#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 -1.40 6.43 3.02 -1.26 -4.87 115.26 117.18 2mob n ASN 36 Ca 0.00 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.39 2mob n ASN 36 Cb 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 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 0.00 -1.59 -2.81 5.41 0.00 -1.26 -4.67 120.51 115.58 2mob n ALA 37 Ca 0.00 0.14 -0.36 0.00 0.00 0.00 0.00 53.44 53.23 2mob n ALA 37 Cb 0.00 -0.52 -0.08 0.00 0.00 0.00 0.00 19.45 18.86 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 -0.30 5.12 0.12 0.00 0.11 -0.44 -4.92 120.40 120.08 2mob s VAL 38 Ca 0.21 0.07 -0.29 0.00 -2.93 0.00 0.00 61.98 59.04 2mob s VAL 38 Cb -0.30 -3.25 -0.06 0.00 -1.53 0.00 0.00 36.38 31.24 2mob s VAL 38 CO 0.18 0.56 0.93 0.54 -3.33 0.00 0.00 175.10 173.98 2mob s VAL 39 N -0.49 4.47 -0.11 2.04 0.11 -1.26 -1.90 120.40 123.25 2mob s VAL 39 Ca 0.11 2.02 -0.01 0.00 -2.93 0.00 0.00 61.98 61.16 2mob s VAL 39 Cb -0.12 -4.30 -0.03 0.00 -1.53 0.00 0.00 36.38 30.41 2mob s VAL 39 CO 0.02 0.35 -0.07 -0.22 -3.33 0.00 0.00 175.10 171.85 2mob s LEU 40 N -0.19 3.13 -0.10 2.54 2.96 0.65 -4.60 118.68 123.08 2mob s LEU 40 Ca 0.45 -0.11 -0.00 0.00 -0.22 0.00 0.00 54.13 54.25 2mob s LEU 40 Cb -0.23 -1.71 0.02 0.00 0.50 0.00 0.00 46.19 44.77 2mob s LEU 40 CO 0.29 0.26 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.82 2mob s VAL 41 N -0.17 0.91 0.09 1.68 1.01 -1.26 0.12 120.40 122.77 2mob s VAL 41 Ca 0.02 -0.23 0.00 0.00 0.00 0.00 0.00 61.98 61.77 2mob s VAL 41 Cb -0.13 -0.94 -0.00 0.00 0.00 0.00 0.00 36.38 35.31 2mob s VAL 41 CO 0.03 0.34 0.00 0.18 0.00 0.00 0.00 175.10 175.65 2mob n LEU 42 N 4.84 0.00 -4.97 3.92 7.99 0.59 -3.61 117.00 125.77 2mob n LEU 42 Ca -0.13 -0.54 -0.22 0.00 -0.01 0.00 0.00 56.01 55.11 2mob n LEU 42 Cb 0.50 0.07 -0.02 0.00 -0.11 0.00 0.00 43.42 43.86 2mob n LEU 42 CO 0.17 -0.08 -0.04 0.00 -1.51 0.00 0.00 177.39 175.92 2mob s MET 43 N -2.31 3.44 -0.63 3.23 0.23 -1.26 -0.83 119.30 121.17 2mob s MET 43 Ca 0.00 -0.74 -0.29 0.00 -1.03 0.00 0.00 55.69 53.63 2mob s MET 43 Cb 0.00 -2.90 -0.13 0.00 -1.53 0.00 0.00 34.83 30.28 2mob s MET 43 CO 0.00 0.44 2.47 0.36 -2.03 0.00 0.00 175.02 176.26 2mob n LYS 44 N -1.32 0.71 -0.15 3.16 2.85 -1.25 -4.17 118.16 117.99 2mob n LYS 44 Ca -0.09 0.06 0.04 0.00 -1.05 0.00 0.00 58.31 57.27 2mob n LYS 44 Cb 0.57 -2.62 0.11 0.00 -0.65 0.00 0.00 35.03 32.44 2mob n LYS 44 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 2mob n SER 45 N 12.97 1.46 0.00 -5.58 2.88 -1.26 -4.92 113.62 119.17 2mob n SER 45 Ca 0.47 -2.04 0.00 0.00 -1.33 0.00 0.00 58.87 55.98 2mob n SER 45 Cb 0.32 -0.21 0.00 0.00 -0.75 0.00 0.00 64.21 63.56 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 0.21 0.00 -1.45 -3.46 8.00 -1.26 -4.20 116.55 114.40 2mob n ASP 46 Ca 0.08 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.50 2mob n ASP 46 Cb 0.25 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.41 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 1.45 0.00 -1.24 1.02 -1.26 -4.59 120.64 116.02 2mob n GLU 47 Ca 0.00 -1.09 0.00 0.00 -0.02 0.00 0.00 57.16 56.05 2mob n GLU 47 Cb 0.00 -1.43 0.00 0.00 -0.02 0.00 0.00 31.44 29.99 2mob n GLU 47 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2mob n ILE 48 N -0.08 0.00 -0.64 -3.67 -0.00 -1.26 0.27 119.36 113.98 2mob n ILE 48 Ca 0.22 1.17 0.49 0.00 -0.00 0.00 0.00 62.75 64.63 2mob n ILE 48 Cb 0.92 -2.14 0.77 0.00 -0.00 0.00 0.00 39.64 39.19 2mob n ILE 48 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 2mob n ASP 49 N -1.22 0.05 0.00 7.28 9.92 -1.26 0.18 116.55 131.50 2mob n ASP 49 Ca 0.00 1.08 -0.10 0.00 -0.53 0.00 0.00 54.79 55.23 2mob n ASP 49 Cb 0.00 -0.54 -0.08 0.00 -0.64 0.00 0.00 41.12 39.86 2mob n ASP 49 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2mob h ALA 50 N 1.13 -0.12 0.14 2.24 0.00 -1.73 -2.32 119.26 118.60 2mob h ALA 50 Ca 0.91 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 55.55 2mob h ALA 50 Cb 3.47 0.05 0.00 0.00 0.00 0.00 0.00 17.79 21.31 2mob h ALA 50 CO -0.13 -0.18 -0.07 -0.84 0.00 0.00 0.00 179.25 178.03 2mob h ILE 51 N -0.89 0.97 -1.09 0.00 3.07 1.25 -0.57 117.51 120.25 2mob h ILE 51 Ca -0.01 -1.16 0.30 0.00 1.55 0.00 0.00 64.86 65.54 2mob h ILE 51 Cb 0.57 1.61 -0.11 0.00 -0.27 0.00 0.00 36.82 38.62 2mob h ILE 51 CO 0.02 0.24 0.68 0.40 -1.05 0.00 0.00 178.15 178.45 2mob h ILE 52 N -0.80 0.42 0.52 0.16 1.08 0.17 4.20 117.51 123.25 2mob h ILE 52 Ca -0.02 -0.12 -0.03 0.00 -0.39 0.00 0.00 64.86 64.31 2mob h ILE 52 Cb 0.54 0.04 0.01 0.00 -3.07 0.00 0.00 36.82 34.34 2mob h ILE 52 CO 0.03 0.06 -0.25 -0.08 -0.69 0.00 0.00 178.15 177.22 2mob h GLU 53 N 0.35 -0.68 0.00 2.37 4.81 -1.21 2.72 114.58 122.94 2mob h GLU 53 Ca 0.66 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.94 2mob h GLU 53 Cb 1.71 0.15 0.00 0.00 0.63 0.00 0.00 28.75 31.24 2mob h GLU 53 CO -0.38 -0.45 0.00 -3.47 -0.73 0.00 0.00 179.01 173.98 2mob n ASP 54 N -4.29 0.01 -0.07 1.04 2.03 -0.24 -1.70 116.55 113.32 2mob n ASP 54 Ca -0.09 0.50 -0.09 0.00 0.52 0.00 0.00 54.79 55.64 2mob n ASP 54 Cb 0.28 -0.50 -0.10 0.00 -0.72 0.00 0.00 41.12 40.08 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 -1.50 0.95 -0.01 5.18 0.13 1.37 -4.80 119.36 120.68 2mob n ILE 55 Ca 0.07 -0.50 -0.01 0.00 -1.10 0.00 0.00 62.75 61.20 2mob n ILE 55 Cb 0.33 -0.82 -0.01 0.00 -0.84 0.00 0.00 39.64 38.30 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 0.10 -0.36 9.51 0.31 0.69 -4.03 118.33 121.86 2mob n VAL 56 Ca -0.25 -0.03 0.26 0.00 -0.01 0.00 0.00 64.34 64.31 2mob n VAL 56 Cb 0.90 -0.87 0.52 0.00 -0.91 0.00 0.00 33.84 33.47 2mob n VAL 56 CO 0.00 0.00 0.00 0.17 -1.32 0.00 0.00 176.83 175.68 2mob h LEU 57 N -0.02 0.45 0.09 7.52 8.10 0.46 1.40 115.31 133.31 2mob h LEU 57 Ca -0.04 0.16 -0.27 0.00 0.11 0.00 0.00 57.88 57.84 2mob h LEU 57 Cb 1.05 0.11 -0.01 0.00 -0.44 0.00 0.00 40.66 41.37 2mob h LEU 57 CO -0.01 -0.10 -1.38 0.50 -4.11 0.00 0.00 178.44 173.33 2mob h LYS 58 N 0.29 0.20 0.11 0.17 3.64 -1.80 -3.06 116.57 116.11 2mob h LYS 58 Ca 0.73 -0.33 0.01 0.00 -1.27 0.00 0.00 60.65 59.79 2mob h LYS 58 Cb 1.84 0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 33.75 2mob h LYS 58 CO -0.51 1.16 -0.20 0.78 -2.27 0.00 0.00 179.45 178.41 2mob h GLY 59 N -0.04 -0.36 0.92 5.01 0.00 -1.07 0.14 103.07 107.67 2mob h GLY 59 Ca -0.31 0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.25 2mob h GLY 59 CO 0.02 -0.18 0.00 0.61 0.00 0.00 0.00 176.54 176.98 2mob n GLY 60 N -1.32 -0.61 0.04 4.60 0.00 0.46 -2.53 105.19 105.82 2mob n GLY 60 Ca -0.07 -0.11 0.07 0.00 0.00 0.00 0.00 46.02 45.91 2mob n GLY 60 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2mob n LYS 61 N -0.96 2.23 0.00 1.61 4.76 0.39 -3.97 118.16 122.21 2mob n LYS 61 Ca 0.13 -0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 2mob n LYS 61 Cb 0.06 -1.18 0.00 0.00 -1.84 0.00 0.00 35.03 32.07 2mob n LYS 61 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2mob n ALA 62 N -1.18 0.00 -0.01 7.82 0.00 -0.53 -4.64 120.51 121.97 2mob n ALA 62 Ca 0.03 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.49 2mob n ALA 62 Cb 0.23 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.56 2mob n ALA 62 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2mob n LYS 63 N -0.50 0.65 -2.01 0.00 2.85 -1.26 -4.86 118.16 113.03 2mob n LYS 63 Ca 0.00 0.03 -0.43 0.00 -1.05 0.00 0.00 58.31 56.87 2mob n LYS 63 Cb 0.00 -1.65 -0.03 0.00 -0.65 0.00 0.00 35.03 32.70 2mob n LYS 63 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 2mob s ASN 64 N -5.31 6.41 0.28 -5.58 0.01 -1.25 -4.88 114.94 104.62 2mob s ASN 64 Ca -0.06 1.91 -0.02 0.00 -0.71 0.00 0.00 52.86 53.98 2mob s ASN 64 Cb 0.10 -2.53 0.40 0.00 0.41 0.00 0.00 41.25 39.63 2mob s ASN 64 CO 0.84 -1.19 1.85 1.55 -1.51 0.00 0.00 177.10 178.65 2mob h PRO 65 N 10.65 0.89 0.00 -0.60 0.13 -1.89 -3.36 132.00 137.82 2mob h PRO 65 Ca -0.37 -0.15 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2mob h PRO 65 Cb 1.17 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.15 2mob h PRO 65 CO 0.98 0.75 0.00 0.43 -0.23 0.00 0.00 178.00 179.93 2mob n SER 66 N -4.30 0.00 -4.83 1.44 7.64 -1.26 -5.02 113.62 107.29 2mob n SER 66 Ca 0.05 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.67 2mob n SER 66 Cb 0.19 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.34 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 4.66 0.05 0.44 1.09 -1.26 -4.62 121.20 121.56 2mob s ILE 67 Ca 0.00 -1.00 0.04 0.00 -1.10 0.00 0.00 60.65 58.59 2mob s ILE 67 Cb 0.00 -3.39 -0.04 0.00 -1.06 0.00 0.00 42.46 37.98 2mob s ILE 67 CO 0.00 -0.11 -0.05 0.54 -0.10 0.00 0.00 174.94 175.22 2mob s VAL 68 N -1.75 3.72 -0.26 2.92 0.11 -0.37 -4.98 120.40 119.79 2mob s VAL 68 Ca 0.32 -0.93 -0.00 0.00 -2.93 0.00 0.00 61.98 58.44 2mob s VAL 68 Cb -0.10 -2.69 0.08 0.00 -1.53 0.00 0.00 36.38 32.13 2mob s VAL 68 CO 0.24 0.26 0.02 -0.69 -3.33 0.00 0.00 175.10 171.60 2mob s VAL 69 N -1.14 1.24 -1.03 2.04 1.01 -1.26 -1.02 120.40 120.24 2mob s VAL 69 Ca 0.21 -1.26 -0.12 0.00 0.00 0.00 0.00 61.98 60.80 2mob s VAL 69 Cb -0.11 -1.71 0.23 0.00 0.00 0.00 0.00 36.38 34.79 2mob s VAL 69 CO 0.12 -0.33 1.07 -1.61 0.00 0.00 0.00 175.10 174.34 2mob s GLU 70 N 1.49 3.95 -0.18 2.72 0.41 0.75 -4.95 118.70 122.88 2mob s GLU 70 Ca 0.01 -2.75 -0.14 0.00 -0.41 0.00 0.00 54.97 51.69 2mob s GLU 70 Cb -0.18 -4.64 -0.05 0.00 -1.78 0.00 0.00 34.13 27.48 2mob s GLU 70 CO -0.12 -1.40 0.29 0.16 -0.49 0.00 0.00 175.26 173.70 2mob s ASP 71 N 2.05 6.38 -0.04 -0.19 -4.77 -1.26 -0.78 116.67 118.06 2mob s ASP 71 Ca 0.29 0.44 -0.06 0.00 -3.30 0.00 0.00 52.55 49.92 2mob s ASP 71 Cb -0.08 -2.18 0.01 0.00 -1.09 0.00 0.00 42.92 39.58 2mob s ASP 71 CO -0.07 0.05 0.16 -0.75 0.70 0.00 0.00 175.17 175.26 2mob s LYS 72 N 0.76 0.30 -0.98 2.11 2.20 -1.04 -5.02 119.74 118.07 2mob s LYS 72 Ca 0.15 0.01 -0.25 0.00 -0.36 0.00 0.00 55.97 55.53 2mob s LYS 72 Cb -0.13 0.13 -0.21 0.00 -1.51 0.00 0.00 37.83 36.11 2mob s LYS 72 CO 0.05 -0.06 2.09 0.00 -0.36 0.00 0.00 175.35 177.07 2mob n ALA 73 N 2.44 0.23 0.00 3.13 0.00 -1.26 -1.17 120.51 123.88 2mob n ALA 73 Ca -0.16 -2.02 0.00 0.00 0.00 0.00 0.00 53.44 51.26 2mob n ALA 73 Cb 0.58 -3.16 0.00 0.00 0.00 0.00 0.00 19.45 16.87 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 6.13 2.21 3.24 0.00 0.00 -1.26 -5.10 105.19 110.41 2mob n GLY 74 Ca 0.40 -0.20 -0.15 0.00 0.00 0.00 0.00 46.02 46.07 2mob n GLY 74 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2mob s PHE 75 N 0.00 1.41 -0.40 1.61 0.08 -0.32 -3.90 117.98 116.46 2mob s PHE 75 Ca 0.00 -1.50 0.03 0.00 0.12 0.00 0.00 56.93 55.58 2mob s PHE 75 Cb 0.00 -0.63 0.16 0.00 -0.57 0.00 0.00 43.02 41.98 2mob s PHE 75 CO 0.00 -0.73 0.30 -0.46 -0.10 0.00 0.00 175.22 174.23 2mob s TRP 76 N -3.86 1.09 -0.25 0.36 -0.00 -0.01 -2.49 118.94 113.77 2mob s TRP 76 Ca 0.40 -2.16 -0.08 0.00 -0.00 0.00 0.00 56.10 54.26 2mob s TRP 76 Cb 0.05 -1.01 -0.03 0.00 -0.00 0.00 0.00 33.47 32.48 2mob s TRP 76 CO 0.18 -0.82 0.09 -1.58 -0.00 0.00 0.00 176.95 174.83 2mob s TRP 77 N 0.31 3.12 0.00 5.86 0.52 0.04 0.22 118.94 129.02 2mob s TRP 77 Ca 0.28 -0.29 0.04 0.00 0.02 0.00 0.00 56.10 56.14 2mob s TRP 77 Cb -0.05 -2.26 -0.01 0.00 -1.15 0.00 0.00 33.47 30.00 2mob s TRP 77 CO -0.13 -0.29 -0.13 0.42 0.02 0.00 0.00 176.95 176.84 2mob s ILE 78 N 1.58 0.99 -0.10 2.03 1.01 0.31 0.27 121.20 127.29 2mob s ILE 78 Ca 0.06 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 60.07 2mob s ILE 78 Cb -0.15 -0.85 -0.02 0.00 0.01 0.00 0.00 42.46 41.45 2mob s ILE 78 CO 0.05 0.19 -0.14 -1.59 0.00 0.00 0.00 174.94 173.45 2mob s LYS 79 N -0.54 3.02 0.11 2.79 -2.85 -0.19 0.24 119.74 122.32 2mob s LYS 79 Ca 0.04 -0.69 0.11 0.00 -1.00 0.00 0.00 55.97 54.42 2mob s LYS 79 Cb -0.06 -2.52 -0.04 0.00 -2.06 0.00 0.00 37.83 33.15 2mob s LYS 79 CO 0.00 0.39 -0.27 0.00 0.10 0.00 0.00 175.35 175.57 2mob s ALA 80 N -0.10 2.34 -0.82 0.59 0.00 -0.80 -1.24 121.76 121.72 2mob s ALA 80 Ca -0.02 -1.42 -0.03 0.00 0.00 0.00 0.00 51.96 50.49 2mob s ALA 80 Cb -0.14 -0.39 0.21 0.00 0.00 0.00 0.00 23.12 22.80 2mob s ALA 80 CO 0.04 0.53 2.29 -0.25 0.00 0.00 0.00 175.76 178.37 2mob n ASP 81 N 1.08 7.24 0.00 0.00 9.92 -1.26 -1.33 116.55 132.20 2mob n ASP 81 Ca -0.18 -3.50 0.00 0.00 -0.53 0.00 0.00 54.79 50.58 2mob n ASP 81 Cb 0.53 -1.19 0.00 0.00 -0.64 0.00 0.00 41.12 39.82 2mob n ASP 81 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2mob n GLY 82 N 0.36 0.61 3.33 0.44 0.00 -1.26 -4.83 105.19 103.84 2mob n GLY 82 Ca 0.52 0.46 -0.28 0.00 0.00 0.00 0.00 46.02 46.72 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 2.15 0.12 4.61 0.00 -1.26 -1.11 121.76 125.27 2mob s ALA 83 Ca 0.00 -1.28 0.03 0.00 0.00 0.00 0.00 51.96 50.71 2mob s ALA 83 Cb 0.00 -0.40 -0.04 0.00 0.00 0.00 0.00 23.12 22.68 2mob s ALA 83 CO 0.00 0.49 -0.09 -1.50 0.00 0.00 0.00 175.76 174.67 2mob s ILE 84 N -0.91 0.95 -0.03 0.00 1.10 -0.47 -4.97 121.20 116.87 2mob s ILE 84 Ca 0.11 -1.98 0.01 0.00 -0.51 0.00 0.00 60.65 58.27 2mob s ILE 84 Cb -0.10 -1.75 0.03 0.00 0.15 0.00 0.00 42.46 40.79 2mob s ILE 84 CO 0.03 -0.79 -0.00 -1.61 -2.11 0.00 0.00 174.94 170.46 2mob s GLU 85 N -3.73 0.33 0.53 3.50 2.02 -1.26 0.67 118.70 120.77 2mob s GLU 85 Ca 0.14 0.05 -0.05 0.00 0.02 0.00 0.00 54.97 55.13 2mob s GLU 85 Cb 0.03 -0.49 0.12 0.00 0.10 0.00 0.00 34.13 33.89 2mob s GLU 85 CO -0.02 -0.12 0.73 -0.89 0.02 0.00 0.00 175.26 174.98 2mob n ILE 86 N 4.07 0.00 -3.57 -1.63 2.08 -0.23 -4.86 119.36 115.23 2mob n ILE 86 Ca -0.26 -0.80 -0.14 0.00 0.56 0.00 0.00 62.75 62.10 2mob n ILE 86 Cb 0.51 -1.38 -0.05 0.00 -0.75 0.00 0.00 39.64 37.97 2mob n ILE 86 CO 0.00 0.00 0.00 -1.81 0.56 0.00 0.00 176.55 175.30 2mob s ASP 87 N -3.79 -0.45 0.00 4.38 1.11 -1.26 -2.54 116.67 114.12 2mob s ASP 87 Ca 0.44 0.18 0.00 0.00 0.18 0.00 0.00 52.55 53.35 2mob s ASP 87 Cb -0.02 0.50 0.00 0.00 1.07 0.00 0.00 42.92 44.47 2mob s ASP 87 CO 0.30 -0.72 0.00 0.00 1.18 0.00 0.00 175.17 175.93 2mob n ALA 88 N 0.39 0.27 -0.33 5.23 0.00 -1.26 -4.70 120.51 120.11 2mob n ALA 88 Ca -0.18 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.44 2mob n ALA 88 Cb 0.60 0.00 0.35 0.00 0.00 0.00 0.00 19.45 20.40 2mob n ALA 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2mob n ALA 89 N -0.27 0.60 0.25 0.00 0.00 -1.25 -0.58 120.51 119.26 2mob n ALA 89 Ca 0.00 1.04 -0.17 0.00 0.00 0.00 0.00 53.44 54.31 2mob n ALA 89 Cb 0.00 -0.81 -0.09 0.00 0.00 0.00 0.00 19.45 18.54 2mob n ALA 89 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2mob h GLU 90 N 0.00 -0.89 -1.64 0.00 4.57 -1.93 -0.16 114.58 114.53 2mob h GLU 90 Ca 0.64 0.06 0.49 0.00 -1.18 0.00 0.00 59.36 59.37 2mob h GLU 90 Cb 1.42 0.20 -0.09 0.00 -0.16 0.00 0.00 28.75 30.12 2mob h GLU 90 CO -0.88 -0.59 1.15 0.00 -1.18 0.00 0.00 179.01 177.51 2mob h ALA 91 N -0.89 3.41 -0.20 2.92 0.00 -1.17 1.16 119.26 124.48 2mob h ALA 91 Ca -0.05 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.68 2mob h ALA 91 Cb 0.82 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2mob h ALA 91 CO -0.10 -1.95 -0.52 0.78 0.00 0.00 0.00 179.25 177.47 2mob h GLY 92 N 0.03 0.77 1.38 0.00 0.00 -0.79 -0.94 103.07 103.53 2mob h GLY 92 Ca 0.83 -0.97 0.06 0.00 0.00 0.00 0.00 47.33 47.25 2mob h GLY 92 CO -0.13 0.87 0.25 0.83 0.00 0.00 0.00 176.54 178.37 2mob h GLU 93 N 0.41 0.00 0.00 4.80 5.08 0.19 2.68 114.58 127.74 2mob h GLU 93 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2mob h GLU 93 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 2mob h GLU 93 CO 0.11 0.00 0.00 -0.11 -1.00 0.00 0.00 179.01 178.01 2mob n LEU 94 N -3.65 0.18 0.00 1.33 7.94 -0.97 -4.63 117.00 117.21 2mob n LEU 94 Ca 0.02 0.29 -0.08 0.00 -1.11 0.00 0.00 56.01 55.14 2mob n LEU 94 Cb 0.37 -0.45 -0.13 0.00 0.53 0.00 0.00 43.42 43.74 2mob n LEU 94 CO 0.26 -0.45 -0.32 0.17 -1.11 0.00 0.00 177.39 175.93 2mob h LEU 95 N 0.00 0.00 -1.39 -1.96 -0.00 -1.10 -3.49 115.31 107.37 2mob h LEU 95 Ca 0.00 0.00 -0.31 0.00 -0.00 0.00 0.00 57.88 57.57 2mob h LEU 95 Cb 0.00 0.00 0.14 0.00 -0.00 0.00 0.00 40.66 40.80 2mob h LEU 95 CO 0.00 0.98 -0.65 0.61 -0.00 0.00 0.00 178.44 179.39 2mob n GLY 96 N 1.49 -0.30 0.00 0.17 0.00 0.90 -4.99 105.19 102.46 2mob n GLY 96 Ca -0.12 0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2mob n GLY 96 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2mob n LYS 97 N -4.00 0.00 0.00 1.61 2.85 -1.26 -4.95 118.16 112.41 2mob n LYS 97 Ca -0.16 0.00 0.07 0.00 -1.05 0.00 0.00 58.31 57.17 2mob n LYS 97 Cb 0.61 0.00 0.37 0.00 -0.65 0.00 0.00 35.03 35.36 2mob n LYS 97 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 2mob n PRO 98 N 0.00 0.28 -0.17 -1.58 -0.04 -1.26 -3.84 135.00 128.40 2mob n PRO 98 Ca 0.00 0.10 0.14 0.00 -0.04 0.00 0.00 63.50 63.70 2mob n PRO 98 Cb 0.00 -1.50 0.26 0.00 -0.04 0.00 0.00 33.50 32.22 2mob n PRO 98 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2mob n PHE 99 N -1.18 0.52 0.17 0.54 1.16 -1.26 0.32 117.46 117.72 2mob n PHE 99 Ca 0.08 0.60 -0.16 0.00 -1.87 0.00 0.00 57.45 56.11 2mob n PHE 99 Cb 0.09 -1.00 -0.08 0.00 -1.61 0.00 0.00 39.48 36.87 2mob n PHE 99 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 2mob h SER 100 N 0.00 -1.27 0.05 5.98 0.87 -1.76 -2.39 113.55 115.03 2mob h SER 100 Ca 0.40 0.13 -0.38 0.00 -1.23 0.00 0.00 61.79 60.71 2mob h SER 100 Cb 1.01 0.46 -0.06 0.00 -0.44 0.00 0.00 62.40 63.36 2mob h SER 100 CO -0.41 -0.54 -2.34 0.52 -0.53 0.00 0.00 176.83 173.52 2mob n VAL 101 N -5.49 1.52 0.01 2.23 0.31 0.15 -2.82 118.33 114.24 2mob n VAL 101 Ca -0.09 -0.66 0.05 0.00 -0.01 0.00 0.00 64.34 63.64 2mob n VAL 101 Cb 0.40 -1.25 0.45 0.00 -0.91 0.00 0.00 33.84 32.53 2mob n VAL 101 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 2mob h TYR 102 N 0.01 0.46 0.01 3.52 5.03 -0.81 1.80 116.97 126.98 2mob h TYR 102 Ca -0.53 0.01 -0.20 0.00 2.58 0.00 0.00 58.73 60.59 2mob h TYR 102 Cb 2.00 -0.16 0.02 0.00 1.55 0.00 0.00 36.73 40.14 2mob h TYR 102 CO 0.03 0.28 -0.78 0.38 -1.32 0.00 0.00 178.16 176.76 2mob h ASP 103 N 0.49 0.67 -0.20 -2.11 2.03 -1.57 -2.96 116.42 112.78 2mob h ASP 103 Ca 0.15 -0.76 -0.11 0.00 -0.73 0.00 0.00 57.03 55.58 2mob h ASP 103 Cb 0.01 -0.21 -0.01 0.00 -0.83 0.00 0.00 39.33 38.29 2mob h ASP 103 CO -0.03 1.35 -0.26 0.17 -1.03 0.00 0.00 179.24 179.43 2mob h LEU 104 N 0.07 0.69 -0.68 0.15 8.10 -1.13 0.22 115.31 122.74 2mob h LEU 104 Ca -0.10 -0.26 0.14 0.00 0.11 0.00 0.00 57.88 57.77 2mob h LEU 104 Cb 1.47 -0.19 -0.13 0.00 -0.44 0.00 0.00 40.66 41.38 2mob h LEU 104 CO 0.15 0.93 -0.12 -0.07 -4.11 0.00 0.00 178.44 175.22 2mob h LEU 105 N 0.59 -0.54 0.00 0.17 -0.00 0.28 2.43 115.31 118.24 2mob h LEU 105 Ca 0.08 0.19 -0.15 0.00 -0.00 0.00 0.00 57.88 58.00 2mob h LEU 105 Cb 0.75 0.39 -0.02 0.00 -0.00 0.00 0.00 40.66 41.78 2mob h LEU 105 CO 0.06 -0.20 -0.95 0.40 -0.00 0.00 0.00 178.44 177.75 2mob h ILE 106 N 0.03 0.88 -0.48 1.22 1.08 -1.34 -3.29 117.51 115.61 2mob h ILE 106 Ca 0.34 -2.37 0.00 0.00 -0.39 0.00 0.00 64.86 62.44 2mob h ILE 106 Cb 0.54 2.37 0.00 0.00 -3.07 0.00 0.00 36.82 36.65 2mob h ILE 106 CO -0.67 0.50 0.00 -0.46 -0.69 0.00 0.00 178.15 176.84 2mob n ASN 107 N -3.13 4.80 0.00 1.72 0.23 0.05 -4.26 115.26 114.67 2mob n ASN 107 Ca -0.03 -2.81 0.00 0.00 -0.53 0.00 0.00 54.58 51.20 2mob n ASN 107 Cb 0.82 -0.59 0.00 0.00 -2.08 0.00 0.00 39.78 37.93 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 0.35 0.00 -0.36 3.53 3.14 0.80 -4.03 118.33 121.75 2mob n VAL 108 Ca 0.24 -0.35 0.33 0.00 -2.96 0.00 0.00 64.34 61.60 2mob n VAL 108 Cb 1.00 0.87 0.51 0.00 -1.06 0.00 0.00 33.84 35.16 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 -1.03 0.00 -1.53 6.55 2.88 -1.24 0.14 113.62 119.39 2mob n SER 109 Ca 0.00 0.72 -0.09 0.00 -1.33 0.00 0.00 58.87 58.18 2mob n SER 109 Cb 0.00 -0.30 0.04 0.00 -0.75 0.00 0.00 64.21 63.20 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 -3.22 4.38 -2.77 -3.46 3.41 -1.26 -4.36 113.62 106.34 2mob n SER 110 Ca 0.27 -2.63 -0.35 0.00 -0.26 0.00 0.00 58.87 55.90 2mob n SER 110 Cb 1.47 -0.80 0.03 0.00 -0.26 0.00 0.00 64.21 64.64 2mob n SER 110 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2mob n THR 111 N 0.31 3.17 0.08 6.66 5.66 0.36 -4.55 114.28 125.98 2mob n THR 111 Ca 0.19 -4.53 -0.13 0.00 -3.05 0.00 0.00 64.05 56.52 2mob n THR 111 Cb 0.73 -1.25 -0.13 0.00 -1.55 0.00 0.00 70.33 68.13 2mob n THR 111 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 2mob h VAL 112 N 2.21 1.52 0.00 1.08 2.07 -1.84 -3.40 116.25 117.88 2mob h VAL 112 Ca 0.47 -3.14 0.00 0.00 0.82 0.00 0.00 66.70 64.85 2mob h VAL 112 Cb 0.34 2.88 0.00 0.00 -1.52 0.00 0.00 31.29 32.99 2mob h VAL 112 CO 1.23 0.90 0.00 0.61 0.02 0.00 0.00 177.57 180.33 2mob n GLY 113 N 1.49 -1.37 3.36 2.17 0.00 -1.26 -4.98 105.19 104.60 2mob n GLY 113 Ca -0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 2mob n GLY 113 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2mob s ARG 114 N -0.82 1.69 -0.43 1.61 6.06 -1.25 -4.91 118.95 120.89 2mob s ARG 114 Ca 0.00 -1.98 0.01 0.00 -2.50 0.00 0.00 55.73 51.27 2mob s ARG 114 Cb 0.00 -0.14 0.23 0.00 0.06 0.00 0.00 34.95 35.09 2mob s ARG 114 CO 0.00 -0.48 0.97 0.00 -2.50 0.00 0.00 175.30 173.28 2mob n ALA 115 N -0.65 -2.57 -2.53 6.12 0.00 -1.10 -4.26 120.51 115.52 2mob n ALA 115 Ca 0.01 -0.72 -0.43 0.00 0.00 0.00 0.00 53.44 52.30 2mob n ALA 115 Cb 0.64 -2.24 -0.02 0.00 0.00 0.00 0.00 19.45 17.83 2mob n ALA 115 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2mob s TYR 116 N 0.69 2.95 -0.01 0.00 2.02 0.70 -4.71 117.35 118.98 2mob s TYR 116 Ca 0.28 1.07 -0.30 0.00 -0.37 0.00 0.00 57.07 57.75 2mob s TYR 116 Cb 0.14 -3.71 -0.03 0.00 -0.40 0.00 0.00 41.96 37.95 2mob s TYR 116 CO -0.12 -1.24 1.02 0.99 -1.57 0.00 0.00 175.55 174.63 2mob s THR 117 N 3.86 4.75 -0.69 -0.71 2.01 -1.26 -0.31 115.64 123.28 2mob s THR 117 Ca 0.51 1.98 -0.00 0.00 0.31 0.00 0.00 61.69 64.48 2mob s THR 117 Cb -0.15 -4.27 0.40 0.00 0.01 0.00 0.00 72.50 68.49 2mob s THR 117 CO 0.17 0.12 1.85 0.18 -0.69 0.00 0.00 174.62 176.26 2mob n LEU 118 N 4.15 7.05 0.00 4.42 7.99 0.74 -4.92 117.00 136.43 2mob n LEU 118 Ca 0.07 -4.68 0.00 0.00 -0.01 0.00 0.00 56.01 51.39 2mob n LEU 118 Cb 0.50 -0.90 0.00 0.00 -0.11 0.00 0.00 43.42 42.90 2mob n LEU 118 CO 0.52 1.74 0.00 0.61 -1.51 0.00 0.00 177.39 178.76 2mob n GLY 119 N -0.68 0.41 0.00 -0.72 0.00 -1.26 -2.62 105.19 100.32 2mob n GLY 119 Ca 0.55 -0.01 0.02 0.00 0.00 0.00 0.00 46.02 46.58 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 -4.67 2.61 -2.24 -1.26 -5.05 114.28 103.67 2mob n THR 120 Ca 0.00 -0.31 -0.30 0.00 -2.27 0.00 0.00 64.05 61.16 2mob n THR 120 Cb 0.00 0.83 -0.08 0.00 -2.10 0.00 0.00 70.33 68.99 2mob n THR 120 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2mob s LYS 121 N -1.67 2.10 0.06 -0.78 1.02 -1.08 -3.92 119.74 115.47 2mob s LYS 121 Ca 0.01 -2.33 0.07 0.00 0.02 0.00 0.00 55.97 53.74 2mob s LYS 121 Cb 0.03 -1.14 -0.03 0.00 -0.52 0.00 0.00 37.83 36.18 2mob s LYS 121 CO 0.19 -0.43 -0.18 0.12 -0.92 0.00 0.00 175.35 174.13 2mob s PHE 122 N -3.01 1.58 -0.07 3.18 2.19 -1.05 -0.19 117.98 120.61 2mob s PHE 122 Ca 0.12 -0.38 -0.01 0.00 0.33 0.00 0.00 56.93 56.99 2mob s PHE 122 Cb 0.02 -0.92 0.03 0.00 -1.31 0.00 0.00 43.02 40.83 2mob s PHE 122 CO 0.07 0.10 -0.02 0.99 1.83 0.00 0.00 175.22 178.19 2mob s THR 123 N -0.93 0.47 0.34 0.12 2.01 0.57 -1.06 115.64 117.16 2mob s THR 123 Ca 0.05 0.02 0.06 0.00 0.31 0.00 0.00 61.69 62.13 2mob s THR 123 Cb -0.09 -0.57 -0.07 0.00 0.01 0.00 0.00 72.50 71.78 2mob s THR 123 CO 0.02 0.25 0.01 -0.63 -0.69 0.00 0.00 174.62 173.58 2mob s ILE 124 N 1.62 1.62 0.05 1.82 1.09 0.21 0.25 121.20 127.87 2mob s ILE 124 Ca -0.00 -2.04 -0.26 0.00 -1.10 0.00 0.00 60.65 57.25 2mob s ILE 124 Cb -0.13 -2.78 0.07 0.00 -1.06 0.00 0.00 42.46 38.56 2mob s ILE 124 CO -0.04 -0.08 0.61 0.28 -0.10 0.00 0.00 174.94 175.61 2mob s THR 125 N -3.00 0.01 -0.24 2.92 -1.32 -1.26 -1.36 115.64 111.39 2mob s THR 125 Ca 0.34 -0.06 -0.18 0.00 -1.21 0.00 0.00 61.69 60.58 2mob s THR 125 Cb 0.08 -0.99 -0.16 0.00 -1.51 0.00 0.00 72.50 69.91 2mob s THR 125 CO 0.16 -0.03 -0.06 -1.20 -2.21 0.00 0.00 174.62 171.28 2mob n SER 126 N 0.31 1.91 -4.79 8.08 7.64 -0.26 -3.75 113.62 122.76 2mob n SER 126 Ca -0.18 0.38 -0.37 0.00 1.01 0.00 0.00 58.87 59.71 2mob n SER 126 Cb 0.61 -0.90 -0.06 0.00 -1.01 0.00 0.00 64.21 62.85 2mob n SER 126 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2mob s GLU 127 N -2.43 4.53 0.00 1.43 2.02 -1.26 -4.87 118.70 118.12 2mob s GLU 127 Ca -0.34 1.24 0.00 0.00 0.02 0.00 0.00 54.97 55.89 2mob s GLU 127 Cb 0.10 -2.86 0.00 0.00 0.10 0.00 0.00 34.13 31.47 2mob s GLU 127 CO 0.54 0.33 0.46 1.47 0.02 0.00 0.00 175.26 178.08