#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 -4.55 4.04 4.13 -1.26 -4.93 115.26 112.68 2mob n ASN 36 Ca 0.00 0.00 -0.64 0.00 1.68 0.00 0.00 54.58 55.62 2mob n ASN 36 Cb 0.00 -0.16 -0.11 0.00 -1.54 0.00 0.00 39.78 37.97 2mob n ASN 36 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2mob n ALA 37 N 0.13 -0.69 -2.44 5.41 0.00 -1.26 -4.40 120.51 117.27 2mob n ALA 37 Ca 0.00 0.37 -0.27 0.00 0.00 0.00 0.00 53.44 53.54 2mob n ALA 37 Cb 0.00 -2.00 -0.13 0.00 0.00 0.00 0.00 19.45 17.32 2mob n ALA 37 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2mob s VAL 38 N 4.22 2.04 -0.02 0.00 1.01 -0.92 -4.95 120.40 121.78 2mob s VAL 38 Ca 1.11 -1.61 0.05 0.00 0.00 0.00 0.00 61.98 61.52 2mob s VAL 38 Cb -1.48 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 33.08 2mob s VAL 38 CO 0.75 0.09 -0.15 0.54 0.00 0.00 0.00 175.10 176.32 2mob s VAL 39 N -1.04 1.24 -0.12 2.92 0.11 -1.26 -1.08 120.40 121.16 2mob s VAL 39 Ca 0.11 -0.66 0.02 0.00 -2.93 0.00 0.00 61.98 58.52 2mob s VAL 39 Cb -0.10 -1.04 -0.00 0.00 -1.53 0.00 0.00 36.38 33.71 2mob s VAL 39 CO 0.05 0.35 -0.18 -0.22 -3.33 0.00 0.00 175.10 171.77 2mob s LEU 40 N -0.28 2.38 0.08 2.54 2.96 0.49 -4.45 118.68 122.41 2mob s LEU 40 Ca 0.04 -0.47 0.05 0.00 -0.22 0.00 0.00 54.13 53.54 2mob s LEU 40 Cb -0.07 -1.51 -0.03 0.00 0.50 0.00 0.00 46.19 45.08 2mob s LEU 40 CO -0.00 0.14 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.34 2mob s VAL 41 N 0.48 1.16 0.31 1.68 1.01 -1.26 0.22 120.40 124.00 2mob s VAL 41 Ca -0.13 -1.39 0.02 0.00 0.00 0.00 0.00 61.98 60.48 2mob s VAL 41 Cb -0.17 -1.17 -0.02 0.00 0.00 0.00 0.00 36.38 35.02 2mob s VAL 41 CO 0.05 -0.26 0.32 -0.22 0.00 0.00 0.00 175.10 174.99 2mob s LEU 42 N -1.89 1.34 -0.42 3.92 2.96 0.23 -3.87 118.68 120.97 2mob s LEU 42 Ca 0.00 -1.57 0.05 0.00 -0.22 0.00 0.00 54.13 52.39 2mob s LEU 42 Cb -0.09 0.87 0.49 0.00 0.50 0.00 0.00 46.19 47.96 2mob s LEU 42 CO 0.02 -1.10 1.58 1.15 -1.32 0.00 0.00 176.35 176.68 2mob n MET 43 N -0.53 2.71 0.00 1.98 0.00 -1.26 0.14 117.12 120.17 2mob n MET 43 Ca 0.04 -3.54 0.00 0.00 0.00 0.00 0.00 57.70 54.20 2mob n MET 43 Cb 0.63 -2.14 0.00 0.00 0.00 0.00 0.00 33.22 31.71 2mob n MET 43 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2mob n LYS 44 N -0.93 0.00 -2.21 3.17 4.76 -1.23 -4.00 118.16 117.72 2mob n LYS 44 Ca 0.48 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.91 2mob n LYS 44 Cb 0.95 -0.25 -0.01 0.00 -1.84 0.00 0.00 35.03 33.88 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 -0.81 -4.24 0.00 4.39 2.88 -1.26 -3.84 113.62 110.74 2mob n SER 45 Ca 0.00 0.85 0.00 0.00 -1.33 0.00 0.00 58.87 58.39 2mob n SER 45 Cb 0.00 -3.62 0.00 0.00 -0.75 0.00 0.00 64.21 59.84 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 0.61 0.00 0.00 -3.46 2.03 -1.26 -4.65 116.55 109.82 2mob n ASP 46 Ca -0.08 0.00 0.12 0.00 0.52 0.00 0.00 54.79 55.35 2mob n ASP 46 Cb 0.12 0.00 0.17 0.00 -0.72 0.00 0.00 41.12 40.69 2mob n ASP 46 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2mob n GLU 47 N 0.00 0.02 0.27 -0.67 1.02 -1.26 -4.45 120.64 115.57 2mob n GLU 47 Ca 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.04 2mob n GLU 47 Cb 0.00 -1.51 -0.05 0.00 -0.02 0.00 0.00 31.44 29.86 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 0.00 0.00 -1.28 -3.67 -2.65 -1.96 1.38 117.51 109.33 2mob h ILE 48 Ca 0.00 -0.02 0.44 0.00 1.03 0.00 0.00 64.86 66.32 2mob h ILE 48 Cb 0.51 0.00 -0.14 0.00 -2.05 0.00 0.00 36.82 35.14 2mob h ILE 48 CO 0.00 0.00 0.80 -0.78 0.03 0.00 0.00 178.15 178.20 2mob h ASP 49 N -0.71 0.25 0.06 2.16 1.82 -1.91 2.82 116.42 120.90 2mob h ASP 49 Ca -0.07 0.17 -0.00 0.00 -0.39 0.00 0.00 57.03 56.73 2mob h ASP 49 Cb 0.53 0.16 0.00 0.00 0.68 0.00 0.00 39.33 40.71 2mob h ASP 49 CO 0.12 -0.25 -0.03 0.00 -1.61 0.00 0.00 179.24 177.47 2mob h ALA 50 N 1.68 -0.08 0.00 -0.78 0.00 -1.61 -2.62 119.26 115.86 2mob h ALA 50 Ca 0.85 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 55.45 2mob h ALA 50 Cb 2.58 0.03 0.00 0.00 0.00 0.00 0.00 17.79 20.40 2mob h ALA 50 CO -0.51 -0.14 -0.00 -0.84 0.00 0.00 0.00 179.25 177.76 2mob h ILE 51 N -0.89 1.42 -1.01 0.00 3.07 0.55 -1.28 117.51 119.37 2mob h ILE 51 Ca -0.01 -1.24 0.35 0.00 1.55 0.00 0.00 64.86 65.51 2mob h ILE 51 Cb 0.63 2.27 -0.16 0.00 -0.27 0.00 0.00 36.82 39.29 2mob h ILE 51 CO 0.01 0.32 0.57 0.40 -1.05 0.00 0.00 178.15 178.41 2mob h ILE 52 N -0.53 0.21 0.44 0.16 1.08 0.47 4.95 117.51 124.28 2mob h ILE 52 Ca -0.00 -0.08 -0.02 0.00 -0.39 0.00 0.00 64.86 64.37 2mob h ILE 52 Cb 0.53 -0.04 0.00 0.00 -3.07 0.00 0.00 36.82 34.25 2mob h ILE 52 CO 0.00 0.04 -0.21 -0.08 -0.69 0.00 0.00 178.15 177.21 2mob h GLU 53 N 0.23 -0.57 0.00 2.37 4.81 -1.10 2.90 114.58 123.23 2mob h GLU 53 Ca 0.77 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 60.04 2mob h GLU 53 Cb 1.86 0.13 0.00 0.00 0.63 0.00 0.00 28.75 31.37 2mob h GLU 53 CO -0.64 -0.38 0.00 -3.47 -0.73 0.00 0.00 179.01 173.79 2mob n ASP 54 N -4.07 0.00 -0.08 1.04 -0.08 -0.12 -1.41 116.55 111.82 2mob n ASP 54 Ca -0.07 0.47 -0.09 0.00 -1.51 0.00 0.00 54.79 53.58 2mob n ASP 54 Cb 0.23 -0.49 -0.09 0.00 2.34 0.00 0.00 41.12 43.11 2mob n ASP 54 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2mob n ILE 55 N -1.49 0.96 -0.02 5.18 0.13 1.60 -4.41 119.36 121.32 2mob n ILE 55 Ca 0.07 -0.48 -0.04 0.00 -1.10 0.00 0.00 62.75 61.20 2mob n ILE 55 Cb 0.30 -0.88 -0.01 0.00 -0.84 0.00 0.00 39.64 38.21 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 -2.75 0.21 -0.33 9.51 0.31 0.76 -2.71 118.33 123.32 2mob n VAL 56 Ca -0.26 -0.06 0.05 0.00 -0.01 0.00 0.00 64.34 64.05 2mob n VAL 56 Cb 0.89 -1.21 0.24 0.00 -0.91 0.00 0.00 33.84 32.84 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 -0.09 0.92 0.00 7.52 6.46 0.53 2.28 115.31 132.93 2mob h LEU 57 Ca -0.09 0.02 -0.32 0.00 -0.12 0.00 0.00 57.88 57.37 2mob h LEU 57 Cb 1.10 -0.18 -0.05 0.00 -0.73 0.00 0.00 40.66 40.81 2mob h LEU 57 CO -0.04 0.56 -1.75 1.17 -0.62 0.00 0.00 178.44 177.76 2mob n LYS 58 N -4.52 0.58 0.09 1.25 4.81 -0.68 -3.38 118.16 116.30 2mob n LYS 58 Ca 0.16 0.46 -0.22 0.00 -0.87 0.00 0.00 58.31 57.83 2mob n LYS 58 Cb 0.25 -1.65 -0.15 0.00 0.02 0.00 0.00 35.03 33.50 2mob n LYS 58 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 2mob h GLY 59 N -0.94 0.46 0.53 3.14 0.00 -1.61 -3.22 103.07 101.43 2mob h GLY 59 Ca -0.48 -1.17 -0.01 0.00 0.00 0.00 0.00 47.33 45.67 2mob h GLY 59 CO -0.28 1.02 -0.11 -1.33 0.00 0.00 0.00 176.54 175.84 2mob h GLY 60 N -0.06 -0.31 -0.26 4.60 0.00 0.32 -3.03 103.07 104.33 2mob h GLY 60 Ca -0.22 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2mob h GLY 60 CO 0.20 -0.11 0.00 1.17 0.00 0.00 0.00 176.54 177.79 2mob n LYS 61 N -5.02 0.38 0.06 4.80 4.81 0.57 -3.52 118.16 120.23 2mob n LYS 61 Ca -0.09 0.00 -0.10 0.00 -0.87 0.00 0.00 58.31 57.26 2mob n LYS 61 Cb 0.26 -1.05 -0.06 0.00 0.02 0.00 0.00 35.03 34.20 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 1.66 -0.81 0.00 3.14 0.00 -1.53 -3.13 119.26 118.59 2mob h ALA 62 Ca 0.00 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 2mob h ALA 62 Cb 0.05 0.73 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2mob h ALA 62 CO 0.00 -0.90 -1.88 1.63 0.00 0.00 0.00 179.25 178.10 2mob n LYS 63 N -4.26 0.65 -2.17 0.00 5.02 -1.26 -4.90 118.16 111.24 2mob n LYS 63 Ca -0.05 -0.09 -0.42 0.00 -2.02 0.00 0.00 58.31 55.73 2mob n LYS 63 Cb 0.25 -1.58 -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 -4.89 6.82 0.14 4.39 0.02 -1.18 -4.93 114.94 115.31 2mob s ASN 64 Ca -0.07 2.29 -0.15 0.00 -1.02 0.00 0.00 52.86 53.91 2mob s ASN 64 Cb 0.12 -2.58 0.01 0.00 0.02 0.00 0.00 41.25 38.81 2mob s ASN 64 CO 0.87 -0.67 1.67 1.55 0.02 0.00 0.00 177.10 180.54 2mob h PRO 65 N 7.04 0.67 0.00 -0.60 0.13 -1.91 -3.40 132.00 133.94 2mob h PRO 65 Ca -0.41 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 2mob h PRO 65 Cb 1.20 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.23 2mob h PRO 65 CO 0.87 0.64 0.00 0.43 -0.23 0.00 0.00 178.00 179.71 2mob n SER 66 N -4.58 0.00 -4.87 1.44 7.64 -1.26 -5.04 113.62 106.95 2mob n SER 66 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 58.87 59.52 2mob n SER 66 Cb 0.17 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.31 2mob n SER 66 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2mob s ILE 67 N 0.00 5.35 0.12 0.44 1.09 -1.26 -4.60 121.20 122.33 2mob s ILE 67 Ca 0.00 0.36 -0.26 0.00 -1.10 0.00 0.00 60.65 59.65 2mob s ILE 67 Cb 0.00 -3.51 -0.07 0.00 -1.06 0.00 0.00 42.46 37.82 2mob s ILE 67 CO 0.00 0.56 0.82 -0.69 -0.10 0.00 0.00 174.94 175.53 2mob s VAL 68 N -1.09 4.50 -0.68 2.92 1.01 0.36 -4.88 120.40 122.55 2mob s VAL 68 Ca 0.20 1.78 0.05 0.00 0.00 0.00 0.00 61.98 64.00 2mob s VAL 68 Cb -0.13 -4.18 0.16 0.00 0.00 0.00 0.00 36.38 32.23 2mob s VAL 68 CO 0.09 0.43 0.46 -0.69 0.00 0.00 0.00 175.10 175.38 2mob s VAL 69 N -0.54 2.85 0.27 2.92 1.01 -1.26 0.36 120.40 126.01 2mob s VAL 69 Ca 0.39 -4.14 -0.29 0.00 0.00 0.00 0.00 61.98 57.95 2mob s VAL 69 Cb -0.22 -2.89 -0.09 0.00 0.00 0.00 0.00 36.38 33.17 2mob s VAL 69 CO 0.26 -0.97 0.97 -1.61 0.00 0.00 0.00 175.10 173.75 2mob s GLU 70 N -1.28 4.74 -0.10 2.72 0.41 0.74 -4.92 118.70 121.02 2mob s GLU 70 Ca 0.24 1.51 -0.04 0.00 -0.41 0.00 0.00 54.97 56.26 2mob s GLU 70 Cb -0.08 -3.14 0.05 0.00 -1.78 0.00 0.00 34.13 29.18 2mob s GLU 70 CO -0.14 0.40 0.22 -0.51 -0.49 0.00 0.00 175.26 174.74 2mob s ASP 71 N -1.24 -0.07 0.27 -0.19 1.11 -1.26 -0.36 116.67 114.93 2mob s ASP 71 Ca 0.44 0.47 -0.09 0.00 0.18 0.00 0.00 52.55 53.56 2mob s ASP 71 Cb -0.25 0.39 0.03 0.00 1.07 0.00 0.00 42.92 44.16 2mob s ASP 71 CO 0.32 -0.18 0.51 1.17 1.18 0.00 0.00 175.17 178.17 2mob n LYS 72 N 4.46 0.74 -0.45 8.23 4.81 -0.40 -4.97 118.16 130.59 2mob n LYS 72 Ca -0.21 -1.64 -0.09 0.00 -0.87 0.00 0.00 58.31 55.50 2mob n LYS 72 Cb 0.52 1.94 -0.06 0.00 0.02 0.00 0.00 35.03 37.45 2mob n LYS 72 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2mob n ALA 73 N -1.31 0.23 -4.38 3.14 0.00 -1.26 0.19 120.51 117.11 2mob n ALA 73 Ca -0.11 -0.17 -0.36 0.00 0.00 0.00 0.00 53.44 52.79 2mob n ALA 73 Cb 0.42 -0.70 -0.08 0.00 0.00 0.00 0.00 19.45 19.09 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 1.78 -0.29 2.53 0.00 0.00 -1.25 -4.88 105.19 103.09 2mob n GLY 74 Ca 0.20 0.12 -0.29 0.00 0.00 0.00 0.00 46.02 46.05 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 -3.74 1.02 -1.21 1.61 0.40 0.49 -3.49 117.98 113.07 2mob s PHE 75 Ca 0.45 -1.77 -0.18 0.00 -0.60 0.00 0.00 56.93 54.84 2mob s PHE 75 Cb -0.26 -1.17 0.10 0.00 0.51 0.00 0.00 43.02 42.20 2mob s PHE 75 CO 1.00 -0.82 1.58 -0.46 0.70 0.00 0.00 175.22 177.22 2mob s TRP 76 N 0.99 2.94 -0.08 0.36 -0.00 0.38 -1.27 118.94 122.26 2mob s TRP 76 Ca 0.17 -1.61 -0.20 0.00 -0.00 0.00 0.00 56.10 54.45 2mob s TRP 76 Cb -0.23 -4.61 -0.04 0.00 -0.00 0.00 0.00 33.47 28.59 2mob s TRP 76 CO -0.02 -1.71 0.57 -1.58 -0.00 0.00 0.00 176.95 174.21 2mob s TRP 77 N 3.60 3.57 0.07 5.86 0.52 0.51 0.77 118.94 133.83 2mob s TRP 77 Ca 0.49 1.07 0.03 0.00 0.02 0.00 0.00 56.10 57.70 2mob s TRP 77 Cb 0.01 -2.64 -0.03 0.00 -1.15 0.00 0.00 33.47 29.66 2mob s TRP 77 CO 0.02 0.19 -0.09 0.42 0.02 0.00 0.00 176.95 177.51 2mob s ILE 78 N 0.47 0.73 -0.06 2.03 -1.09 0.61 0.26 121.20 124.15 2mob s ILE 78 Ca 0.31 -1.39 -0.04 0.00 -2.23 0.00 0.00 60.65 57.29 2mob s ILE 78 Cb -0.17 -1.03 0.02 0.00 -1.58 0.00 0.00 42.46 39.70 2mob s ILE 78 CO 0.14 -0.50 0.14 -0.75 -1.23 0.00 0.00 174.94 172.74 2mob s LYS 79 N -2.30 0.12 -0.00 2.79 2.20 0.16 0.18 119.74 122.89 2mob s LYS 79 Ca -0.01 0.27 0.01 0.00 -0.36 0.00 0.00 55.97 55.88 2mob s LYS 79 Cb -0.06 -0.04 -0.00 0.00 -1.51 0.00 0.00 37.83 36.22 2mob s LYS 79 CO -0.00 -0.09 -0.05 0.00 -0.36 0.00 0.00 175.35 174.85 2mob s ALA 80 N 0.57 0.39 -0.34 3.13 0.00 -0.24 0.14 121.76 125.41 2mob s ALA 80 Ca -0.04 -0.21 -0.05 0.00 0.00 0.00 0.00 51.96 51.65 2mob s ALA 80 Cb -0.06 -0.09 -0.12 0.00 0.00 0.00 0.00 23.12 22.85 2mob s ALA 80 CO -0.03 0.09 3.21 -3.47 0.00 0.00 0.00 175.76 175.56 2mob n ASP 81 N 2.93 6.07 0.00 0.00 -0.08 -1.26 -2.17 116.55 122.04 2mob n ASP 81 Ca -0.13 -2.79 0.00 0.00 -1.51 0.00 0.00 54.79 50.36 2mob n ASP 81 Cb 0.58 -1.36 0.00 0.00 2.34 0.00 0.00 41.12 42.69 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 1.93 2.10 3.83 0.27 0.00 -1.26 -4.84 105.19 107.21 2mob n GLY 82 Ca 0.48 -0.29 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 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 3.50 0.25 4.61 0.00 -1.26 -4.27 121.76 123.58 2mob s ALA 83 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 51.96 51.95 2mob s ALA 83 Cb 0.00 -2.66 -0.03 0.00 0.00 0.00 0.00 23.12 20.43 2mob s ALA 83 CO 0.00 0.40 0.25 -1.50 0.00 0.00 0.00 175.76 174.90 2mob s ILE 84 N -1.49 0.00 0.37 0.00 2.07 -0.42 -5.02 121.20 116.70 2mob s ILE 84 Ca 0.40 -1.88 0.04 0.00 -1.41 0.00 0.00 60.65 57.80 2mob s ILE 84 Cb -0.16 -2.47 -0.03 0.00 0.13 0.00 0.00 42.46 39.93 2mob s ILE 84 CO 0.20 0.00 0.14 -1.61 -1.91 0.00 0.00 174.94 171.76 2mob s GLU 85 N -3.87 1.81 0.03 3.50 2.02 -1.26 -1.67 118.70 119.25 2mob s GLU 85 Ca 0.36 -2.08 -0.28 0.00 0.02 0.00 0.00 54.97 53.00 2mob s GLU 85 Cb 0.04 -0.46 0.08 0.00 0.10 0.00 0.00 34.13 33.88 2mob s GLU 85 CO 0.16 -0.45 0.68 -1.50 0.02 0.00 0.00 175.26 174.17 2mob s ILE 86 N -3.32 0.00 0.32 -1.63 -1.16 -1.09 -4.79 121.20 109.53 2mob s ILE 86 Ca 0.29 0.00 0.06 0.00 -0.51 0.00 0.00 60.65 60.49 2mob s ILE 86 Cb 0.04 -1.00 -0.02 0.00 0.61 0.00 0.00 42.46 42.08 2mob s ILE 86 CO 0.16 0.00 0.22 0.47 -2.81 0.00 0.00 174.94 172.98 2mob n ASP 87 N 0.33 -0.07 0.00 4.50 8.00 -1.26 0.15 116.55 128.20 2mob n ASP 87 Ca -0.17 -2.97 0.00 0.00 0.71 0.00 0.00 54.79 52.36 2mob n ASP 87 Cb 0.60 1.33 0.00 0.00 -0.02 0.00 0.00 41.12 43.03 2mob n ASP 87 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2mob n ALA 88 N -1.04 0.48 -0.34 2.24 0.00 -1.26 -4.85 120.51 115.74 2mob n ALA 88 Ca -0.12 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.46 2mob n ALA 88 Cb 0.55 0.00 0.26 0.00 0.00 0.00 0.00 19.45 20.26 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 -0.50 0.46 0.07 0.00 0.00 -1.26 -0.54 120.51 118.74 2mob n ALA 89 Ca 0.00 1.04 -0.11 0.00 0.00 0.00 0.00 53.44 54.37 2mob n ALA 89 Cb 0.00 -0.74 -0.07 0.00 0.00 0.00 0.00 19.45 18.64 2mob n ALA 89 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 2mob h GLU 90 N 0.00 -0.48 -1.11 0.00 4.39 -1.93 -0.19 114.58 115.27 2mob h GLU 90 Ca 0.57 0.03 0.42 0.00 0.34 0.00 0.00 59.36 60.72 2mob h GLU 90 Cb 1.14 0.11 -0.15 0.00 -0.10 0.00 0.00 28.75 29.75 2mob h GLU 90 CO -0.92 -0.32 0.66 0.00 -1.16 0.00 0.00 179.01 177.27 2mob n ALA 91 N -2.78 1.12 -0.20 3.43 0.00 0.30 0.22 120.51 122.60 2mob n ALA 91 Ca -0.06 0.88 -0.08 0.00 0.00 0.00 0.00 53.44 54.19 2mob n ALA 91 Cb 0.28 -0.97 0.02 0.00 0.00 0.00 0.00 19.45 18.77 2mob n ALA 91 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2mob h GLY 92 N 0.00 0.94 2.00 0.00 0.00 -0.81 -0.77 103.07 104.43 2mob h GLY 92 Ca 0.81 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 47.57 2mob h GLY 92 CO -0.58 0.53 -0.00 0.83 0.00 0.00 0.00 176.54 177.32 2mob h GLU 93 N 0.79 0.00 0.01 4.80 5.08 0.30 1.97 114.58 127.52 2mob h GLU 93 Ca 0.18 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 2mob h GLU 93 Cb 0.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2mob h GLU 93 CO -0.00 0.00 -0.01 1.25 -1.00 0.00 0.00 179.01 179.25 2mob h LEU 94 N 0.00 -0.01 0.00 1.33 6.46 -0.63 -3.42 115.31 119.04 2mob h LEU 94 Ca -0.00 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.75 2mob h LEU 94 Cb 0.01 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 39.94 2mob h LEU 94 CO 0.00 0.46 -1.51 0.00 -0.62 0.00 0.00 178.44 176.77 2mob n LEU 95 N -4.69 0.00 -2.53 2.25 -0.00 -0.68 -5.08 117.00 106.28 2mob n LEU 95 Ca -0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 56.01 56.01 2mob n LEU 95 Cb 0.01 0.01 -0.00 0.00 -0.00 0.00 0.00 43.42 43.44 2mob n LEU 95 CO 0.01 0.01 -0.43 0.61 -0.00 0.00 0.00 177.39 177.59 2mob n GLY 96 N 1.90 -4.15 0.00 1.47 0.00 0.67 -5.03 105.19 100.04 2mob n GLY 96 Ca -0.03 0.41 0.00 0.00 0.00 0.00 0.00 46.02 46.40 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 0.64 0.00 0.00 1.61 4.81 -1.26 -4.93 118.16 119.02 2mob n LYS 97 Ca -0.02 0.00 0.06 0.00 -0.87 0.00 0.00 58.31 57.49 2mob n LYS 97 Cb 0.02 0.00 0.34 0.00 0.02 0.00 0.00 35.03 35.42 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 0.00 0.31 -0.02 1.64 -0.04 -1.26 -4.09 135.00 131.54 2mob n PRO 98 Ca 0.00 0.06 0.01 0.00 -0.04 0.00 0.00 63.50 63.53 2mob n PRO 98 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 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 -1.10 0.05 0.06 0.54 1.16 -1.26 0.17 117.46 117.08 2mob n PHE 99 Ca 0.08 0.08 -0.11 0.00 -1.87 0.00 0.00 57.45 55.63 2mob n PHE 99 Cb 0.06 -0.56 -0.05 0.00 -1.61 0.00 0.00 39.48 37.33 2mob n PHE 99 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 2mob h SER 100 N 0.00 -0.70 0.01 5.98 0.02 -1.76 -2.18 113.55 114.91 2mob h SER 100 Ca 0.04 0.10 -0.42 0.00 -0.84 0.00 0.00 61.79 60.67 2mob h SER 100 Cb 0.10 0.29 -0.06 0.00 0.14 0.00 0.00 62.40 62.87 2mob h SER 100 CO -0.06 -0.31 -2.37 0.52 -1.14 0.00 0.00 176.83 173.47 2mob n VAL 101 N -5.36 1.53 -0.14 2.27 0.31 0.44 -2.72 118.33 114.66 2mob n VAL 101 Ca -0.05 -0.41 0.27 0.00 -0.01 0.00 0.00 64.34 64.15 2mob n VAL 101 Cb 0.27 -1.78 0.72 0.00 -0.91 0.00 0.00 33.84 32.15 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 -0.70 0.00 0.14 3.52 5.03 -1.01 0.60 116.97 124.54 2mob h TYR 102 Ca -0.63 0.00 -0.20 0.00 2.58 0.00 0.00 58.73 60.49 2mob h TYR 102 Cb 1.67 0.00 0.02 0.00 1.55 0.00 0.00 36.73 39.97 2mob h TYR 102 CO -0.03 0.00 -0.90 0.22 -1.32 0.00 0.00 178.16 176.13 2mob h ASP 103 N 0.00 0.46 -0.49 -2.11 1.82 -1.55 -2.67 116.42 111.88 2mob h ASP 103 Ca 0.39 -0.94 0.01 0.00 -0.39 0.00 0.00 57.03 56.11 2mob h ASP 103 Cb 1.65 -0.15 -0.03 0.00 0.68 0.00 0.00 39.33 41.48 2mob h ASP 103 CO -0.00 1.43 0.32 0.17 -1.61 0.00 0.00 179.24 179.54 2mob h LEU 104 N -0.37 0.53 -1.79 2.28 8.10 -0.16 1.02 115.31 124.93 2mob h LEU 104 Ca -0.17 -0.01 -0.03 0.00 0.11 0.00 0.00 57.88 57.78 2mob h LEU 104 Cb 1.66 -0.12 -0.00 0.00 -0.44 0.00 0.00 40.66 41.75 2mob h LEU 104 CO 0.14 0.38 -0.15 -0.07 -4.11 0.00 0.00 178.44 174.63 2mob h LEU 105 N 0.64 0.00 0.00 0.17 3.38 -0.11 2.83 115.31 122.22 2mob h LEU 105 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2mob h LEU 105 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2mob h LEU 105 CO -0.06 0.15 -0.97 -0.38 0.09 0.00 0.00 178.44 177.28 2mob n ILE 106 N -3.96 0.08 -0.01 1.22 5.41 -0.51 -4.41 119.36 117.18 2mob n ILE 106 Ca -0.02 -0.14 -0.01 0.00 1.00 0.00 0.00 62.75 63.58 2mob n ILE 106 Cb 0.24 0.42 -0.01 0.00 -0.71 0.00 0.00 39.64 39.58 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 -1.76 4.21 0.00 4.38 0.23 0.34 -4.62 115.26 118.03 2mob n ASN 107 Ca 0.03 -0.00 0.02 0.00 -0.53 0.00 0.00 54.58 54.09 2mob n ASN 107 Cb 0.39 0.19 0.11 0.00 -2.08 0.00 0.00 39.78 38.39 2mob n ASN 107 CO 0.00 0.00 0.00 0.55 -0.93 0.00 0.00 177.26 176.88 2mob n VAL 108 N -2.35 0.84 -0.34 3.53 3.14 0.94 -3.74 118.33 120.35 2mob n VAL 108 Ca -0.02 0.21 0.31 0.00 -2.96 0.00 0.00 64.34 61.88 2mob n VAL 108 Cb 0.53 -1.14 0.48 0.00 -1.06 0.00 0.00 33.84 32.64 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 -1.24 0.00 -1.08 6.55 2.88 -1.26 0.17 113.62 119.64 2mob n SER 109 Ca 0.02 0.68 -0.02 0.00 -1.33 0.00 0.00 58.87 58.22 2mob n SER 109 Cb 0.03 -0.29 0.02 0.00 -0.75 0.00 0.00 64.21 63.23 2mob n SER 109 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2mob n SER 110 N -3.13 2.91 -2.05 -3.46 3.41 -1.25 -4.33 113.62 105.72 2mob n SER 110 Ca 0.26 -2.17 -0.19 0.00 -0.26 0.00 0.00 58.87 56.51 2mob n SER 110 Cb 1.39 -0.54 0.01 0.00 -0.26 0.00 0.00 64.21 64.81 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 0.29 2.92 -0.10 6.66 5.66 0.46 -4.44 114.28 125.73 2mob n THR 111 Ca 0.06 -1.99 -0.07 0.00 -3.05 0.00 0.00 64.05 59.00 2mob n THR 111 Cb 0.60 -1.43 0.01 0.00 -1.55 0.00 0.00 70.33 67.96 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 1.29 0.96 0.00 1.08 2.07 -1.84 -3.35 116.25 116.46 2mob h VAL 112 Ca 0.31 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.72 2mob h VAL 112 Cb 0.88 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 31.25 2mob h VAL 112 CO 0.77 0.06 0.00 0.61 0.02 0.00 0.00 177.57 179.03 2mob n GLY 113 N -1.21 0.31 2.53 2.17 0.00 -1.25 -5.06 105.19 102.68 2mob n GLY 113 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 2mob n GLY 113 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2mob n ARG 114 N -1.22 0.62 -2.70 1.61 0.63 -0.96 -4.82 116.66 109.82 2mob n ARG 114 Ca 0.00 -1.86 -0.05 0.00 -0.92 0.00 0.00 57.85 55.02 2mob n ARG 114 Cb 0.00 1.96 0.05 0.00 0.45 0.00 0.00 32.46 34.92 2mob n ARG 114 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2mob n ALA 115 N -1.31 -2.88 -1.76 5.13 0.00 -1.22 -3.55 120.51 114.92 2mob n ALA 115 Ca -0.11 -0.58 -0.40 0.00 0.00 0.00 0.00 53.44 52.36 2mob n ALA 115 Cb 0.42 -2.55 -0.04 0.00 0.00 0.00 0.00 19.45 17.28 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 0.56 3.42 -0.30 0.00 6.14 0.19 -4.65 117.35 122.72 2mob s TYR 116 Ca 0.27 1.63 -0.21 0.00 0.64 0.00 0.00 57.07 59.41 2mob s TYR 116 Cb 0.16 -3.36 -0.01 0.00 0.42 0.00 0.00 41.96 39.18 2mob s TYR 116 CO -0.12 -0.86 0.67 0.99 0.64 0.00 0.00 175.55 176.87 2mob s THR 117 N -1.21 4.90 -0.22 4.34 2.01 -1.26 0.16 115.64 124.36 2mob s THR 117 Ca 0.47 0.96 -0.01 0.00 0.31 0.00 0.00 61.69 63.43 2mob s THR 117 Cb -0.33 -4.03 0.15 0.00 0.01 0.00 0.00 72.50 68.30 2mob s THR 117 CO 0.42 -0.15 1.99 -0.11 -0.69 0.00 0.00 174.62 176.07 2mob n LEU 118 N 5.95 6.06 0.00 4.42 0.00 0.82 -4.87 117.00 129.38 2mob n LEU 118 Ca 0.00 -3.00 0.00 0.00 0.00 0.00 0.00 56.01 53.01 2mob n LEU 118 Cb 0.49 -1.06 0.00 0.00 0.00 0.00 0.00 43.42 42.84 2mob n LEU 118 CO 0.47 1.14 0.00 0.61 0.00 0.00 0.00 177.39 179.61 2mob n GLY 119 N 0.67 -0.10 0.08 -3.96 0.00 -1.26 -2.73 105.19 97.89 2mob n GLY 119 Ca 0.21 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.17 2mob n GLY 119 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2mob h THR 120 N 0.00 0.86 -1.78 2.61 1.35 -2.01 -3.49 112.91 110.45 2mob h THR 120 Ca 0.00 -2.57 0.00 0.00 -0.55 0.00 0.00 66.41 63.29 2mob h THR 120 Cb 0.00 2.36 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 2mob h THR 120 CO 0.00 0.49 0.00 2.29 -0.25 0.00 0.00 175.52 178.05 2mob n LYS 121 N -3.05 0.00 -4.37 4.72 2.85 -1.11 -4.42 118.16 112.79 2mob n LYS 121 Ca -0.12 0.00 -0.25 0.00 -1.05 0.00 0.00 58.31 56.89 2mob n LYS 121 Cb 0.97 0.00 -0.09 0.00 -0.65 0.00 0.00 35.03 35.26 2mob n LYS 121 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 177.40 177.29 2mob s PHE 122 N -3.57 2.52 -0.24 5.58 0.40 0.39 0.28 117.98 123.35 2mob s PHE 122 Ca 0.00 -0.46 -0.03 0.00 -0.60 0.00 0.00 56.93 55.84 2mob s PHE 122 Cb 0.00 -1.49 0.08 0.00 0.51 0.00 0.00 43.02 42.12 2mob s PHE 122 CO 0.00 0.49 0.09 0.99 0.70 0.00 0.00 175.22 177.49 2mob s THR 123 N -2.54 0.24 -0.05 0.64 2.01 0.41 -2.67 115.64 113.68 2mob s THR 123 Ca 0.34 -0.67 -0.00 0.00 0.31 0.00 0.00 61.69 61.68 2mob s THR 123 Cb 0.01 -1.01 -0.03 0.00 0.01 0.00 0.00 72.50 71.47 2mob s THR 123 CO 0.19 -0.47 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.00 2mob s ILE 124 N 1.96 4.09 0.03 1.82 1.09 -0.67 0.56 121.20 130.09 2mob s ILE 124 Ca 0.05 -0.43 -0.00 0.00 -1.10 0.00 0.00 60.65 59.17 2mob s ILE 124 Cb -0.16 -2.74 0.00 0.00 -1.06 0.00 0.00 42.46 38.49 2mob s ILE 124 CO -0.20 0.53 0.04 1.07 -0.10 0.00 0.00 174.94 176.27 2mob n THR 125 N 1.91 0.00 -0.08 2.92 5.66 -1.23 -1.31 114.28 122.16 2mob n THR 125 Ca -0.17 -0.13 -0.13 0.00 -3.05 0.00 0.00 64.05 60.57 2mob n THR 125 Cb 0.53 0.09 -0.14 0.00 -1.55 0.00 0.00 70.33 69.25 2mob n THR 125 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2mob n SER 126 N -1.97 0.91 -3.85 1.09 2.88 -1.26 -2.26 113.62 109.16 2mob n SER 126 Ca -0.00 0.09 -0.45 0.00 -1.33 0.00 0.00 58.87 57.18 2mob n SER 126 Cb 0.05 0.20 -0.12 0.00 -0.75 0.00 0.00 64.21 63.59 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 -3.02 0.00 0.00 -1.46 -0.58 -1.26 -4.77 120.64 109.55 2mob n GLU 127 Ca -0.32 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.42 2mob n GLU 127 Cb 1.08 -1.32 0.00 0.00 -0.57 0.00 0.00 31.44 30.63 2mob n GLU 127 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93