N -3.75 0.00 -0.05 -2.13 7.64 -1.25 0.19 113.62 114.26 2mob n SER 100 Ca 0.01 0.40 -0.13 0.00 1.01 0.00 0.00 58.87 60.15 2mob n SER 100 Cb 0.09 -0.15 -0.12 0.00 -1.01 0.00 0.00 64.21 63.02 2mob n SER 100 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 2mob h VAL 101 N 0.00 1.62 -0.82 0.44 2.07 -1.72 -2.60 116.25 115.23 2mob h VAL 101 Ca 0.00 -1.98 0.15 0.00 0.82 0.00 0.00 66.70 65.69 2mob h VAL 101 Cb 0.00 2.94 -0.10 0.00 -1.52 0.00 0.00 31.29 32.61 2mob h VAL 101 CO 0.00 0.50 0.40 1.88 0.02 0.00 0.00 177.57 180.37 2mob h TYR 102 N -0.87 0.69 -0.98 1.57 -1.99 0.20 1.48 116.97 117.07 2mob h TYR 102 Ca -0.00 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.77 2mob h TYR 102 Cb 0.83 -0.18 -0.05 0.00 2.00 0.00 0.00 36.73 39.33 2mob h TYR 102 CO 0.22 0.13 0.62 0.22 -0.00 0.00 0.00 178.16 179.36 2mob h ASP 103 N 0.56 1.15 0.24 3.88 1.82 0.20 -2.44 116.42 121.82 2mob h ASP 103 Ca 0.46 -0.05 -0.34 0.00 -0.39 0.00 0.00 57.03 56.70 2mob h ASP 103 Cb 0.67 -0.29 0.03 0.00 0.68 0.00 0.00 39.33 40.42 2mob h ASP 103 CO -0.38 0.85 -1.60 0.17 -1.61 0.00 0.00 179.24 176.67 2mob h LEU 104 N 1.34 0.74 -1.74 2.28 8.10 -0.23 -2.21 115.31 123.59 2mob h LEU 104 Ca 0.36 -0.91 0.00 0.00 0.11 0.00 0.00 57.88 57.44 2mob h LEU 104 Cb -0.11 -0.24 0.00 0.00 -0.44 0.00 0.00 40.66 39.86 2mob h LEU 104 CO -0.07 1.74 0.40 -0.07 -4.11 0.00 0.00 178.44 176.32 2mob h LEU 105 N 0.13 0.00 0.00 0.17 3.38 0.21 2.45 115.31 121.65 2mob h LEU 105 Ca -0.29 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.32 2mob h LEU 105 Cb 2.14 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.83 2mob h LEU 105 CO 0.23 0.00 -2.32 -0.38 0.09 0.00 0.00 178.44 176.07 2mob n ILE 106 N -2.80 1.32 0.72 1.22 -0.00 -0.94 -4.47 119.36 114.41 2mob n ILE 106 Ca -0.02 -0.46 0.12 0.00 -0.00 0.00 0.00 62.75 62.40 2mob n ILE 106 Cb 0.44 -1.45 0.23 0.00 -0.00 0.00 0.00 39.64 38.86 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 -3.42 0.60 0.00 4.38 0.23 -0.70 -3.72 115.26 112.63 2mob n ASN 107 Ca -0.43 0.06 0.03 0.00 -0.53 0.00 0.00 54.58 53.71 2mob n ASN 107 Cb 0.91 0.11 0.17 0.00 -2.08 0.00 0.00 39.78 38.89 2mob n ASN 107 CO 0.00 0.00 0.00 0.52 -0.93 0.00 0.00 177.26 176.85 2mob n VAL 108 N -1.90 0.91 -0.38 3.53 0.31 0.82 -3.70 118.33 117.92 2mob n VAL 108 Ca 0.04 0.23 0.31 0.00 -0.01 0.00 0.00 64.34 64.91 2mob n VAL 108 Cb 0.40 -1.12 0.47 0.00 -0.91 0.00 0.00 33.84 32.69 2mob n VAL 108 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2mob n SER 109 N -1.29 0.00 -0.29 4.52 3.41 -1.24 0.20 113.62 118.92 2mob n SER 109 Ca 0.03 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.26 2mob n SER 109 Cb 0.05 -0.29 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 2mob n SER 109 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2mob n SER 110 N -3.08 0.45 0.15 4.04 3.41 -1.24 -4.19 113.62 113.16 2mob n SER 110 Ca 0.26 -1.53 -0.07 0.00 -0.26 0.00 0.00 58.87 57.27 2mob n SER 110 Cb 1.27 -0.22 -0.03 0.00 -0.26 0.00 0.00 64.21 64.96 2mob n SER 110 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 2mob h THR 111 N 0.00 0.00 0.00 6.66 1.35 0.21 -3.37 112.91 117.76 2mob h THR 111 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2mob h THR 111 Cb 0.22 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.64 2mob h THR 111 CO 0.00 0.00 0.00 0.52 -0.25 0.00 0.00 175.52 175.79 2mob n VAL 112 N -3.30 0.00 -1.74 6.82 0.31 -1.26 -4.04 118.33 115.11 2mob n VAL 112 Ca -0.05 0.00 -0.33 0.00 -0.01 0.00 0.00 64.34 63.95 2mob n VAL 112 Cb 0.17 0.00 -0.02 0.00 -0.91 0.00 0.00 33.84 33.08 2mob n VAL 112 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2mob n GLY 113 N 0.00 4.89 0.64 2.92 0.00 -1.26 -5.01 105.19 107.37 2mob n GLY 113 Ca 0.00 -2.12 0.07 0.00 0.00 0.00 0.00 46.02 43.97 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 0.52 -1.07 -3.55 1.61 0.63 -1.26 -3.78 116.66 109.76 2mob n ARG 114 Ca 0.52 0.74 -0.12 0.00 -0.92 0.00 0.00 57.85 58.07 2mob n ARG 114 Cb 0.41 -1.41 -0.11 0.00 0.45 0.00 0.00 32.46 31.80 2mob n ARG 114 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2mob s ALA 115 N -2.05 -0.78 -0.37 5.13 0.00 -1.26 -4.31 121.76 118.13 2mob s ALA 115 Ca 0.00 0.93 -0.29 0.00 0.00 0.00 0.00 51.96 52.60 2mob s ALA 115 Cb 0.00 -1.31 0.01 0.00 0.00 0.00 0.00 23.12 21.82 2mob s ALA 115 CO 0.00 -0.93 1.31 0.71 0.00 0.00 0.00 175.76 176.85 2mob s TYR 116 N 2.48 2.61 -0.11 0.00 1.51 0.36 -4.65 117.35 119.56 2mob s TYR 116 Ca 0.05 0.79 -0.30 0.00 -1.01 0.00 0.00 57.07 56.60 2mob s TYR 116 Cb -0.14 -4.12 -0.01 0.00 -0.11 0.00 0.00 41.96 37.58 2mob s TYR 116 CO -0.12 -1.71 1.03 0.99 -1.11 0.00 0.00 175.55 174.63 2mob s THR 117 N 4.76 4.72 -0.55 -0.71 2.01 -1.26 -0.33 115.64 124.28 2mob s THR 117 Ca 0.57 1.99 -0.04 0.00 0.31 0.00 0.00 61.69 64.52 2mob s THR 117 Cb -0.14 -4.28 0.11 0.00 0.01 0.00 0.00 72.50 68.20 2mob s THR 117 CO 0.28 -0.01 2.63 -0.11 -0.69 0.00 0.00 174.62 176.72 2mob n LEU 118 N 5.10 6.70 0.00 4.42 7.94 -0.22 -4.85 117.00 136.08 2mob n LEU 118 Ca 0.09 -4.23 0.00 0.00 -1.11 0.00 0.00 56.01 50.76 2mob n LEU 118 Cb 0.48 -1.21 0.00 0.00 0.53 0.00 0.00 43.42 43.22 2mob n LEU 118 CO 0.52 1.75 0.00 0.61 -1.11 0.00 0.00 177.39 179.16 2mob n GLY 119 N 0.65 0.49 0.02 -3.96 0.00 -1.26 -2.60 105.19 98.53 2mob n GLY 119 Ca 0.50 -0.01 0.02 0.00 0.00 0.00 0.00 46.02 46.53 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 -4.04 2.61 -2.24 -1.26 -5.05 114.28 104.30 2mob n THR 120 Ca 0.00 -0.41 -0.02 0.00 -2.27 0.00 0.00 64.05 61.36 2mob n THR 120 Cb 0.00 1.01 -0.00 0.00 -2.10 0.00 0.00 70.33 69.24 2mob n THR 120 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 2mob n LYS 121 N -0.94 1.65 -3.97 -0.78 4.81 -1.07 -3.45 118.16 114.41 2mob n LYS 121 Ca 0.01 -0.20 -0.11 0.00 -0.87 0.00 0.00 58.31 57.14 2mob n LYS 121 Cb 0.08 0.07 -0.12 0.00 0.02 0.00 0.00 35.03 35.08 2mob n LYS 121 CO 0.00 0.00 0.00 0.12 1.17 0.00 0.00 177.40 178.69 2mob s PHE 122 N -1.25 0.26 -0.04 5.64 5.36 -0.62 -1.06 117.98 126.27 2mob s PHE 122 Ca 0.00 -0.38 -0.02 0.00 -0.96 0.00 0.00 56.93 55.58 2mob s PHE 122 Cb 0.00 -0.18 0.03 0.00 -0.34 0.00 0.00 43.02 42.53 2mob s PHE 122 CO 0.00 -0.12 0.05 0.99 -1.46 0.00 0.00 175.22 174.68 2mob s THR 123 N -1.04 -0.08 0.01 0.12 2.01 0.56 -2.62 115.64 114.59 2mob s THR 123 Ca -0.11 0.38 0.07 0.00 0.31 0.00 0.00 61.69 62.35 2mob s THR 123 Cb -0.07 -0.16 -0.03 0.00 0.01 0.00 0.00 72.50 72.25 2mob s THR 123 CO -0.01 0.17 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.24 2mob s ILE 124 N 1.98 2.43 -0.07 1.82 1.09 -0.47 0.13 121.20 128.11 2mob s ILE 124 Ca 0.03 -1.15 -0.05 0.00 -1.10 0.00 0.00 60.65 58.37 2mob s ILE 124 Cb -0.12 -1.94 0.02 0.00 -1.06 0.00 0.00 42.46 39.36 2mob s ILE 124 CO -0.03 0.45 0.18 0.28 -0.10 0.00 0.00 174.94 175.73 2mob s THR 125 N -0.77 -0.01 0.00 2.92 -1.32 -1.25 -1.96 115.64 113.25 2mob s THR 125 Ca 0.12 0.05 0.00 0.00 -1.21 0.00 0.00 61.69 60.65 2mob s THR 125 Cb -0.10 -0.27 0.00 0.00 -1.51 0.00 0.00 72.50 70.62 2mob s THR 125 CO 0.02 0.02 0.25 -0.24 -2.21 0.00 0.00 174.62 172.46 2mob n SER 126 N 3.36 0.00 -4.34 8.08 2.88 -1.26 -4.65 113.62 117.69 2mob n SER 126 Ca -0.17 0.25 -0.28 0.00 -1.33 0.00 0.00 58.87 57.34 2mob n SER 126 Cb 0.57 0.00 0.26 0.00 -0.75 0.00 0.00 64.21 64.29 2mob n SER 126 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2mob s GLU 127 N -0.50 -1.30 0.00 -1.46 2.02 -1.26 -4.90 118.70 111.29 2mob s GLU 127 Ca 0.00 0.69 0.00 0.00 0.02 0.00 0.00 54.97 55.68 2mob s GLU 127 Cb 0.00 -1.52 0.00 0.00 0.10 0.00 0.00 34.13 32.71 2mob s GLU 127 CO 0.00 -3.94 0.18 1.28 0.02 0.00 0.00 175.26 172.80