#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 -3.96 -3.46 3.02 -1.26 -4.98 115.26 104.62 2mob n ASN 36 Ca 0.00 0.00 -0.57 0.00 -0.03 0.00 0.00 54.58 53.98 2mob n ASN 36 Cb 0.00 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.08 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 -3.00 -0.84 -2.10 5.41 0.00 -1.26 -4.81 120.51 113.91 2mob n ALA 37 Ca 0.00 0.36 -0.20 0.00 0.00 0.00 0.00 53.44 53.61 2mob n ALA 37 Cb 0.00 -1.67 0.02 0.00 0.00 0.00 0.00 19.45 17.79 2mob n ALA 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2mob s VAL 38 N 3.18 2.52 0.02 0.00 -7.23 -0.84 -4.98 120.40 113.07 2mob s VAL 38 Ca 0.93 -1.12 0.01 0.00 -1.81 0.00 0.00 61.98 59.99 2mob s VAL 38 Cb -1.28 -2.64 -0.01 0.00 0.56 0.00 0.00 36.38 33.00 2mob s VAL 38 CO 0.67 0.00 -0.04 0.54 -0.31 0.00 0.00 175.10 175.95 2mob s VAL 39 N -2.52 0.30 -0.08 1.32 0.11 -1.26 -1.88 120.40 116.39 2mob s VAL 39 Ca 0.54 -0.62 0.01 0.00 -2.93 0.00 0.00 61.98 58.97 2mob s VAL 39 Cb -0.06 -0.34 -0.03 0.00 -1.53 0.00 0.00 36.38 34.42 2mob s VAL 39 CO 0.33 -0.22 -0.09 -0.22 -3.33 0.00 0.00 175.10 171.57 2mob s LEU 40 N -0.90 3.01 -0.07 2.54 2.96 0.37 -4.34 118.68 122.25 2mob s LEU 40 Ca -0.07 -0.12 -0.00 0.00 -0.22 0.00 0.00 54.13 53.72 2mob s LEU 40 Cb -0.06 -1.66 0.02 0.00 0.50 0.00 0.00 46.19 45.00 2mob s LEU 40 CO -0.00 0.31 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.61 2mob s VAL 41 N -0.48 0.58 0.39 1.68 1.01 -1.25 -0.09 120.40 122.25 2mob s VAL 41 Ca 0.07 -0.07 0.05 0.00 0.00 0.00 0.00 61.98 62.03 2mob s VAL 41 Cb -0.12 -0.65 -0.02 0.00 0.00 0.00 0.00 36.38 35.59 2mob s VAL 41 CO 0.02 0.27 0.17 -0.76 0.00 0.00 0.00 175.10 174.80 2mob s LEU 42 N 1.46 1.92 0.68 3.92 1.43 0.01 -3.55 118.68 124.55 2mob s LEU 42 Ca -0.02 -1.72 -0.04 0.00 -1.03 0.00 0.00 54.13 51.32 2mob s LEU 42 Cb -0.13 0.09 0.08 0.00 0.03 0.00 0.00 46.19 46.26 2mob s LEU 42 CO -0.03 -0.99 0.96 0.00 0.23 0.00 0.00 176.35 176.52 2mob s MET 43 N -3.63 2.07 -1.08 1.70 0.23 -1.26 -0.70 119.30 116.63 2mob s MET 43 Ca 0.28 -0.60 -0.24 0.00 -1.03 0.00 0.00 55.69 54.10 2mob s MET 43 Cb 0.02 -2.27 -0.09 0.00 -1.53 0.00 0.00 34.83 30.95 2mob s MET 43 CO 0.18 -1.22 1.98 0.15 -2.03 0.00 0.00 175.02 174.08 2mob s LYS 44 N -5.13 2.32 0.00 3.16 1.02 -1.22 -4.04 119.74 115.84 2mob s LYS 44 Ca 0.62 -0.78 0.00 0.00 0.02 0.00 0.00 55.97 55.82 2mob s LYS 44 Cb -0.09 -5.15 0.00 0.00 -0.52 0.00 0.00 37.83 32.07 2mob s LYS 44 CO 0.43 -4.02 0.33 0.43 -0.92 0.00 0.00 175.35 171.60 2mob n SER 45 N 15.07 0.00 0.00 2.83 7.64 -1.26 -4.99 113.62 132.91 2mob n SER 45 Ca 0.43 0.33 0.00 0.00 1.01 0.00 0.00 58.87 60.64 2mob n SER 45 Cb 0.47 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 2mob n SER 45 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 2mob n ASP 46 N -0.43 0.00 -2.18 6.43 5.68 -1.26 -4.95 116.55 119.84 2mob n ASP 46 Ca 0.00 0.00 -0.28 0.00 -0.50 0.00 0.00 54.79 54.01 2mob n ASP 46 Cb 0.00 0.00 0.08 0.00 -1.14 0.00 0.00 41.12 40.06 2mob n ASP 46 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2mob n GLU 47 N -0.68 2.37 -0.16 0.11 1.02 -1.26 -4.74 120.64 117.31 2mob n GLU 47 Ca 0.00 -2.75 -0.13 0.00 -0.02 0.00 0.00 57.16 54.27 2mob n GLU 47 Cb 0.00 -2.08 -0.09 0.00 -0.02 0.00 0.00 31.44 29.25 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 0.97 0.00 -0.84 -3.67 -2.65 -1.95 2.63 117.51 112.01 2mob h ILE 48 Ca 0.52 0.00 0.21 0.00 1.03 0.00 0.00 64.86 66.62 2mob h ILE 48 Cb 1.13 0.00 -0.13 0.00 -2.05 0.00 0.00 36.82 35.77 2mob h ILE 48 CO 1.29 0.00 0.26 0.44 0.03 0.00 0.00 178.15 180.16 2mob h ASP 49 N -0.33 0.09 -0.09 2.16 3.32 -1.98 2.49 116.42 122.08 2mob h ASP 49 Ca 0.08 0.17 -0.05 0.00 0.02 0.00 0.00 57.03 57.24 2mob h ASP 49 Cb 0.53 0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.29 2mob h ASP 49 CO -0.59 -0.08 -0.16 0.00 -1.72 0.00 0.00 179.24 176.69 2mob h ALA 50 N 1.71 0.14 -0.00 3.45 0.00 -0.38 -2.72 119.26 121.46 2mob h ALA 50 Ca 0.51 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 2mob h ALA 50 Cb 0.97 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2mob h ALA 50 CO -0.58 0.05 -0.02 -0.84 0.00 0.00 0.00 179.25 177.86 2mob h ILE 51 N -0.19 1.58 -1.13 0.00 3.07 0.60 -1.26 117.51 120.18 2mob h ILE 51 Ca 0.01 -1.75 0.35 0.00 1.55 0.00 0.00 64.86 65.02 2mob h ILE 51 Cb 0.73 2.76 -0.13 0.00 -0.27 0.00 0.00 36.82 39.92 2mob h ILE 51 CO 0.04 0.46 0.70 0.40 -1.05 0.00 0.00 178.15 178.69 2mob h ILE 52 N -0.71 0.30 0.39 0.16 1.08 0.41 4.77 117.51 123.92 2mob h ILE 52 Ca -0.00 -0.09 -0.02 0.00 -0.39 0.00 0.00 64.86 64.36 2mob h ILE 52 Cb 0.76 0.02 0.00 0.00 -3.07 0.00 0.00 36.82 34.53 2mob h ILE 52 CO 0.00 0.05 -0.19 -0.08 -0.69 0.00 0.00 178.15 177.24 2mob h GLU 53 N 0.26 -0.51 0.00 2.37 4.81 -1.32 3.00 114.58 123.18 2mob h GLU 53 Ca 0.73 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.99 2mob h GLU 53 Cb 1.95 0.12 0.00 0.00 0.63 0.00 0.00 28.75 31.44 2mob h GLU 53 CO -0.45 -0.34 0.00 -0.25 -0.73 0.00 0.00 179.01 177.24 2mob n ASP 54 N -4.25 0.05 -0.07 1.04 8.00 -0.26 -1.56 116.55 119.50 2mob n ASP 54 Ca -0.07 0.51 -0.09 0.00 0.71 0.00 0.00 54.79 55.85 2mob n ASP 54 Cb 0.21 -0.52 -0.09 0.00 -0.02 0.00 0.00 41.12 40.70 2mob n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2mob n ILE 55 N -1.55 0.90 -0.02 0.53 0.13 1.55 -4.61 119.36 116.29 2mob n ILE 55 Ca 0.06 -0.44 -0.03 0.00 -1.10 0.00 0.00 62.75 61.24 2mob n ILE 55 Cb 0.28 -0.89 -0.01 0.00 -0.84 0.00 0.00 39.64 38.18 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 -2.74 0.17 -0.31 9.51 0.31 0.73 -3.61 118.33 122.39 2mob n VAL 56 Ca -0.25 -0.06 0.02 0.00 -0.01 0.00 0.00 64.34 64.04 2mob n VAL 56 Cb 0.85 -0.99 0.16 0.00 -0.91 0.00 0.00 33.84 32.95 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 0.82 0.10 7.52 6.46 0.53 2.31 115.31 133.00 2mob h LEU 57 Ca -0.07 0.03 -0.29 0.00 -0.12 0.00 0.00 57.88 57.42 2mob h LEU 57 Cb 1.09 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.86 2mob h LEU 57 CO -0.03 0.51 -1.53 0.50 -0.62 0.00 0.00 178.44 177.28 2mob h LYS 58 N 0.95 0.20 0.14 1.25 3.64 -1.61 -3.26 116.57 117.89 2mob h LYS 58 Ca 0.39 -0.35 -0.33 0.00 -1.27 0.00 0.00 60.65 59.10 2mob h LYS 58 Cb 0.23 0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.18 2mob h LYS 58 CO -0.20 1.17 -1.70 0.78 -2.27 0.00 0.00 179.45 177.23 2mob h GLY 59 N 0.13 0.34 0.56 5.01 0.00 -1.63 -3.36 103.07 104.12 2mob h GLY 59 Ca -0.34 -0.88 -0.01 0.00 0.00 0.00 0.00 47.33 46.10 2mob h GLY 59 CO 0.02 0.77 -0.12 -1.33 0.00 0.00 0.00 176.54 175.87 2mob h GLY 60 N 0.54 -0.35 0.11 4.60 0.00 0.37 -3.08 103.07 105.27 2mob h GLY 60 Ca -0.36 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.10 2mob h GLY 60 CO 0.10 -0.13 0.00 1.17 0.00 0.00 0.00 176.54 177.68 2mob n LYS 61 N -5.05 0.03 0.09 4.80 4.81 0.15 -3.32 118.16 119.66 2mob n LYS 61 Ca -0.09 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.31 2mob n LYS 61 Cb 0.26 -1.06 -0.02 0.00 0.02 0.00 0.00 35.03 34.23 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 1.18 -0.95 0.00 3.14 0.00 -1.69 -3.21 119.26 117.73 2mob h ALA 62 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2mob h ALA 62 Cb 0.00 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2mob h ALA 62 CO 0.00 -0.94 -0.99 1.63 0.00 0.00 0.00 179.25 178.94 2mob n LYS 63 N -2.92 0.58 -2.13 0.00 4.76 -1.25 -4.84 118.16 112.36 2mob n LYS 63 Ca -0.03 0.11 -0.42 0.00 -2.87 0.00 0.00 58.31 55.10 2mob n LYS 63 Cb 0.11 -1.81 -0.03 0.00 -1.84 0.00 0.00 35.03 31.47 2mob n LYS 63 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2mob s ASN 64 N -5.24 6.76 0.22 4.39 0.01 -1.21 -4.90 114.94 114.97 2mob s ASN 64 Ca -0.00 2.10 -0.06 0.00 -0.71 0.00 0.00 52.86 54.19 2mob s ASN 64 Cb 0.10 -2.54 0.20 0.00 0.41 0.00 0.00 41.25 39.42 2mob s ASN 64 CO 0.79 -0.85 1.76 1.55 -1.51 0.00 0.00 177.10 178.83 2mob h PRO 65 N 8.90 1.08 -0.12 -0.60 0.13 -1.86 -3.41 132.00 136.11 2mob h PRO 65 Ca -0.36 -0.24 0.28 0.00 -0.87 0.00 0.00 66.00 64.81 2mob h PRO 65 Cb 1.16 -0.15 -0.22 0.00 0.13 0.00 0.00 31.00 31.92 2mob h PRO 65 CO 0.95 0.94 0.29 -1.12 -0.23 0.00 0.00 178.00 178.83 2mob s SER 66 N -6.47 -0.15 0.01 1.44 0.01 -1.26 -5.10 113.70 102.18 2mob s SER 66 Ca -0.12 0.11 0.01 0.00 1.31 0.00 0.00 55.95 57.27 2mob s SER 66 Cb 0.15 1.13 -0.04 0.00 0.21 0.00 0.00 66.02 67.48 2mob s SER 66 CO 0.84 -0.03 0.02 -0.63 0.41 0.00 0.00 173.24 173.85 2mob s ILE 67 N 2.88 4.29 -0.04 1.44 1.09 -1.26 -4.14 121.20 125.46 2mob s ILE 67 Ca -0.07 -0.59 -0.00 0.00 -1.10 0.00 0.00 60.65 58.88 2mob s ILE 67 Cb -0.08 -2.94 -0.03 0.00 -1.06 0.00 0.00 42.46 38.35 2mob s ILE 67 CO -0.09 0.34 0.01 0.54 -0.10 0.00 0.00 174.94 175.64 2mob s VAL 68 N -1.14 4.29 -0.38 2.92 0.11 -0.80 -4.95 120.40 120.45 2mob s VAL 68 Ca 0.21 -0.42 -0.01 0.00 -2.93 0.00 0.00 61.98 58.83 2mob s VAL 68 Cb -0.12 -2.87 0.10 0.00 -1.53 0.00 0.00 36.38 31.97 2mob s VAL 68 CO 0.12 0.48 0.15 -0.69 -3.33 0.00 0.00 175.10 171.83 2mob s VAL 69 N -1.01 2.96 -0.15 2.04 1.01 -1.26 -0.04 120.40 123.96 2mob s VAL 69 Ca 0.17 -2.12 -0.26 0.00 0.00 0.00 0.00 61.98 59.77 2mob s VAL 69 Cb -0.11 -3.06 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 2mob s VAL 69 CO 0.07 -0.64 0.86 -1.61 0.00 0.00 0.00 175.10 173.78 2mob s GLU 70 N 1.07 4.33 -0.31 2.72 0.41 0.89 -4.93 118.70 122.88 2mob s GLU 70 Ca 0.09 1.09 0.02 0.00 -0.41 0.00 0.00 54.97 55.76 2mob s GLU 70 Cb -0.22 -3.56 0.09 0.00 -1.78 0.00 0.00 34.13 28.67 2mob s GLU 70 CO -0.05 -0.30 0.03 0.34 -0.49 0.00 0.00 175.26 174.79 2mob s ASP 71 N 1.12 4.46 -0.03 -0.19 2.15 -1.26 -0.48 116.67 122.44 2mob s ASP 71 Ca 0.40 -1.83 -0.01 0.00 0.43 0.00 0.00 52.55 51.54 2mob s ASP 71 Cb -0.17 -1.40 -0.04 0.00 -0.30 0.00 0.00 42.92 41.01 2mob s ASP 71 CO 0.14 -0.35 0.08 -0.54 -0.17 0.00 0.00 175.17 174.34 2mob s LYS 72 N 1.14 3.12 -0.85 4.34 -0.14 -0.76 -4.97 119.74 121.61 2mob s LYS 72 Ca 0.06 -0.43 -0.22 0.00 -1.36 0.00 0.00 55.97 54.03 2mob s LYS 72 Cb -0.19 -2.90 -0.19 0.00 -1.68 0.00 0.00 37.83 32.88 2mob s LYS 72 CO -0.11 0.67 2.05 0.00 -0.76 0.00 0.00 175.35 177.20 2mob n ALA 73 N 1.37 0.34 0.00 5.17 0.00 -1.26 0.07 120.51 126.20 2mob n ALA 73 Ca -0.14 -1.72 0.00 0.00 0.00 0.00 0.00 53.44 51.58 2mob n ALA 73 Cb 0.53 -2.87 0.00 0.00 0.00 0.00 0.00 19.45 17.11 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 6.06 1.28 3.40 0.00 0.00 -1.26 -5.11 105.19 109.55 2mob n GLY 74 Ca 0.39 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.21 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 -0.55 1.90 -0.47 1.61 0.08 0.11 -3.46 117.98 117.20 2mob s PHE 75 Ca 0.00 -0.57 0.04 0.00 0.12 0.00 0.00 56.93 56.52 2mob s PHE 75 Cb 0.00 -0.94 0.17 0.00 -0.57 0.00 0.00 43.02 41.68 2mob s PHE 75 CO 0.00 0.40 0.38 1.87 -0.10 0.00 0.00 175.22 177.77 2mob n TRP 76 N -0.49 -0.05 -3.78 0.36 -0.00 0.12 -1.84 117.44 111.76 2mob n TRP 76 Ca -0.07 -3.52 -0.37 0.00 -0.00 0.00 0.00 57.50 53.55 2mob n TRP 76 Cb 0.61 0.06 -0.06 0.00 -0.00 0.00 0.00 31.31 31.92 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 -0.32 3.58 -0.00 5.87 0.52 0.37 -0.81 118.94 128.14 2mob s TRP 77 Ca 0.32 0.57 0.01 0.00 0.02 0.00 0.00 56.10 57.01 2mob s TRP 77 Cb 0.03 -2.05 0.00 0.00 -1.15 0.00 0.00 33.47 30.30 2mob s TRP 77 CO -0.19 0.62 -0.02 0.42 0.02 0.00 0.00 176.95 177.80 2mob s ILE 78 N -0.71 0.17 0.29 2.03 1.01 0.88 0.30 121.20 125.17 2mob s ILE 78 Ca 0.15 -0.08 0.08 0.00 0.00 0.00 0.00 60.65 60.81 2mob s ILE 78 Cb -0.13 -0.16 -0.04 0.00 0.01 0.00 0.00 42.46 42.15 2mob s ILE 78 CO 0.04 0.06 0.16 -1.59 0.00 0.00 0.00 174.94 173.61 2mob s LYS 79 N 0.04 2.60 -0.16 2.79 -2.85 0.95 0.14 119.74 123.25 2mob s LYS 79 Ca -0.00 -1.31 -0.16 0.00 -1.00 0.00 0.00 55.97 53.50 2mob s LYS 79 Cb -0.02 -2.36 0.04 0.00 -2.06 0.00 0.00 37.83 33.44 2mob s LYS 79 CO -0.00 0.26 0.44 0.00 0.10 0.00 0.00 175.35 176.15 2mob s ALA 80 N -2.29 -1.09 -0.55 0.59 0.00 -0.79 -1.90 121.76 115.73 2mob s ALA 80 Ca 0.35 1.21 -0.03 0.00 0.00 0.00 0.00 51.96 53.49 2mob s ALA 80 Cb -0.06 -0.68 0.13 0.00 0.00 0.00 0.00 23.12 22.52 2mob s ALA 80 CO 0.24 -0.21 2.59 -0.25 0.00 0.00 0.00 175.76 178.12 2mob n ASP 81 N 2.73 6.73 0.00 0.00 9.92 -1.26 -1.98 116.55 132.69 2mob n ASP 81 Ca -0.14 -3.36 0.00 0.00 -0.53 0.00 0.00 54.79 50.76 2mob n ASP 81 Cb 0.57 -1.19 0.00 0.00 -0.64 0.00 0.00 41.12 39.86 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 0.53 2.16 3.89 0.44 0.00 -1.26 -4.76 105.19 106.19 2mob n GLY 82 Ca 0.50 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.23 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 3.03 0.13 4.61 0.00 -1.26 -4.48 121.76 122.79 2mob s ALA 83 Ca 0.00 -0.35 -0.13 0.00 0.00 0.00 0.00 51.96 51.49 2mob s ALA 83 Cb 0.00 -2.95 0.01 0.00 0.00 0.00 0.00 23.12 20.18 2mob s ALA 83 CO 0.00 -0.94 0.34 -1.50 0.00 0.00 0.00 175.76 173.65 2mob s ILE 84 N -3.23 0.08 0.12 0.00 1.10 -1.04 -4.95 121.20 113.28 2mob s ILE 84 Ca 0.56 -0.95 -0.01 0.00 -0.51 0.00 0.00 60.65 59.74 2mob s ILE 84 Cb -0.11 -1.42 -0.04 0.00 0.15 0.00 0.00 42.46 41.04 2mob s ILE 84 CO 0.51 -0.37 0.05 -1.61 -2.11 0.00 0.00 174.94 171.41 2mob s GLU 85 N -3.87 0.90 0.29 3.50 2.02 -1.26 -0.64 118.70 119.63 2mob s GLU 85 Ca 0.07 -1.41 0.07 0.00 0.02 0.00 0.00 54.97 53.72 2mob s GLU 85 Cb 0.03 0.24 -0.06 0.00 0.10 0.00 0.00 34.13 34.44 2mob s GLU 85 CO -0.08 -0.25 -0.05 0.42 0.02 0.00 0.00 175.26 175.32 2mob s ILE 86 N -4.03 1.64 0.05 -1.63 -1.09 -1.07 -4.88 121.20 110.18 2mob s ILE 86 Ca 0.22 -2.12 -0.13 0.00 -2.23 0.00 0.00 60.65 56.39 2mob s ILE 86 Cb 0.07 -2.49 0.02 0.00 -1.58 0.00 0.00 42.46 38.48 2mob s ILE 86 CO 0.00 -0.27 0.29 -1.81 -1.23 0.00 0.00 174.94 171.92 2mob s ASP 87 N -3.46 -0.09 0.00 3.58 1.11 -1.26 -0.93 116.67 115.62 2mob s ASP 87 Ca 0.30 -0.24 0.00 0.00 0.18 0.00 0.00 52.55 52.79 2mob s ASP 87 Cb 0.04 0.35 0.00 0.00 1.07 0.00 0.00 42.92 44.38 2mob s ASP 87 CO 0.12 -0.62 0.00 0.00 1.18 0.00 0.00 175.17 175.85 2mob n ALA 88 N 0.54 0.16 -0.33 5.23 0.00 -1.26 -4.83 120.51 120.02 2mob n ALA 88 Ca -0.18 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.39 2mob n ALA 88 Cb 0.60 0.00 0.27 0.00 0.00 0.00 0.00 19.45 20.32 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 1.13 -0.16 0.00 0.00 -1.89 0.13 119.26 118.48 2mob h ALA 89 Ca 0.00 0.32 0.04 0.00 0.00 0.00 0.00 54.91 55.27 2mob h ALA 89 Cb 0.00 0.55 -0.07 0.00 0.00 0.00 0.00 17.79 18.27 2mob h ALA 89 CO 0.00 -0.55 -0.45 1.49 0.00 0.00 0.00 179.25 179.74 2mob h GLU 90 N 0.04 -0.48 -1.43 0.00 4.81 -1.94 0.45 114.58 116.03 2mob h GLU 90 Ca 0.57 0.03 0.42 0.00 -0.13 0.00 0.00 59.36 60.25 2mob h GLU 90 Cb 1.16 0.11 -0.06 0.00 0.63 0.00 0.00 28.75 30.59 2mob h GLU 90 CO -0.87 -0.32 1.03 0.00 -0.73 0.00 0.00 179.01 178.12 2mob h ALA 91 N 0.05 3.33 -0.24 2.92 0.00 -1.04 1.10 119.26 125.38 2mob h ALA 91 Ca 0.07 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 2mob h ALA 91 Cb 0.64 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.53 2mob h ALA 91 CO -0.43 -1.75 -0.54 0.78 0.00 0.00 0.00 179.25 177.32 2mob h GLY 92 N 0.01 0.77 2.00 0.00 0.00 0.08 -0.56 103.07 105.36 2mob h GLY 92 Ca 0.69 -0.89 -0.00 0.00 0.00 0.00 0.00 47.33 47.13 2mob h GLY 92 CO -0.03 0.80 -0.00 0.83 0.00 0.00 0.00 176.54 178.14 2mob h GLU 93 N 0.54 0.00 0.00 4.80 5.08 0.17 2.44 114.58 127.61 2mob h GLU 93 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 2mob h GLU 93 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2mob h GLU 93 CO 0.11 0.00 -0.06 1.25 -1.00 0.00 0.00 179.01 179.32 2mob h LEU 94 N 0.00 0.00 0.00 1.33 6.46 -0.71 -3.42 115.31 118.97 2mob h LEU 94 Ca -0.00 0.00 -0.12 0.00 -0.12 0.00 0.00 57.88 57.64 2mob h LEU 94 Cb 0.24 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.15 2mob h LEU 94 CO 0.00 0.15 -2.08 0.00 -0.62 0.00 0.00 178.44 175.88 2mob n LEU 95 N -2.74 0.00 -3.49 2.25 -0.00 -0.30 -5.01 117.00 107.71 2mob n LEU 95 Ca -0.01 0.00 -0.20 0.00 -0.00 0.00 0.00 56.01 55.80 2mob n LEU 95 Cb 0.03 0.16 0.09 0.00 -0.00 0.00 0.00 43.42 43.69 2mob n LEU 95 CO 0.01 0.16 0.17 0.61 -0.00 0.00 0.00 177.39 178.34 2mob n GLY 96 N 1.47 -0.44 0.00 1.47 0.00 0.82 -4.98 105.19 103.54 2mob n GLY 96 Ca -0.13 0.17 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 0.28 0.00 0.00 0.00 173.32 173.60 2mob n LYS 97 N -4.49 0.00 0.00 1.61 5.02 -1.26 -4.94 118.16 114.10 2mob n LYS 97 Ca -0.16 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.22 2mob n LYS 97 Cb 0.62 0.00 0.46 0.00 -0.02 0.00 0.00 35.03 36.09 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 0.30 -0.07 1.97 -0.04 -1.26 -4.03 135.00 131.86 2mob n PRO 98 Ca 0.00 0.10 0.05 0.00 -0.04 0.00 0.00 63.50 63.62 2mob n PRO 98 Cb 0.00 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.06 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 -1.25 0.20 0.21 0.54 1.16 -1.26 0.16 117.46 117.23 2mob n PHE 99 Ca 0.09 0.25 -0.15 0.00 -1.87 0.00 0.00 57.45 55.77 2mob n PHE 99 Cb 0.13 -0.70 -0.07 0.00 -1.61 0.00 0.00 39.48 37.23 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 -0.66 0.05 5.98 0.87 -1.74 -1.83 113.55 116.21 2mob h SER 100 Ca 0.16 0.05 -0.36 0.00 -1.23 0.00 0.00 61.79 60.41 2mob h SER 100 Cb 0.38 0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.51 2mob h SER 100 CO -0.17 -0.39 -2.04 0.52 -0.53 0.00 0.00 176.83 174.21 2mob n VAL 101 N -5.38 1.62 -0.33 2.23 0.31 0.43 -2.77 118.33 114.44 2mob n VAL 101 Ca -0.10 -0.45 0.08 0.00 -0.01 0.00 0.00 64.34 63.86 2mob n VAL 101 Cb 0.29 -1.75 0.25 0.00 -0.91 0.00 0.00 33.84 31.71 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 -0.36 0.97 -0.32 3.52 5.03 -0.57 2.06 116.97 127.30 2mob h TYR 102 Ca -0.49 0.03 -0.10 0.00 2.58 0.00 0.00 58.73 60.75 2mob h TYR 102 Cb 1.77 -0.29 -0.01 0.00 1.55 0.00 0.00 36.73 39.75 2mob h TYR 102 CO 0.04 0.30 -0.17 0.22 -1.32 0.00 0.00 178.16 177.23 2mob h ASP 103 N 0.80 0.71 -0.04 -2.11 1.82 -1.47 -2.71 116.42 113.42 2mob h ASP 103 Ca 0.49 -0.41 -0.25 0.00 -0.39 0.00 0.00 57.03 56.47 2mob h ASP 103 Cb 0.62 -0.20 0.02 0.00 0.68 0.00 0.00 39.33 40.46 2mob h ASP 103 CO -0.32 0.97 -0.94 0.17 -1.61 0.00 0.00 179.24 177.50 2mob h LEU 104 N 0.45 0.90 -1.92 2.28 8.10 -0.84 -2.42 115.31 121.86 2mob h LEU 104 Ca 0.07 -0.71 0.00 0.00 0.11 0.00 0.00 57.88 57.35 2mob h LEU 104 Cb 0.71 -0.27 -0.00 0.00 -0.44 0.00 0.00 40.66 40.65 2mob h LEU 104 CO 0.05 1.48 0.36 -0.07 -4.11 0.00 0.00 178.44 176.15 2mob h LEU 105 N 0.39 0.00 0.05 0.17 3.38 0.33 2.93 115.31 122.56 2mob h LEU 105 Ca -0.11 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.54 2mob h LEU 105 Cb 1.59 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.31 2mob h LEU 105 CO 0.19 0.00 -1.82 -0.38 0.09 0.00 0.00 178.44 176.51 2mob n ILE 106 N -2.87 1.63 0.28 1.22 5.41 -1.03 -4.62 119.36 119.38 2mob n ILE 106 Ca -0.02 -0.38 0.03 0.00 1.00 0.00 0.00 62.75 63.38 2mob n ILE 106 Cb 0.40 -1.84 -0.02 0.00 -0.71 0.00 0.00 39.64 37.48 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 -3.91 0.58 0.26 4.38 6.94 -0.57 -4.52 115.26 118.42 2mob n ASN 107 Ca -0.36 -0.79 0.17 0.00 -0.02 0.00 0.00 54.58 53.58 2mob n ASN 107 Cb 0.89 0.76 0.91 0.00 -2.36 0.00 0.00 39.78 39.97 2mob n ASN 107 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 2mob h VAL 108 N 0.31 0.00 -0.55 3.53 3.04 0.52 -3.01 116.25 120.09 2mob h VAL 108 Ca 0.00 -0.03 0.16 0.00 -1.01 0.00 0.00 66.70 65.82 2mob h VAL 108 Cb 0.17 0.81 -0.02 0.00 -2.01 0.00 0.00 31.29 30.24 2mob h VAL 108 CO 0.00 0.00 1.11 -0.24 -1.01 0.00 0.00 177.57 177.43 2mob n SER 109 N -2.71 0.00 0.00 3.17 2.88 -1.26 0.11 113.62 115.82 2mob n SER 109 Ca -0.02 0.63 0.01 0.00 -1.33 0.00 0.00 58.87 58.16 2mob n SER 109 Cb 0.07 -0.14 0.03 0.00 -0.75 0.00 0.00 64.21 63.43 2mob n SER 109 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2mob n SER 110 N -2.88 0.00 0.03 -3.46 2.88 -1.14 -3.61 113.62 105.44 2mob n SER 110 Ca 0.12 -1.30 0.03 0.00 -1.33 0.00 0.00 58.87 56.40 2mob n SER 110 Cb 1.28 0.00 0.14 0.00 -0.75 0.00 0.00 64.21 64.88 2mob n SER 110 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 2mob n THR 111 N -0.52 1.70 0.00 2.46 5.66 0.30 -4.32 114.28 119.56 2mob n THR 111 Ca 0.01 0.50 0.00 0.00 -3.05 0.00 0.00 64.05 61.51 2mob n THR 111 Cb 0.00 -1.46 0.00 0.00 -1.55 0.00 0.00 70.33 67.32 2mob n THR 111 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 2mob n VAL 112 N -1.64 0.00 0.00 1.08 0.31 -1.24 -2.40 118.33 114.45 2mob n VAL 112 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2mob n VAL 112 Cb 0.03 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.96 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 0.00 2.98 2.92 0.00 -1.26 -5.14 105.19 104.69 2mob n GLY 113 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.24 0.32 -0.36 1.61 3.52 -1.01 -5.08 118.95 117.71 2mob s ARG 114 Ca 0.00 -0.52 0.05 0.00 -0.13 0.00 0.00 55.73 55.14 2mob s ARG 114 Cb 0.00 -0.04 0.17 0.00 -1.56 0.00 0.00 34.95 33.53 2mob s ARG 114 CO 0.00 -0.01 0.52 0.00 -0.81 0.00 0.00 175.30 175.01 2mob s ALA 115 N -1.12 -1.71 -0.12 6.12 0.00 -1.24 -3.99 121.76 119.69 2mob s ALA 115 Ca -0.11 0.08 -0.29 0.00 0.00 0.00 0.00 51.96 51.64 2mob s ALA 115 Cb -0.08 -2.43 -0.04 0.00 0.00 0.00 0.00 23.12 20.58 2mob s ALA 115 CO -0.00 -2.05 1.54 -0.47 0.00 0.00 0.00 175.76 174.78 2mob s TYR 116 N 2.04 2.23 -0.28 0.00 6.14 0.64 -4.50 117.35 123.62 2mob s TYR 116 Ca 0.14 0.48 -0.29 0.00 0.64 0.00 0.00 57.07 58.04 2mob s TYR 116 Cb -0.09 -3.82 0.01 0.00 0.42 0.00 0.00 41.96 38.48 2mob s TYR 116 CO -0.14 -3.09 1.08 0.99 0.64 0.00 0.00 175.55 175.04 2mob s THR 117 N 4.15 4.54 0.00 4.34 2.01 -1.26 0.23 115.64 129.65 2mob s THR 117 Ca 0.68 1.81 -0.06 0.00 0.31 0.00 0.00 61.69 64.43 2mob s THR 117 Cb -0.28 -4.35 -0.25 0.00 0.01 0.00 0.00 72.50 67.63 2mob s THR 117 CO 0.26 -0.36 3.47 -0.11 -0.69 0.00 0.00 174.62 177.19 2mob n LEU 118 N 6.70 5.08 0.00 4.42 7.94 0.01 -4.76 117.00 136.40 2mob n LEU 118 Ca 0.12 -3.07 0.00 0.00 -1.11 0.00 0.00 56.01 51.95 2mob n LEU 118 Cb 0.47 -1.37 0.00 0.00 0.53 0.00 0.00 43.42 43.05 2mob n LEU 118 CO 0.57 1.61 0.00 0.61 -1.11 0.00 0.00 177.39 179.06 2mob n GLY 119 N 2.48 0.61 0.00 -3.96 0.00 -1.26 -2.49 105.19 100.56 2mob n GLY 119 Ca 0.40 -0.01 0.02 0.00 0.00 0.00 0.00 46.02 46.43 2mob n GLY 119 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2mob n THR 120 N 0.00 0.00 -3.19 2.61 -1.04 -1.26 -5.05 114.28 106.34 2mob n THR 120 Ca 0.00 -0.40 0.00 0.00 -2.04 0.00 0.00 64.05 61.61 2mob n THR 120 Cb 0.00 0.99 0.00 0.00 -1.82 0.00 0.00 70.33 69.50 2mob n THR 120 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2mob n LYS 121 N -1.11 3.42 -3.96 -2.82 4.81 -1.04 -4.10 118.16 113.36 2mob n LYS 121 Ca 0.01 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.35 2mob n LYS 121 Cb 0.07 0.00 -0.11 0.00 0.02 0.00 0.00 35.03 35.01 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 0.52 0.23 -0.17 5.64 5.36 -0.11 -0.81 117.98 128.64 2mob s PHE 122 Ca 0.00 -0.48 -0.04 0.00 -0.96 0.00 0.00 56.93 55.45 2mob s PHE 122 Cb 0.00 -0.17 0.06 0.00 -0.34 0.00 0.00 43.02 42.57 2mob s PHE 122 CO 0.00 -0.23 0.06 0.99 -1.46 0.00 0.00 175.22 174.58 2mob s THR 123 N -1.67 0.20 0.22 0.12 2.01 0.63 -2.61 115.64 114.55 2mob s THR 123 Ca -0.14 -0.29 0.09 0.00 0.31 0.00 0.00 61.69 61.66 2mob s THR 123 Cb -0.08 -0.75 -0.04 0.00 0.01 0.00 0.00 72.50 71.64 2mob s THR 123 CO -0.01 -0.20 -0.05 -0.63 -0.69 0.00 0.00 174.62 173.03 2mob s ILE 124 N 2.01 3.30 0.23 1.82 1.09 0.18 0.23 121.20 130.07 2mob s ILE 124 Ca 0.01 -1.80 -0.08 0.00 -1.10 0.00 0.00 60.65 57.68 2mob s ILE 124 Cb -0.16 -2.70 -0.02 0.00 -1.06 0.00 0.00 42.46 38.52 2mob s ILE 124 CO -0.08 -0.25 0.34 0.28 -0.10 0.00 0.00 174.94 175.13 2mob s THR 125 N -2.04 0.00 -0.08 2.92 -1.32 -1.26 -2.49 115.64 111.38 2mob s THR 125 Ca 0.28 -1.65 0.08 0.00 -1.21 0.00 0.00 61.69 59.19 2mob s THR 125 Cb -0.08 -2.33 -0.24 0.00 -1.51 0.00 0.00 72.50 68.34 2mob s THR 125 CO 0.18 0.00 0.51 -0.24 -2.21 0.00 0.00 174.62 172.86 2mob n SER 126 N -0.37 1.12 -1.23 8.08 2.88 -1.26 -4.06 113.62 118.78 2mob n SER 126 Ca -0.00 0.31 -0.05 0.00 -1.33 0.00 0.00 58.87 57.81 2mob n SER 126 Cb 0.64 -0.16 0.05 0.00 -0.75 0.00 0.00 64.21 63.98 2mob n SER 126 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2mob n GLU 127 N -3.13 1.36 0.00 -1.46 1.02 -1.26 -4.86 120.64 112.32 2mob n GLU 127 Ca -0.23 -0.70 0.00 0.00 -0.02 0.00 0.00 57.16 56.22 2mob n GLU 127 Cb 1.06 -1.32 0.00 0.00 -0.02 0.00 0.00 31.44 31.16 2mob n GLU 127 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78