#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2mob s ASN 36 N 0.00 6.46 0.34 4.04 0.01 -1.26 -4.99 114.94 119.54 2mob s ASN 36 Ca 0.00 0.02 -0.19 0.00 -0.71 0.00 0.00 52.86 51.99 2mob s ASN 36 Cb 0.00 -2.43 -0.14 0.00 0.41 0.00 0.00 41.25 39.09 2mob s ASN 36 CO 0.00 -1.01 0.10 0.00 -1.51 0.00 0.00 177.10 174.67 2mob n ALA 37 N 7.03 -2.78 -3.74 0.60 0.00 -1.26 -4.20 120.51 116.15 2mob n ALA 37 Ca 0.05 0.12 -0.22 0.00 0.00 0.00 0.00 53.44 53.39 2mob n ALA 37 Cb 0.48 -1.29 -0.18 0.00 0.00 0.00 0.00 19.45 18.47 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 -1.43 0.27 -0.13 0.00 1.01 -0.78 -4.79 120.40 114.55 2mob s VAL 38 Ca 0.52 0.18 -0.11 0.00 0.00 0.00 0.00 61.98 62.56 2mob s VAL 38 Cb -0.57 -0.44 -0.05 0.00 0.00 0.00 0.00 36.38 35.33 2mob s VAL 38 CO 0.54 0.24 0.23 0.54 0.00 0.00 0.00 175.10 176.65 2mob s VAL 39 N 1.92 5.34 0.05 2.92 0.11 -1.26 -0.10 120.40 129.38 2mob s VAL 39 Ca 0.04 0.42 0.03 0.00 -2.93 0.00 0.00 61.98 59.53 2mob s VAL 39 Cb -0.12 -3.54 -0.04 0.00 -1.53 0.00 0.00 36.38 31.15 2mob s VAL 39 CO -0.04 0.50 0.03 -0.22 -3.33 0.00 0.00 175.10 172.04 2mob s LEU 40 N -0.27 3.63 -0.14 2.54 2.96 0.92 -4.41 118.68 123.90 2mob s LEU 40 Ca 0.16 -0.04 -0.07 0.00 -0.22 0.00 0.00 54.13 53.96 2mob s LEU 40 Cb -0.13 -2.24 0.06 0.00 0.50 0.00 0.00 46.19 44.38 2mob s LEU 40 CO 0.04 0.22 0.33 -0.69 -1.32 0.00 0.00 176.35 174.93 2mob s VAL 41 N -1.26 -0.20 0.36 1.68 1.01 -1.26 0.83 120.40 121.57 2mob s VAL 41 Ca 0.25 0.16 0.06 0.00 0.00 0.00 0.00 61.98 62.44 2mob s VAL 41 Cb -0.12 -0.51 -0.03 0.00 0.00 0.00 0.00 36.38 35.72 2mob s VAL 41 CO 0.17 0.07 0.21 -0.22 0.00 0.00 0.00 175.10 175.32 2mob s LEU 42 N 1.73 1.83 1.01 3.92 2.96 0.15 -4.23 118.68 126.06 2mob s LEU 42 Ca -0.06 -1.72 -0.17 0.00 -0.22 0.00 0.00 54.13 51.96 2mob s LEU 42 Cb -0.10 0.27 0.22 0.00 0.50 0.00 0.00 46.19 47.08 2mob s LEU 42 CO -0.11 -1.01 1.30 0.00 -1.32 0.00 0.00 176.35 175.22 2mob s MET 43 N -3.57 0.30 -0.66 1.98 0.23 -1.26 0.84 119.30 117.14 2mob s MET 43 Ca 0.33 -0.40 -0.26 0.00 -1.03 0.00 0.00 55.69 54.33 2mob s MET 43 Cb 0.02 -1.80 -0.07 0.00 -1.53 0.00 0.00 34.83 31.45 2mob s MET 43 CO 0.22 -2.65 2.20 0.15 -2.03 0.00 0.00 175.02 172.91 2mob s LYS 44 N -5.85 2.17 0.00 3.16 1.02 -1.26 -3.02 119.74 115.97 2mob s LYS 44 Ca 0.74 0.71 0.22 0.00 0.02 0.00 0.00 55.97 57.66 2mob s LYS 44 Cb -0.04 -4.67 1.28 0.00 -0.52 0.00 0.00 37.83 33.88 2mob s LYS 44 CO 0.54 -3.46 1.69 0.45 -0.92 0.00 0.00 175.35 173.65 2mob n SER 45 N 15.53 0.00 0.00 2.83 2.88 -1.26 -4.89 113.62 128.71 2mob n SER 45 Ca 0.36 -0.58 0.00 0.00 -1.33 0.00 0.00 58.87 57.32 2mob n SER 45 Cb 0.50 -0.05 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 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 -1.05 0.00 -1.70 -3.46 2.03 -1.26 -4.39 116.55 106.72 2mob n ASP 46 Ca 0.15 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.43 2mob n ASP 46 Cb 0.09 0.00 0.25 0.00 -0.72 0.00 0.00 41.12 40.74 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 3.23 0.00 -0.67 1.02 -1.26 -4.63 120.64 118.32 2mob n GLU 47 Ca 0.00 -2.35 0.00 0.00 -0.02 0.00 0.00 57.16 54.79 2mob n GLU 47 Cb 0.00 -2.01 0.00 0.00 -0.02 0.00 0.00 31.44 29.41 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 0.03 0.00 -0.46 -3.67 -0.00 -1.26 0.18 119.36 114.17 2mob n ILE 48 Ca 0.30 1.28 0.38 0.00 -0.00 0.00 0.00 62.75 64.71 2mob n ILE 48 Cb 1.13 -2.26 0.61 0.00 -0.00 0.00 0.00 39.64 39.12 2mob n ILE 48 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 2mob n ASP 49 N -1.83 0.12 -0.02 7.28 2.03 -1.26 0.30 116.55 123.18 2mob n ASP 49 Ca 0.00 1.07 -0.08 0.00 0.52 0.00 0.00 54.79 56.30 2mob n ASP 49 Cb 0.00 -0.53 -0.07 0.00 -0.72 0.00 0.00 41.12 39.80 2mob n ASP 49 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2mob h ALA 50 N 1.19 -0.08 0.03 -1.67 0.00 -1.78 -2.57 119.26 114.39 2mob h ALA 50 Ca 0.76 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.43 2mob h ALA 50 Cb 2.66 0.03 0.00 0.00 0.00 0.00 0.00 17.79 20.48 2mob h ALA 50 CO -0.28 -0.10 -0.02 -0.84 0.00 0.00 0.00 179.25 178.02 2mob h ILE 51 N -0.96 1.37 -1.03 0.00 3.07 0.98 -1.30 117.51 119.65 2mob h ILE 51 Ca -0.01 -1.37 0.30 0.00 1.55 0.00 0.00 64.86 65.33 2mob h ILE 51 Cb 0.52 2.27 -0.13 0.00 -0.27 0.00 0.00 36.82 39.20 2mob h ILE 51 CO 0.01 0.34 0.61 0.40 -1.05 0.00 0.00 178.15 178.46 2mob h ILE 52 N -0.65 0.38 0.68 0.16 1.08 0.45 4.91 117.51 124.51 2mob h ILE 52 Ca -0.00 -0.13 -0.03 0.00 -0.39 0.00 0.00 64.86 64.30 2mob h ILE 52 Cb 0.60 -0.05 0.01 0.00 -3.07 0.00 0.00 36.82 34.31 2mob h ILE 52 CO 0.01 0.07 -0.33 -0.08 -0.69 0.00 0.00 178.15 177.13 2mob h GLU 53 N 0.39 -0.88 0.00 2.37 4.22 -1.24 2.67 114.58 122.11 2mob h GLU 53 Ca 0.70 0.06 0.00 0.00 0.08 0.00 0.00 59.36 60.20 2mob h GLU 53 Cb 1.59 0.20 0.00 0.00 0.50 0.00 0.00 28.75 31.04 2mob h GLU 53 CO -0.52 -0.58 -0.04 -3.47 -2.18 0.00 0.00 179.01 172.22 2mob n ASP 54 N -4.96 0.17 -0.08 1.04 2.03 -0.22 -1.68 116.55 112.85 2mob n ASP 54 Ca -0.11 0.46 -0.09 0.00 0.52 0.00 0.00 54.79 55.57 2mob n ASP 54 Cb 0.36 -0.50 -0.10 0.00 -0.72 0.00 0.00 41.12 40.16 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 -1.63 0.98 -0.02 5.18 0.13 1.59 -4.09 119.36 121.50 2mob n ILE 55 Ca 0.07 -0.53 -0.03 0.00 -1.10 0.00 0.00 62.75 61.15 2mob n ILE 55 Cb 0.36 -0.79 -0.01 0.00 -0.84 0.00 0.00 39.64 38.35 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 -2.68 0.20 -0.33 9.51 0.31 0.73 -3.00 118.33 123.06 2mob n VAL 56 Ca -0.26 -0.06 0.01 0.00 -0.01 0.00 0.00 64.34 64.02 2mob n VAL 56 Cb 0.92 -1.11 0.19 0.00 -0.91 0.00 0.00 33.84 32.92 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 1.01 0.00 7.52 6.46 0.45 0.90 115.31 131.58 2mob h LEU 57 Ca -0.08 -0.01 -0.40 0.00 -0.12 0.00 0.00 57.88 57.27 2mob h LEU 57 Cb 1.10 -0.23 -0.07 0.00 -0.73 0.00 0.00 40.66 40.73 2mob h LEU 57 CO -0.04 0.69 -2.49 1.17 -0.62 0.00 0.00 178.44 177.15 2mob n LYS 58 N -4.45 0.64 -0.02 1.25 4.81 -0.73 -4.07 118.16 115.60 2mob n LYS 58 Ca 0.13 0.16 -0.13 0.00 -0.87 0.00 0.00 58.31 57.60 2mob n LYS 58 Cb 0.11 -1.52 -0.08 0.00 0.02 0.00 0.00 35.03 33.56 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 1.69 0.11 -1.53 3.14 0.00 -1.49 -2.79 103.07 102.20 2mob h GLY 59 Ca -0.59 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 46.63 2mob h GLY 59 CO -0.13 0.08 0.02 0.61 0.00 0.00 0.00 176.54 177.12 2mob n GLY 60 N -0.12 1.81 0.04 4.60 0.00 0.31 -3.42 105.19 108.42 2mob n GLY 60 Ca -0.07 -0.07 0.06 0.00 0.00 0.00 0.00 46.02 45.94 2mob n GLY 60 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2mob n LYS 61 N 0.17 2.52 0.00 1.61 3.00 -1.05 -4.16 118.16 120.25 2mob n LYS 61 Ca 0.03 -0.10 0.00 0.00 -0.00 0.00 0.00 58.31 58.24 2mob n LYS 61 Cb 0.41 -1.13 0.00 0.00 0.00 0.00 0.00 35.03 34.31 2mob n LYS 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2mob n ALA 62 N -1.16 0.00 0.00 3.14 0.00 -1.22 -4.69 120.51 116.59 2mob n ALA 62 Ca 0.03 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.39 2mob n ALA 62 Cb 0.22 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.76 2mob n ALA 62 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 2mob h LYS 63 N 0.00 0.55 -6.31 0.00 2.10 -1.88 -3.42 116.57 107.61 2mob h LYS 63 Ca 0.00 -0.30 -0.55 0.00 -2.00 0.00 0.00 60.65 57.81 2mob h LYS 63 Cb 0.00 0.01 -0.01 0.00 -0.90 0.00 0.00 32.23 31.34 2mob h LYS 63 CO 0.00 0.89 0.95 -0.80 -2.00 0.00 0.00 179.45 178.49 2mob s ASN 64 N -6.87 6.77 0.12 7.07 0.02 -1.26 -4.91 114.94 115.89 2mob s ASN 64 Ca -0.07 2.14 -0.17 0.00 -1.02 0.00 0.00 52.86 53.74 2mob s ASN 64 Cb 0.12 -2.55 -0.02 0.00 0.02 0.00 0.00 41.25 38.82 2mob s ASN 64 CO 0.83 -0.81 1.67 1.55 0.02 0.00 0.00 177.10 180.35 2mob h PRO 65 N 8.52 0.53 0.00 -0.60 0.13 -1.81 -3.36 132.00 135.40 2mob h PRO 65 Ca -0.37 -0.10 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2mob h PRO 65 Cb 1.17 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2mob h PRO 65 CO 0.93 0.52 0.00 0.43 -0.23 0.00 0.00 178.00 179.65 2mob n SER 66 N -4.69 0.00 -4.61 1.44 7.64 -1.26 -4.98 113.62 107.16 2mob n SER 66 Ca -0.01 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.53 2mob n SER 66 Cb 0.14 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.24 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 4.32 0.02 0.44 1.09 -1.26 -2.31 121.20 123.49 2mob s ILE 67 Ca 0.00 -0.22 -0.17 0.00 -1.10 0.00 0.00 60.65 59.16 2mob s ILE 67 Cb 0.00 -2.88 -0.06 0.00 -1.06 0.00 0.00 42.46 38.46 2mob s ILE 67 CO 0.00 0.53 0.47 -0.69 -0.10 0.00 0.00 174.94 175.15 2mob s VAL 68 N -0.14 4.94 -0.77 2.92 1.01 0.36 -4.84 120.40 123.87 2mob s VAL 68 Ca 0.05 0.98 -0.09 0.00 0.00 0.00 0.00 61.98 62.91 2mob s VAL 68 Cb -0.13 -3.78 0.20 0.00 0.00 0.00 0.00 36.38 32.67 2mob s VAL 68 CO 0.02 0.55 0.67 -0.69 0.00 0.00 0.00 175.10 175.65 2mob s VAL 69 N -0.97 4.92 -0.17 2.92 1.01 -1.26 0.15 120.40 127.01 2mob s VAL 69 Ca 0.26 -2.75 -0.06 0.00 0.00 0.00 0.00 61.98 59.43 2mob s VAL 69 Cb -0.18 -4.08 -0.20 0.00 0.00 0.00 0.00 36.38 31.93 2mob s VAL 69 CO 0.15 -0.99 3.43 -0.62 0.00 0.00 0.00 175.10 177.08 2mob n GLU 70 N 3.67 2.18 -2.48 2.72 4.71 0.39 -4.90 120.64 126.93 2mob n GLU 70 Ca 0.13 -1.32 -0.43 0.00 -0.01 0.00 0.00 57.16 55.53 2mob n GLU 70 Cb 0.43 -2.07 -0.02 0.00 -1.01 0.00 0.00 31.44 28.77 2mob n GLU 70 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 2mob s ASP 71 N 1.69 6.46 0.01 1.62 2.15 -1.19 -1.91 116.67 125.50 2mob s ASP 71 Ca 0.66 0.57 0.05 0.00 0.43 0.00 0.00 52.55 54.25 2mob s ASP 71 Cb 0.32 -2.55 -0.01 0.00 -0.30 0.00 0.00 42.92 40.38 2mob s ASP 71 CO -0.04 -1.38 -0.14 -0.75 -0.17 0.00 0.00 175.17 172.68 2mob s LYS 72 N 4.78 1.09 -0.82 4.34 2.20 -1.07 -4.99 119.74 125.26 2mob s LYS 72 Ca 0.53 -0.61 -0.20 0.00 -0.36 0.00 0.00 55.97 55.34 2mob s LYS 72 Cb -0.10 -1.07 -0.19 0.00 -1.51 0.00 0.00 37.83 34.96 2mob s LYS 72 CO 0.31 0.29 2.16 0.00 -0.36 0.00 0.00 175.35 177.74 2mob n ALA 73 N 2.42 0.48 0.00 3.13 0.00 -1.26 -1.62 120.51 123.67 2mob n ALA 73 Ca -0.16 -1.42 0.00 0.00 0.00 0.00 0.00 53.44 51.86 2mob n ALA 73 Cb 0.55 -2.84 0.00 0.00 0.00 0.00 0.00 19.45 17.16 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 6.16 1.39 3.04 0.00 0.00 -1.26 -5.12 105.19 109.40 2mob n GLY 74 Ca 0.45 -0.04 -0.11 0.00 0.00 0.00 0.00 46.02 46.31 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 -0.02 -1.17 1.61 0.40 -0.64 -4.13 117.98 114.03 2mob s PHE 75 Ca 0.00 0.05 -0.12 0.00 -0.60 0.00 0.00 56.93 56.27 2mob s PHE 75 Cb 0.00 -0.02 0.22 0.00 0.51 0.00 0.00 43.02 43.73 2mob s PHE 75 CO 0.00 -0.17 1.29 -0.46 0.70 0.00 0.00 175.22 176.58 2mob s TRP 76 N -0.69 3.85 -0.11 0.36 -0.00 0.25 -2.60 118.94 120.00 2mob s TRP 76 Ca -0.08 -2.39 -0.22 0.00 -0.00 0.00 0.00 56.10 53.41 2mob s TRP 76 Cb -0.05 -4.10 -0.03 0.00 -0.00 0.00 0.00 33.47 29.29 2mob s TRP 76 CO 0.01 -1.20 0.66 -1.58 -0.00 0.00 0.00 176.95 174.84 2mob s TRP 77 N 0.31 3.52 -0.02 5.86 0.52 -0.80 0.33 118.94 128.65 2mob s TRP 77 Ca 0.37 1.13 0.03 0.00 0.02 0.00 0.00 56.10 57.65 2mob s TRP 77 Cb -0.06 -2.77 -0.00 0.00 -1.15 0.00 0.00 33.47 29.48 2mob s TRP 77 CO -0.03 0.03 -0.10 0.42 0.02 0.00 0.00 176.95 177.28 2mob s ILE 78 N 1.08 0.82 0.02 2.03 1.09 0.24 0.15 121.20 126.63 2mob s ILE 78 Ca 0.34 -0.40 0.08 0.00 -1.10 0.00 0.00 60.65 59.56 2mob s ILE 78 Cb -0.17 -0.71 -0.03 0.00 -1.06 0.00 0.00 42.46 40.50 2mob s ILE 78 CO 0.15 0.25 -0.22 -0.75 -0.10 0.00 0.00 174.94 174.26 2mob s LYS 79 N 0.02 2.02 -0.03 2.79 2.20 0.40 0.31 119.74 127.46 2mob s LYS 79 Ca -0.00 -0.99 0.02 0.00 -0.36 0.00 0.00 55.97 54.63 2mob s LYS 79 Cb -0.07 -2.10 0.01 0.00 -1.51 0.00 0.00 37.83 34.16 2mob s LYS 79 CO 0.00 0.54 -0.06 0.00 -0.36 0.00 0.00 175.35 175.47 2mob s ALA 80 N -0.80 0.65 -0.42 3.13 0.00 0.86 0.14 121.76 125.31 2mob s ALA 80 Ca 0.12 -0.18 -0.05 0.00 0.00 0.00 0.00 51.96 51.85 2mob s ALA 80 Cb -0.10 -0.29 -0.06 0.00 0.00 0.00 0.00 23.12 22.67 2mob s ALA 80 CO 0.02 0.07 3.06 -3.47 0.00 0.00 0.00 175.76 175.45 2mob n ASP 81 N 3.47 6.27 0.00 0.00 -0.08 -0.98 -1.86 116.55 123.37 2mob n ASP 81 Ca -0.20 -2.91 0.00 0.00 -1.51 0.00 0.00 54.79 50.18 2mob n ASP 81 Cb 0.54 -1.33 0.00 0.00 2.34 0.00 0.00 41.12 42.67 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 1.66 0.89 3.67 0.27 0.00 -1.26 -4.69 105.19 105.73 2mob n GLY 82 Ca 0.49 0.43 -0.24 0.00 0.00 0.00 0.00 46.02 46.71 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 3.32 -0.07 4.61 0.00 -1.26 -3.03 121.76 124.33 2mob s ALA 83 Ca 0.00 -1.86 -0.11 0.00 0.00 0.00 0.00 51.96 49.99 2mob s ALA 83 Cb 0.00 -0.58 0.02 0.00 0.00 0.00 0.00 23.12 22.57 2mob s ALA 83 CO 0.00 0.08 0.27 -1.50 0.00 0.00 0.00 175.76 174.61 2mob s ILE 84 N -2.45 0.03 0.12 0.00 1.10 -0.61 -4.96 121.20 114.42 2mob s ILE 84 Ca 0.36 -0.23 0.10 0.00 -0.51 0.00 0.00 60.65 60.37 2mob s ILE 84 Cb -0.02 -0.46 -0.04 0.00 0.15 0.00 0.00 42.46 42.09 2mob s ILE 84 CO 0.21 -0.12 -0.24 -1.61 -2.11 0.00 0.00 174.94 171.06 2mob s GLU 85 N -0.46 1.28 0.24 3.50 2.02 -1.26 -2.25 118.70 121.77 2mob s GLU 85 Ca -0.06 -1.28 -0.22 0.00 0.02 0.00 0.00 54.97 53.43 2mob s GLU 85 Cb -0.04 -1.66 0.03 0.00 0.10 0.00 0.00 34.13 32.57 2mob s GLU 85 CO 0.02 0.39 0.76 0.42 0.02 0.00 0.00 175.26 176.86 2mob s ILE 86 N -1.18 0.00 0.11 -1.63 -1.09 -0.86 -5.01 121.20 111.54 2mob s ILE 86 Ca 0.11 -0.84 0.02 0.00 -2.23 0.00 0.00 60.65 57.71 2mob s ILE 86 Cb -0.10 -1.91 -0.01 0.00 -1.58 0.00 0.00 42.46 38.87 2mob s ILE 86 CO 0.05 0.00 0.09 0.47 -1.23 0.00 0.00 174.94 174.32 2mob n ASP 87 N -0.45 -0.18 0.00 3.58 8.00 -1.26 0.14 116.55 126.38 2mob n ASP 87 Ca -0.05 -1.70 0.00 0.00 0.71 0.00 0.00 54.79 53.74 2mob n ASP 87 Cb 0.60 0.53 0.00 0.00 -0.02 0.00 0.00 41.12 42.23 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 -2.27 0.84 -0.34 2.24 0.00 -1.21 -4.81 120.51 114.97 2mob n ALA 88 Ca -0.04 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.55 2mob n ALA 88 Cb 0.19 0.00 0.30 0.00 0.00 0.00 0.00 19.45 19.95 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 1.22 -0.38 0.00 0.00 -1.88 0.32 119.26 118.54 2mob h ALA 89 Ca 0.00 0.33 0.08 0.00 0.00 0.00 0.00 54.91 55.32 2mob h ALA 89 Cb 0.00 0.57 -0.09 0.00 0.00 0.00 0.00 17.79 18.27 2mob h ALA 89 CO 0.00 -0.58 -0.32 1.49 0.00 0.00 0.00 179.25 179.84 2mob h GLU 90 N 0.02 -0.25 -0.61 0.00 4.57 -1.95 0.75 114.58 117.11 2mob h GLU 90 Ca 0.61 0.02 0.18 0.00 -1.18 0.00 0.00 59.36 58.98 2mob h GLU 90 Cb 1.27 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.89 2mob h GLU 90 CO -0.90 -0.16 0.50 0.00 -1.18 0.00 0.00 179.01 177.27 2mob h ALA 91 N 0.76 2.47 -0.04 2.92 0.00 -0.70 0.69 119.26 125.36 2mob h ALA 91 Ca 0.17 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 2mob h ALA 91 Cb 0.53 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2mob h ALA 91 CO -0.52 -0.81 -0.54 0.78 0.00 0.00 0.00 179.25 178.16 2mob h GLY 92 N 0.00 0.11 2.00 0.00 0.00 0.74 -0.74 103.07 105.18 2mob h GLY 92 Ca 0.29 -0.13 -0.04 0.00 0.00 0.00 0.00 47.33 47.45 2mob h GLY 92 CO -0.00 0.12 -0.20 0.83 0.00 0.00 0.00 176.54 177.28 2mob h GLU 93 N 0.08 0.00 0.06 4.80 5.08 0.10 2.14 114.58 126.84 2mob h GLU 93 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2mob h GLU 93 Cb 0.98 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 2mob h GLU 93 CO 0.08 0.20 -0.03 1.25 -1.00 0.00 0.00 179.01 179.51 2mob h LEU 94 N 0.00 -0.07 0.00 1.33 6.46 -0.74 -3.42 115.31 118.87 2mob h LEU 94 Ca -0.00 -0.08 -0.17 0.00 -0.12 0.00 0.00 57.88 57.51 2mob h LEU 94 Cb 0.64 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.56 2mob h LEU 94 CO 0.03 0.46 -1.68 0.00 -0.62 0.00 0.00 178.44 176.63 2mob n LEU 95 N -4.82 0.00 -2.30 2.25 -0.00 -0.39 -5.03 117.00 106.71 2mob n LEU 95 Ca -0.02 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.86 2mob n LEU 95 Cb 0.07 0.23 0.05 0.00 -0.00 0.00 0.00 43.42 43.77 2mob n LEU 95 CO 0.05 0.23 0.12 0.61 -0.00 0.00 0.00 177.39 178.41 2mob n GLY 96 N 2.35 0.07 0.00 1.47 0.00 0.72 -5.01 105.19 104.79 2mob n GLY 96 Ca -0.15 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.01 0.46 0.00 1.61 5.02 -1.26 -4.95 118.16 116.03 2mob n LYS 97 Ca -0.04 0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.34 2mob n LYS 97 Cb 0.55 0.00 0.48 0.00 -0.02 0.00 0.00 35.03 36.04 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 0.34 -0.11 1.97 -0.04 -1.26 -3.97 135.00 131.92 2mob n PRO 98 Ca 0.00 0.09 0.09 0.00 -0.04 0.00 0.00 63.50 63.63 2mob n PRO 98 Cb 0.00 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.12 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 -1.22 0.32 -0.02 0.54 1.16 -1.26 0.15 117.46 117.13 2mob n PHE 99 Ca 0.10 0.39 -0.09 0.00 -1.87 0.00 0.00 57.45 55.98 2mob n PHE 99 Cb 0.12 -0.82 -0.02 0.00 -1.61 0.00 0.00 39.48 37.15 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 -0.72 0.00 5.98 0.87 -1.76 -2.12 113.55 115.80 2mob h SER 100 Ca 0.25 0.13 -0.38 0.00 -1.23 0.00 0.00 61.79 60.56 2mob h SER 100 Cb 0.62 0.33 -0.06 0.00 -0.44 0.00 0.00 62.40 62.86 2mob h SER 100 CO -0.27 -0.27 -2.33 0.52 -0.53 0.00 0.00 176.83 173.95 2mob n VAL 101 N -5.36 1.32 -0.18 2.23 0.31 0.40 -2.76 118.33 114.28 2mob n VAL 101 Ca -0.02 -0.40 0.23 0.00 -0.01 0.00 0.00 64.34 64.15 2mob n VAL 101 Cb 0.28 -1.63 0.63 0.00 -0.91 0.00 0.00 33.84 32.20 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 -0.54 0.24 0.00 3.52 3.20 -0.89 0.85 116.97 123.35 2mob h TYR 102 Ca -0.57 0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.30 2mob h TYR 102 Cb 1.63 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.83 2mob h TYR 102 CO -0.04 0.06 -0.00 0.22 -1.64 0.00 0.00 178.16 176.76 2mob h ASP 103 N 0.18 -0.00 -0.80 -2.11 3.58 -1.51 -2.76 116.42 112.99 2mob h ASP 103 Ca 0.42 -0.91 0.09 0.00 0.42 0.00 0.00 57.03 57.05 2mob h ASP 103 Cb 1.36 0.00 -0.07 0.00 1.72 0.00 0.00 39.33 42.34 2mob h ASP 103 CO -0.08 0.95 0.45 0.17 -2.88 0.00 0.00 179.24 177.84 2mob h LEU 104 N -0.98 0.63 -2.05 2.28 8.10 -0.87 0.48 115.31 122.89 2mob h LEU 104 Ca -0.00 0.05 0.03 0.00 0.11 0.00 0.00 57.88 58.07 2mob h LEU 104 Cb 0.91 -0.07 -0.00 0.00 -0.44 0.00 0.00 40.66 41.06 2mob h LEU 104 CO 0.00 0.36 0.07 -0.07 -4.11 0.00 0.00 178.44 174.68 2mob h LEU 105 N 0.75 0.00 0.09 0.17 3.38 0.59 1.29 115.31 121.58 2mob h LEU 105 Ca 0.39 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 58.00 2mob h LEU 105 Cb 0.37 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 2mob h LEU 105 CO -0.25 0.00 -2.02 -0.38 0.09 0.00 0.00 178.44 175.88 2mob n ILE 106 N -4.42 1.71 0.34 1.22 5.41 0.61 -4.36 119.36 119.88 2mob n ILE 106 Ca -0.01 -0.58 0.12 0.00 1.00 0.00 0.00 62.75 63.28 2mob n ILE 106 Cb 0.18 -1.72 0.05 0.00 -0.71 0.00 0.00 39.64 37.43 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 -3.56 0.71 0.00 4.38 6.94 0.14 -3.80 115.26 120.06 2mob n ASN 107 Ca -0.35 0.13 0.07 0.00 -0.02 0.00 0.00 54.58 54.41 2mob n ASN 107 Cb 1.00 0.52 0.39 0.00 -2.36 0.00 0.00 39.78 39.33 2mob n ASN 107 CO 0.00 0.00 0.00 0.55 -1.03 0.00 0.00 177.26 176.78 2mob n VAL 108 N -2.32 0.38 -0.38 3.53 3.14 0.44 -3.72 118.33 119.40 2mob n VAL 108 Ca 0.01 0.09 0.32 0.00 -2.96 0.00 0.00 64.34 61.81 2mob n VAL 108 Cb 0.49 -0.86 0.50 0.00 -1.06 0.00 0.00 33.84 32.91 2mob n VAL 108 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 2mob n SER 109 N -1.18 0.00 0.00 6.55 3.41 -1.25 0.12 113.62 121.28 2mob n SER 109 Ca 0.08 0.68 0.01 0.00 -0.26 0.00 0.00 58.87 59.38 2mob n SER 109 Cb 0.09 -0.30 0.05 0.00 -0.26 0.00 0.00 64.21 63.79 2mob n SER 109 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2mob n SER 110 N -3.16 0.00 -1.70 4.04 3.41 -1.24 -3.75 113.62 111.22 2mob n SER 110 Ca 0.27 -0.61 -0.10 0.00 -0.26 0.00 0.00 58.87 58.17 2mob n SER 110 Cb 1.38 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 65.36 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 -0.58 2.38 0.29 6.66 5.66 0.33 -4.40 114.28 124.63 2mob n THR 111 Ca 0.01 -1.15 0.18 0.00 -3.05 0.00 0.00 64.05 60.04 2mob n THR 111 Cb 0.01 -1.31 0.92 0.00 -1.55 0.00 0.00 70.33 68.39 2mob n THR 111 CO 0.00 0.00 0.00 -0.37 -3.05 0.00 0.00 175.07 171.65 2mob h VAL 112 N 0.90 0.12 0.00 1.08 -1.51 -1.83 -3.30 116.25 111.70 2mob h VAL 112 Ca 0.19 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.66 2mob h VAL 112 Cb 1.03 0.78 0.00 0.00 -2.13 0.00 0.00 31.29 30.97 2mob h VAL 112 CO 0.47 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 177.42 2mob n GLY 113 N -1.24 -0.30 3.14 5.19 0.00 -1.26 -5.09 105.19 105.62 2mob n GLY 113 Ca -0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.87 0.69 -0.47 1.61 6.06 -1.23 -4.98 118.95 119.75 2mob s ARG 114 Ca 0.00 -0.96 0.07 0.00 -2.50 0.00 0.00 55.73 52.34 2mob s ARG 114 Cb 0.00 0.26 0.19 0.00 0.06 0.00 0.00 34.95 35.46 2mob s ARG 114 CO 0.00 -0.18 0.71 0.00 -2.50 0.00 0.00 175.30 173.33 2mob s ALA 115 N -3.43 -2.31 -0.29 6.12 0.00 -1.24 -3.31 121.76 117.31 2mob s ALA 115 Ca 0.02 -0.13 -0.29 0.00 0.00 0.00 0.00 51.96 51.56 2mob s ALA 115 Cb 0.04 -2.74 0.01 0.00 0.00 0.00 0.00 23.12 20.43 2mob s ALA 115 CO -0.08 -2.24 1.05 0.71 0.00 0.00 0.00 175.76 175.19 2mob s TYR 116 N 1.25 3.21 -0.01 0.00 1.51 0.94 -4.78 117.35 119.48 2mob s TYR 116 Ca 0.24 1.27 -0.25 0.00 -1.01 0.00 0.00 57.07 57.32 2mob s TYR 116 Cb -0.01 -3.54 -0.04 0.00 -0.11 0.00 0.00 41.96 38.26 2mob s TYR 116 CO -0.06 -0.67 0.77 -0.08 -1.11 0.00 0.00 175.55 174.40 2mob s THR 117 N 3.48 4.89 -0.60 -0.71 -1.32 -1.26 -1.51 115.64 118.61 2mob s THR 117 Ca 0.44 1.61 -0.00 0.00 -1.21 0.00 0.00 61.69 62.53 2mob s THR 117 Cb -0.13 -4.11 0.48 0.00 -1.51 0.00 0.00 72.50 67.23 2mob s THR 117 CO 0.12 0.29 1.94 0.18 -2.21 0.00 0.00 174.62 174.94 2mob n LEU 118 N 3.37 7.26 0.00 9.08 4.77 0.45 -4.92 117.00 137.01 2mob n LEU 118 Ca -0.01 -4.22 0.00 0.00 -0.03 0.00 0.00 56.01 51.75 2mob n LEU 118 Cb 0.51 -0.90 0.00 0.00 -2.33 0.00 0.00 43.42 40.70 2mob n LEU 118 CO 0.48 1.46 0.00 0.61 -1.33 0.00 0.00 177.39 178.61 2mob n GLY 119 N -0.94 0.45 0.00 -0.72 0.00 -1.26 -2.63 105.19 100.09 2mob n GLY 119 Ca 0.60 -0.01 0.06 0.00 0.00 0.00 0.00 46.02 46.68 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 -4.44 2.61 -1.04 -1.26 -4.82 114.28 105.33 2mob n THR 120 Ca 0.00 -0.23 -0.21 0.00 -2.04 0.00 0.00 64.05 61.56 2mob n THR 120 Cb 0.00 0.69 -0.10 0.00 -1.82 0.00 0.00 70.33 69.10 2mob n THR 120 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 2mob s LYS 121 N -2.52 1.58 0.05 -2.82 1.02 -1.08 -3.29 119.74 112.68 2mob s LYS 121 Ca 0.01 -1.82 0.07 0.00 0.02 0.00 0.00 55.97 54.26 2mob s LYS 121 Cb 0.10 -1.12 -0.03 0.00 -0.52 0.00 0.00 37.83 36.26 2mob s LYS 121 CO 0.55 -0.01 -0.20 0.12 -0.92 0.00 0.00 175.35 174.89 2mob s PHE 122 N -3.05 1.78 -0.20 3.18 2.19 0.37 0.17 117.98 122.42 2mob s PHE 122 Ca 0.31 -0.38 -0.04 0.00 0.33 0.00 0.00 56.93 57.15 2mob s PHE 122 Cb 0.05 -1.06 0.09 0.00 -1.31 0.00 0.00 43.02 40.79 2mob s PHE 122 CO 0.13 0.10 0.20 0.99 1.83 0.00 0.00 175.22 178.46 2mob s THR 123 N -0.83 -0.29 0.16 0.12 2.01 -0.57 -2.02 115.64 114.23 2mob s THR 123 Ca 0.07 -0.12 0.08 0.00 0.31 0.00 0.00 61.69 62.03 2mob s THR 123 Cb -0.09 -0.66 -0.04 0.00 0.01 0.00 0.00 72.50 71.72 2mob s THR 123 CO 0.02 -0.21 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.04 2mob s ILE 124 N 2.30 3.39 0.27 1.82 1.09 -0.96 -0.04 121.20 129.08 2mob s ILE 124 Ca 0.06 -1.52 -0.10 0.00 -1.10 0.00 0.00 60.65 58.00 2mob s ILE 124 Cb -0.16 -2.67 0.04 0.00 -1.06 0.00 0.00 42.46 38.61 2mob s ILE 124 CO -0.12 -0.07 0.54 1.07 -0.10 0.00 0.00 174.94 176.26 2mob n THR 125 N 0.10 0.00 0.00 2.92 5.66 -1.21 -1.57 114.28 120.18 2mob n THR 125 Ca -0.11 -0.71 0.00 0.00 -3.05 0.00 0.00 64.05 60.18 2mob n THR 125 Cb 0.55 0.69 0.00 0.00 -1.55 0.00 0.00 70.33 70.02 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 -1.39 0.00 -1.64 1.09 3.41 -1.17 -3.57 113.62 110.36 2mob n SER 126 Ca -0.06 0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.68 2mob n SER 126 Cb 0.41 -0.20 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2mob n SER 126 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2mob n GLU 127 N -1.36 1.26 0.00 4.33 1.02 -1.26 -4.76 120.64 119.87 2mob n GLU 127 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2mob n GLU 127 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2mob n GLU 127 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59