#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2mob h ASN 36 N 0.00 0.50 0.00 6.43 -1.07 -1.97 -3.34 115.58 116.13 2mob h ASN 36 Ca 0.00 -0.89 -0.51 0.00 0.07 0.00 0.00 56.30 54.97 2mob h ASN 36 Cb 0.00 -0.16 -0.04 0.00 -2.07 0.00 0.00 38.32 36.05 2mob h ASN 36 CO 0.00 1.34 1.09 0.00 0.07 0.00 0.00 177.43 179.93 2mob n ALA 37 N -2.64 0.18 -2.56 4.14 0.00 -1.26 -4.48 120.51 113.88 2mob n ALA 37 Ca -0.13 0.03 -0.23 0.00 0.00 0.00 0.00 53.44 53.11 2mob n ALA 37 Cb 0.78 -1.60 -0.12 0.00 0.00 0.00 0.00 19.45 18.51 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 5.19 1.63 -0.05 0.00 0.11 -0.95 -4.94 120.40 121.38 2mob s VAL 38 Ca 0.93 -1.50 -0.01 0.00 -2.93 0.00 0.00 61.98 58.48 2mob s VAL 38 Cb -1.06 -1.49 -0.04 0.00 -1.53 0.00 0.00 36.38 32.26 2mob s VAL 38 CO 0.45 -0.07 0.04 0.54 -3.33 0.00 0.00 175.10 172.73 2mob s VAL 39 N -1.16 4.50 0.28 2.04 0.11 -1.26 -1.91 120.40 122.99 2mob s VAL 39 Ca 0.05 -0.32 0.06 0.00 -2.93 0.00 0.00 61.98 58.84 2mob s VAL 39 Cb -0.10 -2.97 -0.02 0.00 -1.53 0.00 0.00 36.38 31.76 2mob s VAL 39 CO 0.04 0.49 0.38 -0.22 -3.33 0.00 0.00 175.10 172.46 2mob s LEU 40 N -1.27 4.11 -0.28 2.54 2.96 0.50 -4.48 118.68 122.75 2mob s LEU 40 Ca 0.17 -0.08 -0.18 0.00 -0.22 0.00 0.00 54.13 53.82 2mob s LEU 40 Cb -0.12 -2.74 0.12 0.00 0.50 0.00 0.00 46.19 43.95 2mob s LEU 40 CO 0.07 -0.21 0.88 -0.69 -1.32 0.00 0.00 176.35 175.09 2mob s VAL 41 N -2.08 0.00 0.06 1.68 1.01 -1.26 -1.75 120.40 118.05 2mob s VAL 41 Ca 0.38 0.00 0.01 0.00 0.00 0.00 0.00 61.98 62.37 2mob s VAL 41 Cb -0.09 -1.00 -0.00 0.00 0.00 0.00 0.00 36.38 35.29 2mob s VAL 41 CO 0.29 0.00 0.06 0.18 0.00 0.00 0.00 175.10 175.63 2mob n LEU 42 N 3.57 0.00 -4.93 3.92 4.77 0.02 -4.00 117.00 120.34 2mob n LEU 42 Ca -0.18 -0.53 -0.28 0.00 -0.03 0.00 0.00 56.01 54.99 2mob n LEU 42 Cb 0.58 0.35 -0.03 0.00 -2.33 0.00 0.00 43.42 41.98 2mob n LEU 42 CO 0.01 -0.10 -0.05 0.00 -1.33 0.00 0.00 177.39 175.92 2mob s MET 43 N -2.20 3.49 -0.75 3.23 0.23 -1.26 -1.41 119.30 120.62 2mob s MET 43 Ca 0.06 -0.43 -0.24 0.00 -1.03 0.00 0.00 55.69 54.05 2mob s MET 43 Cb 0.00 -2.93 -0.16 0.00 -1.53 0.00 0.00 34.83 30.22 2mob s MET 43 CO 0.04 0.49 2.43 1.63 -2.03 0.00 0.00 175.02 177.59 2mob n LYS 44 N -0.35 0.55 0.00 3.16 4.76 -1.26 -4.16 118.16 120.85 2mob n LYS 44 Ca -0.05 -0.25 0.00 0.00 -2.87 0.00 0.00 58.31 55.14 2mob n LYS 44 Cb 0.53 -2.78 0.00 0.00 -1.84 0.00 0.00 35.03 30.94 2mob n LYS 44 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2mob n SER 45 N 14.17 0.00 0.00 4.39 2.88 -1.26 -4.95 113.62 128.85 2mob n SER 45 Ca 0.50 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.04 2mob n SER 45 Cb 0.35 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.81 2mob n SER 45 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2mob n ASP 46 N 0.00 0.00 -2.12 -3.46 -0.08 -1.26 -4.95 116.55 104.69 2mob n ASP 46 Ca 0.00 0.00 -0.25 0.00 -1.51 0.00 0.00 54.79 53.03 2mob n ASP 46 Cb 0.00 0.44 0.10 0.00 2.34 0.00 0.00 41.12 43.99 2mob n ASP 46 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2mob n GLU 47 N -2.46 2.25 0.20 -0.67 1.02 -1.26 -4.71 120.64 115.02 2mob n GLU 47 Ca 0.00 -2.62 -0.11 0.00 -0.02 0.00 0.00 57.16 54.42 2mob n GLU 47 Cb 0.00 -2.03 -0.06 0.00 -0.02 0.00 0.00 31.44 29.34 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 0.93 0.00 -1.24 -3.67 -2.65 -1.96 2.53 117.51 111.46 2mob h ILE 48 Ca 0.51 0.00 0.37 0.00 1.03 0.00 0.00 64.86 66.77 2mob h ILE 48 Cb 1.50 0.00 -0.10 0.00 -2.05 0.00 0.00 36.82 36.17 2mob h ILE 48 CO 1.16 0.00 0.82 -0.78 0.03 0.00 0.00 178.15 179.38 2mob h ASP 49 N -0.62 0.26 0.00 2.16 3.58 -1.97 2.40 116.42 122.22 2mob h ASP 49 Ca -0.05 0.09 -0.00 0.00 0.42 0.00 0.00 57.03 57.49 2mob h ASP 49 Cb 0.52 0.06 0.00 0.00 1.72 0.00 0.00 39.33 41.63 2mob h ASP 49 CO -0.00 -0.04 -0.02 0.00 -2.88 0.00 0.00 179.24 176.30 2mob h ALA 50 N 1.54 -0.00 -0.04 -0.78 0.00 -1.49 -2.64 119.26 115.84 2mob h ALA 50 Ca 0.70 -0.46 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 2mob h ALA 50 Cb 2.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.01 2mob h ALA 50 CO -0.28 -0.03 -0.09 -0.84 0.00 0.00 0.00 179.25 178.00 2mob h ILE 51 N -0.90 1.44 -0.97 0.00 3.07 0.68 -1.37 117.51 119.45 2mob h ILE 51 Ca -0.00 -1.43 0.26 0.00 1.55 0.00 0.00 64.86 65.24 2mob h ILE 51 Cb 0.93 2.29 -0.13 0.00 -0.27 0.00 0.00 36.82 39.63 2mob h ILE 51 CO 0.00 0.39 0.52 0.40 -1.05 0.00 0.00 178.15 178.41 2mob h ILE 52 N -0.39 0.43 0.71 0.16 1.08 0.38 4.71 117.51 124.59 2mob h ILE 52 Ca 0.00 -0.15 -0.03 0.00 -0.39 0.00 0.00 64.86 64.29 2mob h ILE 52 Cb 0.68 -0.04 0.01 0.00 -3.07 0.00 0.00 36.82 34.39 2mob h ILE 52 CO 0.02 0.08 -0.34 -0.08 -0.69 0.00 0.00 178.15 177.14 2mob h GLU 53 N 0.44 -0.91 0.00 2.37 4.81 -1.14 3.21 114.58 123.35 2mob h GLU 53 Ca 0.65 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.94 2mob h GLU 53 Cb 1.33 0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.91 2mob h GLU 53 CO -0.54 -0.61 -0.01 -3.47 -0.73 0.00 0.00 179.01 173.65 2mob n ASP 54 N -4.73 0.45 -0.08 1.04 2.03 -0.36 -1.51 116.55 113.39 2mob n ASP 54 Ca -0.12 0.53 -0.09 0.00 0.52 0.00 0.00 54.79 55.63 2mob n ASP 54 Cb 0.37 -0.64 -0.10 0.00 -0.72 0.00 0.00 41.12 40.03 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 -1.91 0.99 -0.02 5.18 0.13 1.53 -4.24 119.36 121.02 2mob n ILE 55 Ca 0.06 -0.53 -0.04 0.00 -1.10 0.00 0.00 62.75 61.14 2mob n ILE 55 Cb 0.39 -0.79 -0.02 0.00 -0.84 0.00 0.00 39.64 38.38 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 0.26 -0.08 9.51 0.31 0.80 -2.66 118.33 123.78 2mob n VAL 56 Ca -0.26 -0.09 -0.01 0.00 -0.01 0.00 0.00 64.34 63.97 2mob n VAL 56 Cb 0.92 -1.01 0.25 0.00 -0.91 0.00 0.00 33.84 33.09 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 -0.07 0.66 0.02 7.52 6.46 0.55 1.86 115.31 132.31 2mob h LEU 57 Ca -0.11 -0.11 -0.35 0.00 -0.12 0.00 0.00 57.88 57.19 2mob h LEU 57 Cb 1.14 -0.17 -0.05 0.00 -0.73 0.00 0.00 40.66 40.85 2mob h LEU 57 CO -0.04 0.65 -1.97 1.17 -0.62 0.00 0.00 178.44 177.63 2mob n LYS 58 N -4.30 0.61 0.03 1.25 3.00 -0.57 -3.37 118.16 114.81 2mob n LYS 58 Ca 0.03 0.37 -0.20 0.00 -0.00 0.00 0.00 58.31 58.52 2mob n LYS 58 Cb 0.21 -1.62 -0.14 0.00 0.00 0.00 0.00 35.03 33.47 2mob n LYS 58 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 2mob h GLY 59 N -0.38 0.30 0.55 3.14 0.00 -1.58 -3.28 103.07 101.82 2mob h GLY 59 Ca -0.52 -0.78 -0.01 0.00 0.00 0.00 0.00 47.33 46.03 2mob h GLY 59 CO -0.24 0.68 -0.09 -1.33 0.00 0.00 0.00 176.54 175.56 2mob h GLY 60 N -0.41 -0.27 0.34 4.60 0.00 0.26 -3.04 103.07 104.55 2mob h GLY 60 Ca -0.14 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.29 2mob h GLY 60 CO 0.13 -0.10 0.00 1.17 0.00 0.00 0.00 176.54 177.74 2mob n LYS 61 N -5.01 0.12 0.10 4.80 4.81 0.37 -3.27 118.16 120.08 2mob n LYS 61 Ca -0.09 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.25 2mob n LYS 61 Cb 0.25 -1.17 -0.06 0.00 0.02 0.00 0.00 35.03 34.07 2mob n LYS 61 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2mob h ALA 62 N 1.58 -0.88 0.00 3.14 0.00 -1.59 -3.13 119.26 118.38 2mob h ALA 62 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2mob h ALA 62 Cb 0.00 0.68 0.00 0.00 0.00 0.00 0.00 17.79 18.47 2mob h ALA 62 CO 0.00 -0.95 -1.72 1.63 0.00 0.00 0.00 179.25 178.22 2mob n LYS 63 N -4.31 0.64 -2.11 0.00 5.02 -1.25 -4.90 118.16 111.25 2mob n LYS 63 Ca -0.06 -0.11 -0.42 0.00 -2.02 0.00 0.00 58.31 55.70 2mob n LYS 63 Cb 0.27 -1.61 -0.03 0.00 -0.02 0.00 0.00 35.03 33.64 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 -4.75 6.76 0.16 4.39 0.01 -1.18 -4.92 114.94 115.41 2mob s ASN 64 Ca -0.06 2.27 -0.12 0.00 -0.71 0.00 0.00 52.86 54.25 2mob s ASN 64 Cb 0.13 -2.57 0.06 0.00 0.41 0.00 0.00 41.25 39.28 2mob s ASN 64 CO 0.88 -0.77 1.68 1.55 -1.51 0.00 0.00 177.10 178.93 2mob h PRO 65 N 7.82 0.90 -0.11 -0.60 0.13 -1.85 -3.41 132.00 134.87 2mob h PRO 65 Ca -0.40 -0.21 0.28 0.00 -0.87 0.00 0.00 66.00 64.80 2mob h PRO 65 Cb 1.19 -0.12 -0.22 0.00 0.13 0.00 0.00 31.00 31.98 2mob h PRO 65 CO 0.91 0.83 0.29 -1.54 -0.23 0.00 0.00 178.00 178.26 2mob s SER 66 N -6.22 -0.14 -0.01 1.44 1.04 -1.26 -5.08 113.70 103.47 2mob s SER 66 Ca -0.13 0.10 -0.01 0.00 0.48 0.00 0.00 55.95 56.39 2mob s SER 66 Cb 0.12 1.12 -0.04 0.00 0.10 0.00 0.00 66.02 67.33 2mob s SER 66 CO 0.81 -0.03 0.09 -0.63 0.98 0.00 0.00 173.24 174.47 2mob s ILE 67 N 2.91 4.83 -0.04 -1.02 1.09 -1.26 -4.40 121.20 123.31 2mob s ILE 67 Ca -0.08 -0.36 0.01 0.00 -1.10 0.00 0.00 60.65 59.12 2mob s ILE 67 Cb -0.08 -3.21 -0.03 0.00 -1.06 0.00 0.00 42.46 38.07 2mob s ILE 67 CO -0.08 0.35 -0.04 0.54 -0.10 0.00 0.00 174.94 175.61 2mob s VAL 68 N -1.21 3.89 -0.27 2.92 0.11 0.81 -4.92 120.40 121.73 2mob s VAL 68 Ca 0.23 -0.55 -0.06 0.00 -2.93 0.00 0.00 61.98 58.67 2mob s VAL 68 Cb -0.12 -2.66 -0.00 0.00 -1.53 0.00 0.00 36.38 32.07 2mob s VAL 68 CO 0.14 0.49 0.05 -0.69 -3.33 0.00 0.00 175.10 171.76 2mob s VAL 69 N -0.94 3.89 -0.71 2.04 1.01 -1.26 0.60 120.40 125.04 2mob s VAL 69 Ca 0.15 -0.53 -0.16 0.00 0.00 0.00 0.00 61.98 61.44 2mob s VAL 69 Cb -0.11 -2.92 0.17 0.00 0.00 0.00 0.00 36.38 33.52 2mob s VAL 69 CO 0.05 0.22 0.69 -1.61 0.00 0.00 0.00 175.10 174.45 2mob s GLU 70 N 1.52 3.33 -0.94 2.72 0.41 1.01 -4.95 118.70 121.79 2mob s GLU 70 Ca 0.04 -2.02 -0.17 0.00 -0.41 0.00 0.00 54.97 52.41 2mob s GLU 70 Cb -0.16 -4.40 0.15 0.00 -1.78 0.00 0.00 34.13 27.94 2mob s GLU 70 CO 0.01 -1.37 1.10 -0.51 -0.49 0.00 0.00 175.26 174.00 2mob s ASP 71 N 2.93 6.70 0.57 -0.19 1.11 -1.26 -0.89 116.67 125.65 2mob s ASP 71 Ca 0.13 -2.26 -0.04 0.00 0.18 0.00 0.00 52.55 50.56 2mob s ASP 71 Cb -0.18 -2.37 0.02 0.00 1.07 0.00 0.00 42.92 41.46 2mob s ASP 71 CO -0.03 -0.94 0.84 -0.54 1.18 0.00 0.00 175.17 175.68 2mob s LYS 72 N 2.11 2.82 0.17 8.23 1.02 -0.09 -4.96 119.74 129.04 2mob s LYS 72 Ca 0.31 -0.25 -0.25 0.00 0.02 0.00 0.00 55.97 55.81 2mob s LYS 72 Cb -0.05 -2.36 0.02 0.00 -0.52 0.00 0.00 37.83 34.92 2mob s LYS 72 CO -0.09 -0.66 1.41 0.00 -0.92 0.00 0.00 175.35 175.09 2mob n ALA 73 N -2.47 -0.44 -2.71 5.17 0.00 -1.26 -2.56 120.51 116.23 2mob n ALA 73 Ca 0.05 0.82 -0.18 0.00 0.00 0.00 0.00 53.44 54.13 2mob n ALA 73 Cb 0.58 -0.21 0.00 0.00 0.00 0.00 0.00 19.45 19.82 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 -1.29 3.58 3.14 0.00 0.00 -1.26 -4.88 105.19 104.48 2mob n GLY 74 Ca 0.04 -1.94 0.03 0.00 0.00 0.00 0.00 46.02 44.15 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 -3.18 -1.73 -1.22 1.61 0.08 -1.06 -4.41 117.98 108.08 2mob s PHE 75 Ca 0.37 1.26 -0.12 0.00 0.12 0.00 0.00 56.93 58.56 2mob s PHE 75 Cb 0.41 0.38 0.18 0.00 -0.57 0.00 0.00 43.02 43.41 2mob s PHE 75 CO -0.06 -1.01 1.53 1.87 -0.10 0.00 0.00 175.22 177.44 2mob n TRP 76 N 5.42 4.51 -3.96 0.36 -0.00 -0.50 -0.91 117.44 122.35 2mob n TRP 76 Ca 0.03 -3.24 -0.34 0.00 -0.00 0.00 0.00 57.50 53.94 2mob n TRP 76 Cb 0.53 -2.11 -0.06 0.00 -0.00 0.00 0.00 31.31 29.67 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 1.17 3.49 -0.00 5.87 0.52 -0.07 -0.80 118.94 129.12 2mob s TRP 77 Ca 0.42 0.37 0.01 0.00 0.02 0.00 0.00 56.10 56.91 2mob s TRP 77 Cb -0.00 -1.84 -0.00 0.00 -1.15 0.00 0.00 33.47 30.48 2mob s TRP 77 CO 0.00 0.64 -0.03 0.42 0.02 0.00 0.00 176.95 178.01 2mob s ILE 78 N -1.19 0.25 -0.15 2.03 1.01 -0.72 0.33 121.20 122.76 2mob s ILE 78 Ca 0.22 -0.13 -0.07 0.00 0.00 0.00 0.00 60.65 60.68 2mob s ILE 78 Cb -0.12 -0.23 -0.04 0.00 0.01 0.00 0.00 42.46 42.08 2mob s ILE 78 CO 0.13 0.08 0.09 -1.59 0.00 0.00 0.00 174.94 173.65 2mob s LYS 79 N -0.00 3.69 0.02 2.79 -2.85 0.20 0.19 119.74 123.77 2mob s LYS 79 Ca 0.00 -0.26 0.03 0.00 -1.00 0.00 0.00 55.97 54.74 2mob s LYS 79 Cb -0.02 -3.18 -0.01 0.00 -2.06 0.00 0.00 37.83 32.55 2mob s LYS 79 CO -0.00 0.51 -0.08 0.00 0.10 0.00 0.00 175.35 175.88 2mob s ALA 80 N -0.29 0.66 -0.66 0.59 0.00 -0.80 -0.13 121.76 121.12 2mob s ALA 80 Ca 0.10 -0.51 -0.03 0.00 0.00 0.00 0.00 51.96 51.52 2mob s ALA 80 Cb -0.12 -0.09 0.20 0.00 0.00 0.00 0.00 23.12 23.11 2mob s ALA 80 CO 0.01 0.10 2.41 -0.25 0.00 0.00 0.00 175.76 178.04 2mob n ASP 81 N 2.33 7.00 -0.98 0.00 8.00 -1.26 -2.25 116.55 129.40 2mob n ASP 81 Ca -0.17 -3.51 0.00 0.00 0.71 0.00 0.00 54.79 51.83 2mob n ASP 81 Cb 0.56 -1.16 0.00 0.00 -0.02 0.00 0.00 41.12 40.51 2mob n ASP 81 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2mob n GLY 82 N 0.22 1.12 3.77 0.44 0.00 -1.26 -4.74 105.19 104.73 2mob n GLY 82 Ca 0.51 -0.89 -0.38 0.00 0.00 0.00 0.00 46.02 45.26 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 3.18 0.20 4.61 0.00 -1.26 -4.57 121.76 122.93 2mob s ALA 83 Ca 0.00 0.93 0.08 0.00 0.00 0.00 0.00 51.96 52.97 2mob s ALA 83 Cb 0.00 -3.36 -0.05 0.00 0.00 0.00 0.00 23.12 19.71 2mob s ALA 83 CO 0.00 -0.45 -0.15 -1.50 0.00 0.00 0.00 175.76 173.66 2mob s ILE 84 N -1.41 1.76 0.14 0.00 1.10 -1.01 -5.05 121.20 116.72 2mob s ILE 84 Ca 0.56 -2.20 0.09 0.00 -0.51 0.00 0.00 60.65 58.59 2mob s ILE 84 Cb -0.30 -2.03 -0.04 0.00 0.15 0.00 0.00 42.46 40.24 2mob s ILE 84 CO 0.38 -0.58 -0.22 -1.61 -2.11 0.00 0.00 174.94 170.80 2mob s GLU 85 N -3.59 1.28 0.37 3.50 2.02 -1.26 -2.00 118.70 119.02 2mob s GLU 85 Ca 0.22 -1.31 0.07 0.00 0.02 0.00 0.00 54.97 53.97 2mob s GLU 85 Cb -0.01 -1.56 -0.07 0.00 0.10 0.00 0.00 34.13 32.58 2mob s GLU 85 CO 0.07 0.35 -0.02 0.42 0.02 0.00 0.00 175.26 176.10 2mob s ILE 86 N -1.41 1.97 0.38 -1.63 -1.09 -1.05 -4.93 121.20 113.45 2mob s ILE 86 Ca 0.12 -2.07 0.04 0.00 -2.23 0.00 0.00 60.65 56.51 2mob s ILE 86 Cb -0.09 -2.84 -0.03 0.00 -1.58 0.00 0.00 42.46 37.92 2mob s ILE 86 CO 0.06 -0.08 0.14 -1.81 -1.23 0.00 0.00 174.94 172.02 2mob s ASP 87 N -3.64 2.51 0.00 3.58 1.01 -1.26 -0.06 116.67 118.81 2mob s ASP 87 Ca 0.34 -1.65 0.00 0.00 0.71 0.00 0.00 52.55 51.95 2mob s ASP 87 Cb 0.07 0.47 0.00 0.00 1.01 0.00 0.00 42.92 44.47 2mob s ASP 87 CO 0.17 -0.92 0.00 0.00 0.21 0.00 0.00 175.17 174.63 2mob n ALA 88 N -0.83 1.28 -0.23 5.23 0.00 -1.22 -4.81 120.51 119.92 2mob n ALA 88 Ca -0.04 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.43 2mob n ALA 88 Cb 0.65 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.23 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 0.73 -0.98 0.00 0.00 -1.88 0.56 119.26 117.69 2mob h ALA 89 Ca 0.00 0.20 0.24 0.00 0.00 0.00 0.00 54.91 55.35 2mob h ALA 89 Cb 0.00 0.33 -0.12 0.00 0.00 0.00 0.00 17.79 18.00 2mob h ALA 89 CO 0.00 -0.39 0.55 0.93 0.00 0.00 0.00 179.25 180.34 2mob h GLU 90 N 0.14 0.53 -0.67 0.00 5.08 -1.91 1.18 114.58 118.93 2mob h GLU 90 Ca 0.37 -0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.80 2mob h GLU 90 Cb 0.62 -0.12 -0.08 0.00 0.50 0.00 0.00 28.75 29.67 2mob h GLU 90 CO -0.56 0.35 0.26 0.00 -1.00 0.00 0.00 179.01 178.05 2mob h ALA 91 N 1.72 0.89 -0.98 3.43 0.00 -0.24 0.16 119.26 124.23 2mob h ALA 91 Ca 0.62 0.09 0.18 0.00 0.00 0.00 0.00 54.91 55.81 2mob h ALA 91 Cb 1.17 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 18.92 2mob h ALA 91 CO -0.48 -0.19 0.59 0.78 0.00 0.00 0.00 179.25 179.94 2mob h GLY 92 N 0.43 1.73 1.79 0.00 0.00 0.17 0.84 103.07 108.02 2mob h GLY 92 Ca 0.35 -0.35 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 2mob h GLY 92 CO -0.34 -0.05 -0.15 0.83 0.00 0.00 0.00 176.54 176.82 2mob h GLU 93 N 0.75 0.26 0.26 4.80 5.08 -0.72 2.02 114.58 127.04 2mob h GLU 93 Ca 0.56 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.84 2mob h GLU 93 Cb 0.85 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.07 2mob h GLU 93 CO -0.38 0.42 -0.13 1.25 -1.00 0.00 0.00 179.01 179.18 2mob h LEU 94 N 0.25 -0.30 0.00 1.33 6.46 0.10 -3.41 115.31 119.74 2mob h LEU 94 Ca 0.05 0.01 -0.17 0.00 -0.12 0.00 0.00 57.88 57.65 2mob h LEU 94 Cb 0.42 0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.40 2mob h LEU 94 CO 0.03 -0.06 -1.79 0.00 -0.62 0.00 0.00 178.44 175.99 2mob n LEU 95 N -3.78 0.00 -2.75 2.25 -0.00 -0.35 -5.06 117.00 107.32 2mob n LEU 95 Ca -0.04 0.00 -0.08 0.00 -0.00 0.00 0.00 56.01 55.89 2mob n LEU 95 Cb 0.14 0.23 0.04 0.00 -0.00 0.00 0.00 43.42 43.82 2mob n LEU 95 CO 0.11 0.23 0.09 0.61 -0.00 0.00 0.00 177.39 178.42 2mob n GLY 96 N 2.10 -0.73 0.00 1.47 0.00 0.68 -4.79 105.19 103.92 2mob n GLY 96 Ca -0.16 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2mob n GLY 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2mob n LYS 97 N -2.42 0.00 -0.08 1.61 5.02 -1.26 -4.88 118.16 116.15 2mob n LYS 97 Ca -0.04 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.33 2mob n LYS 97 Cb 0.56 0.00 0.30 0.00 -0.02 0.00 0.00 35.03 35.87 2mob n LYS 97 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 2mob n PRO 98 N 0.00 1.51 0.00 1.97 -0.04 -1.26 -4.76 135.00 132.42 2mob n PRO 98 Ca 0.00 -0.77 0.00 0.00 -0.04 0.00 0.00 63.50 62.69 2mob n PRO 98 Cb 0.00 -1.29 0.00 0.00 -0.04 0.00 0.00 33.50 32.17 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 0.04 0.00 0.00 0.54 -1.74 -1.26 0.22 117.46 115.26 2mob n PHE 99 Ca 0.12 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 57.01 2mob n PHE 99 Cb 0.22 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.22 2mob n PHE 99 CO 0.00 0.00 0.00 -1.13 -0.56 0.00 0.00 176.76 175.07 2mob n SER 100 N 0.00 0.00 -0.01 5.98 3.41 -0.91 0.27 113.62 122.37 2mob n SER 100 Ca 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2mob n SER 100 Cb 0.00 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 63.95 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 0.00 -0.38 -3.33 2.07 -1.88 -0.05 116.25 112.68 2mob h VAL 101 Ca 0.00 -0.12 0.09 0.00 0.82 0.00 0.00 66.70 67.49 2mob h VAL 101 Cb 0.00 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.75 2mob h VAL 101 CO 0.00 0.00 0.26 1.88 0.02 0.00 0.00 177.57 179.73 2mob h TYR 102 N -0.12 0.10 -0.52 1.57 0.05 0.84 1.94 116.97 120.84 2mob h TYR 102 Ca 0.00 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.68 2mob h TYR 102 Cb 0.04 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 37.72 2mob h TYR 102 CO -0.02 0.05 -0.08 0.22 -1.05 0.00 0.00 178.16 177.29 2mob h ASP 103 N 0.10 0.96 0.19 3.88 3.58 1.67 -2.30 116.42 124.50 2mob h ASP 103 Ca 0.18 -0.34 -0.31 0.00 0.42 0.00 0.00 57.03 56.98 2mob h ASP 103 Cb 0.57 -0.26 0.02 0.00 1.72 0.00 0.00 39.33 41.38 2mob h ASP 103 CO -0.02 1.08 -1.47 0.17 -2.88 0.00 0.00 179.24 176.12 2mob h LEU 104 N 0.83 0.61 -1.47 2.28 8.10 0.17 -0.83 115.31 125.00 2mob h LEU 104 Ca 0.14 -0.92 0.00 0.00 0.11 0.00 0.00 57.88 57.21 2mob h LEU 104 Cb 0.63 -0.20 0.00 0.00 -0.44 0.00 0.00 40.66 40.65 2mob h LEU 104 CO 0.04 1.68 0.25 -0.07 -4.11 0.00 0.00 178.44 176.23 2mob h LEU 105 N -0.04 0.00 0.00 0.17 3.38 0.28 2.94 115.31 122.05 2mob h LEU 105 Ca -0.28 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.52 2mob h LEU 105 Cb 1.98 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.70 2mob h LEU 105 CO 0.18 0.00 -1.74 -0.38 0.09 0.00 0.00 178.44 176.59 2mob n ILE 106 N -2.44 0.62 0.29 1.22 5.41 -0.87 -4.62 119.36 118.97 2mob n ILE 106 Ca -0.01 -0.44 0.03 0.00 1.00 0.00 0.00 62.75 63.33 2mob n ILE 106 Cb 0.29 -0.51 0.01 0.00 -0.71 0.00 0.00 39.64 38.72 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 -2.32 1.24 0.00 4.38 0.23 -0.29 -4.52 115.26 113.98 2mob n ASN 107 Ca -0.15 -1.12 0.14 0.00 -0.53 0.00 0.00 54.58 52.91 2mob n ASN 107 Cb 0.76 0.27 0.54 0.00 -2.08 0.00 0.00 39.78 39.27 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 -0.02 0.01 0.25 3.53 3.14 0.97 -3.86 118.33 122.36 2mob n VAL 108 Ca 0.03 -0.01 0.08 0.00 -2.96 0.00 0.00 64.34 61.49 2mob n VAL 108 Cb 0.16 -0.36 0.27 0.00 -1.06 0.00 0.00 33.84 32.85 2mob n VAL 108 CO 0.00 0.00 0.00 -1.28 -6.46 0.00 0.00 176.83 169.09 2mob h SER 109 N 0.00 0.00 0.00 6.55 0.87 -1.80 0.14 113.55 119.31 2mob h SER 109 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2mob h SER 109 Cb 0.50 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 2mob h SER 109 CO 0.00 0.00 0.14 -1.54 -0.53 0.00 0.00 176.83 174.90 2mob n SER 110 N -2.73 0.00 0.00 6.23 3.41 -1.25 -3.91 113.62 115.37 2mob n SER 110 Ca 0.03 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.89 2mob n SER 110 Cb 0.91 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 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 -1.22 0.00 0.00 6.66 5.66 0.04 -4.36 114.28 121.06 2mob n THR 111 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2mob n THR 111 Cb 0.14 -0.50 0.00 0.00 -1.55 0.00 0.00 70.33 68.42 2mob n THR 111 CO 0.00 0.00 0.00 0.55 -3.05 0.00 0.00 175.07 172.57 2mob n VAL 112 N -0.65 0.00 0.00 1.08 3.14 -1.25 -4.74 118.33 115.91 2mob n VAL 112 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2mob n VAL 112 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 2mob n VAL 112 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2mob n GLY 113 N -2.00 0.03 3.52 7.55 0.00 -1.26 -5.08 105.19 107.96 2mob n GLY 113 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 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 -0.46 1.91 -0.43 1.61 6.06 -1.26 -4.88 118.95 121.50 2mob s ARG 114 Ca 0.00 -1.18 0.04 0.00 -2.50 0.00 0.00 55.73 52.09 2mob s ARG 114 Cb 0.00 -2.15 0.27 0.00 0.06 0.00 0.00 34.95 33.12 2mob s ARG 114 CO 0.00 0.47 1.04 0.00 -2.50 0.00 0.00 175.30 174.32 2mob n ALA 115 N 0.57 -2.00 -2.14 6.12 0.00 -1.11 -3.46 120.51 118.49 2mob n ALA 115 Ca -0.14 -1.06 -0.42 0.00 0.00 0.00 0.00 53.44 51.81 2mob n ALA 115 Cb 0.53 -1.92 -0.03 0.00 0.00 0.00 0.00 19.45 18.04 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 0.45 2.63 -0.13 0.00 5.04 0.68 -4.62 117.35 121.41 2mob s TYR 116 Ca 0.28 0.64 -0.15 0.00 -2.44 0.00 0.00 57.07 55.40 2mob s TYR 116 Cb 0.24 -3.75 -0.05 0.00 0.35 0.00 0.00 41.96 38.75 2mob s TYR 116 CO -0.18 -2.90 0.36 -0.08 -1.34 0.00 0.00 175.55 171.41 2mob s THR 117 N 2.76 5.24 -0.77 4.34 -1.32 -1.26 0.19 115.64 124.82 2mob s THR 117 Ca 0.67 0.69 -0.02 0.00 -1.21 0.00 0.00 61.69 61.82 2mob s THR 117 Cb -0.33 -3.69 0.39 0.00 -1.51 0.00 0.00 72.50 67.37 2mob s THR 117 CO 0.27 0.40 2.03 -0.11 -2.21 0.00 0.00 174.62 175.00 2mob n LEU 118 N 3.32 7.59 0.00 9.08 7.94 -0.31 -4.89 117.00 139.73 2mob n LEU 118 Ca -0.11 -4.62 0.00 0.00 -1.11 0.00 0.00 56.01 50.17 2mob n LEU 118 Cb 0.52 -1.03 0.00 0.00 0.53 0.00 0.00 43.42 43.44 2mob n LEU 118 CO 0.40 1.65 0.00 0.61 -1.11 0.00 0.00 177.39 178.94 2mob n GLY 119 N -0.69 0.57 0.00 -3.96 0.00 -1.26 -2.57 105.19 97.27 2mob n GLY 119 Ca 0.58 -0.01 0.02 0.00 0.00 0.00 0.00 46.02 46.61 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 -3.83 2.61 -2.24 -1.26 -4.83 114.28 104.72 2mob n THR 120 Ca 0.00 -0.37 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 2mob n THR 120 Cb 0.00 0.97 0.00 0.00 -2.10 0.00 0.00 70.33 69.20 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 -1.14 2.29 -3.74 -0.78 4.81 -1.06 -3.46 118.16 115.08 2mob n LYS 121 Ca 0.01 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.33 2mob n LYS 121 Cb 0.08 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 35.05 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 -0.69 -0.16 -0.12 5.64 2.19 0.91 -1.16 117.98 124.59 2mob s PHE 122 Ca 0.00 0.11 -0.04 0.00 0.33 0.00 0.00 56.93 57.34 2mob s PHE 122 Cb 0.00 0.12 0.06 0.00 -1.31 0.00 0.00 43.02 41.89 2mob s PHE 122 CO 0.00 -0.48 0.14 0.99 1.83 0.00 0.00 175.22 177.70 2mob s THR 123 N -2.17 -0.21 0.12 0.12 2.01 0.52 -2.52 115.64 113.51 2mob s THR 123 Ca -0.08 0.14 0.08 0.00 0.31 0.00 0.00 61.69 62.15 2mob s THR 123 Cb -0.02 -0.42 -0.04 0.00 0.01 0.00 0.00 72.50 72.03 2mob s THR 123 CO -0.01 -0.03 -0.20 0.27 -0.69 0.00 0.00 174.62 173.96 2mob s ILE 124 N 2.24 1.75 0.00 1.82 -0.00 -0.85 0.25 121.20 126.41 2mob s ILE 124 Ca 0.04 -1.66 0.00 0.00 -0.00 0.00 0.00 60.65 59.03 2mob s ILE 124 Cb -0.14 -1.65 0.00 0.00 -0.00 0.00 0.00 42.46 40.67 2mob s ILE 124 CO -0.07 -0.14 0.00 1.07 -0.00 0.00 0.00 174.94 175.80 2mob n THR 125 N 0.84 0.00 0.00 8.37 5.66 -1.22 -2.41 114.28 125.52 2mob n THR 125 Ca -0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 2mob n THR 125 Cb 0.55 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.33 2mob n THR 125 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 2mob n SER 126 N -2.15 0.00 -4.33 1.09 3.41 -1.26 -4.25 113.62 106.13 2mob n SER 126 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.21 2mob n SER 126 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 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 0.00 2.73 0.00 4.33 2.02 -1.25 -4.31 118.70 122.22 2mob s GLU 127 Ca 0.00 -1.13 0.00 0.00 0.02 0.00 0.00 54.97 53.86 2mob s GLU 127 Cb 0.00 -3.64 0.00 0.00 0.10 0.00 0.00 34.13 30.59 2mob s GLU 127 CO 0.00 -0.70 0.21 1.47 0.02 0.00 0.00 175.26 176.26