#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 1.74 -2.60 6.43 3.02 -1.26 -4.90 115.26 117.69 2mob n ASN 36 Ca 0.00 -1.37 -0.28 0.00 -0.03 0.00 0.00 54.58 52.90 2mob n ASN 36 Cb 0.00 0.17 -0.01 0.00 -0.61 0.00 0.00 39.78 39.32 2mob n ASN 36 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2mob n ALA 37 N 0.35 -2.16 -2.37 5.41 0.00 -1.26 -4.42 120.51 116.07 2mob n ALA 37 Ca 0.06 0.22 -0.16 0.00 0.00 0.00 0.00 53.44 53.56 2mob n ALA 37 Cb 0.28 -0.94 -0.08 0.00 0.00 0.00 0.00 19.45 18.70 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 -0.67 0.00 -0.03 0.00 -7.23 -0.11 -4.79 120.40 107.57 2mob s VAL 38 Ca 0.37 -1.93 0.01 0.00 -1.81 0.00 0.00 61.98 58.62 2mob s VAL 38 Cb -0.52 -2.51 0.02 0.00 0.56 0.00 0.00 36.38 33.94 2mob s VAL 38 CO 0.34 0.00 -0.02 0.54 -0.31 0.00 0.00 175.10 175.65 2mob s VAL 39 N -3.62 0.32 0.29 1.32 0.11 -1.26 -2.20 120.40 115.35 2mob s VAL 39 Ca 0.38 -0.01 0.04 0.00 -2.93 0.00 0.00 61.98 59.46 2mob s VAL 39 Cb 0.03 -0.38 -0.03 0.00 -1.53 0.00 0.00 36.38 34.48 2mob s VAL 39 CO 0.22 0.17 0.44 -0.22 -3.33 0.00 0.00 175.10 172.37 2mob s LEU 40 N 0.90 4.17 -0.30 2.54 2.96 0.81 -4.34 118.68 125.42 2mob s LEU 40 Ca -0.10 0.16 -0.11 0.00 -0.22 0.00 0.00 54.13 53.87 2mob s LEU 40 Cb -0.13 -2.99 0.16 0.00 0.50 0.00 0.00 46.19 43.73 2mob s LEU 40 CO -0.01 -0.19 0.85 -0.69 -1.32 0.00 0.00 176.35 174.98 2mob s VAL 41 N -2.12 -0.68 0.06 1.68 1.01 -1.26 -1.95 120.40 117.14 2mob s VAL 41 Ca 0.37 0.00 0.01 0.00 0.00 0.00 0.00 61.98 62.36 2mob s VAL 41 Cb -0.09 -1.00 -0.00 0.00 0.00 0.00 0.00 36.38 35.28 2mob s VAL 41 CO 0.32 0.00 0.04 0.18 0.00 0.00 0.00 175.10 175.63 2mob n LEU 42 N 5.26 0.00 -4.88 3.92 7.99 0.11 -3.95 117.00 125.45 2mob n LEU 42 Ca -0.08 -0.55 -0.21 0.00 -0.01 0.00 0.00 56.01 55.16 2mob n LEU 42 Cb 0.52 0.24 -0.03 0.00 -0.11 0.00 0.00 43.42 44.03 2mob n LEU 42 CO -0.04 -0.09 -0.10 0.00 -1.51 0.00 0.00 177.39 175.65 2mob s MET 43 N -2.25 3.02 -0.90 3.23 0.23 -1.26 -1.04 119.30 120.32 2mob s MET 43 Ca 0.05 -1.03 -0.25 0.00 -1.03 0.00 0.00 55.69 53.44 2mob s MET 43 Cb 0.00 -2.64 -0.22 0.00 -1.53 0.00 0.00 34.83 30.44 2mob s MET 43 CO 0.04 0.32 2.50 1.63 -2.03 0.00 0.00 175.02 177.48 2mob n LYS 44 N -1.31 0.21 -0.05 3.16 4.76 -1.26 -4.38 118.16 119.29 2mob n LYS 44 Ca -0.06 -0.06 0.01 0.00 -2.87 0.00 0.00 58.31 55.32 2mob n LYS 44 Cb 0.58 -1.87 0.04 0.00 -1.84 0.00 0.00 35.03 31.94 2mob n LYS 44 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2mob n SER 45 N 10.84 0.62 0.00 4.39 7.64 -1.26 -4.92 113.62 130.93 2mob n SER 45 Ca 0.60 -2.02 0.00 0.00 1.01 0.00 0.00 58.87 58.47 2mob n SER 45 Cb 0.17 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 2mob n SER 45 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2mob n ASP 46 N -0.21 0.00 -1.69 6.43 2.03 -1.26 -4.48 116.55 117.38 2mob n ASP 46 Ca 0.03 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.25 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 2.45 0.00 -0.67 1.02 -1.26 -4.64 120.64 117.54 2mob n GLU 47 Ca 0.00 -2.04 0.00 0.00 -0.02 0.00 0.00 57.16 55.10 2mob n GLU 47 Cb 0.00 -1.87 0.00 0.00 -0.02 0.00 0.00 31.44 29.55 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 -0.25 0.00 -0.56 -3.67 -0.00 -1.26 0.27 119.36 113.89 2mob n ILE 48 Ca 0.33 1.11 0.43 0.00 -0.00 0.00 0.00 62.75 64.62 2mob n ILE 48 Cb 1.15 -2.04 0.68 0.00 -0.00 0.00 0.00 39.64 39.43 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 -1.21 0.07 0.01 7.28 -0.08 -1.26 0.26 116.55 121.62 2mob n ASP 49 Ca 0.00 1.01 -0.08 0.00 -1.51 0.00 0.00 54.79 54.22 2mob n ASP 49 Cb 0.00 -0.50 -0.06 0.00 2.34 0.00 0.00 41.12 42.90 2mob n ASP 49 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2mob h ALA 50 N 1.08 -0.15 0.09 -1.67 0.00 -1.75 -2.30 119.26 114.56 2mob h ALA 50 Ca 0.82 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.53 2mob h ALA 50 Cb 3.06 0.06 0.00 0.00 0.00 0.00 0.00 17.79 20.91 2mob h ALA 50 CO -0.16 -0.17 -0.05 -0.84 0.00 0.00 0.00 179.25 178.03 2mob h ILE 51 N -0.97 1.14 -1.03 0.00 3.07 1.31 -0.72 117.51 120.31 2mob h ILE 51 Ca -0.02 -1.16 0.26 0.00 1.55 0.00 0.00 64.86 65.49 2mob h ILE 51 Cb 0.43 1.85 -0.12 0.00 -0.27 0.00 0.00 36.82 38.72 2mob h ILE 51 CO 0.03 0.27 0.63 0.40 -1.05 0.00 0.00 178.15 178.42 2mob h ILE 52 N -0.69 0.50 0.77 0.16 1.08 0.35 4.43 117.51 124.11 2mob h ILE 52 Ca -0.01 -0.17 -0.04 0.00 -0.39 0.00 0.00 64.86 64.25 2mob h ILE 52 Cb 0.54 -0.03 0.01 0.00 -3.07 0.00 0.00 36.82 34.27 2mob h ILE 52 CO 0.02 0.09 -0.37 -0.08 -0.69 0.00 0.00 178.15 177.12 2mob h GLU 53 N 0.49 -0.99 0.00 2.37 4.81 -1.19 2.85 114.58 122.92 2mob h GLU 53 Ca 0.64 0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.94 2mob h GLU 53 Cb 1.38 0.23 0.00 0.00 0.63 0.00 0.00 28.75 30.99 2mob h GLU 53 CO -0.43 -0.66 -0.06 -3.47 -0.73 0.00 0.00 179.01 173.66 2mob n ASP 54 N -5.14 0.37 -0.08 1.04 2.03 -0.30 -1.74 116.55 112.72 2mob n ASP 54 Ca -0.13 0.46 -0.09 0.00 0.52 0.00 0.00 54.79 55.56 2mob n ASP 54 Cb 0.41 -0.53 -0.10 0.00 -0.72 0.00 0.00 41.12 40.17 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 -1.81 1.00 -0.01 5.18 0.13 1.44 -4.71 119.36 120.58 2mob n ILE 55 Ca 0.06 -0.55 -0.03 0.00 -1.10 0.00 0.00 62.75 61.14 2mob n ILE 55 Cb 0.38 -0.78 -0.01 0.00 -0.84 0.00 0.00 39.64 38.39 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 0.16 -0.30 9.51 0.31 0.75 -3.72 118.33 122.37 2mob n VAL 56 Ca -0.26 -0.05 0.11 0.00 -0.01 0.00 0.00 64.34 64.13 2mob n VAL 56 Cb 0.93 -1.08 0.28 0.00 -0.91 0.00 0.00 33.84 33.06 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 0.38 0.11 7.52 5.85 0.48 2.49 115.31 132.09 2mob h LEU 57 Ca -0.07 0.13 -0.25 0.00 0.84 0.00 0.00 57.88 58.53 2mob h LEU 57 Cb 1.08 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 42.21 2mob h LEU 57 CO -0.03 0.06 -1.28 0.11 -0.34 0.00 0.00 178.44 176.97 2mob h LYS 58 N 0.46 0.24 0.10 1.25 1.57 -1.76 -2.97 116.57 115.46 2mob h LYS 58 Ca 0.52 -0.41 -0.00 0.00 -1.87 0.00 0.00 60.65 58.89 2mob h LYS 58 Cb 0.93 0.15 0.00 0.00 0.08 0.00 0.00 32.23 33.39 2mob h LYS 58 CO -0.48 1.19 -0.05 0.78 -0.57 0.00 0.00 179.45 180.33 2mob h GLY 59 N -0.06 -0.14 1.84 3.86 0.00 -1.43 0.18 103.07 107.31 2mob h GLY 59 Ca -0.27 0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.11 2mob h GLY 59 CO 0.06 -0.05 0.00 0.61 0.00 0.00 0.00 176.54 177.16 2mob n GLY 60 N -0.39 -0.89 0.06 4.60 0.00 0.83 -2.18 105.19 107.22 2mob n GLY 60 Ca -0.08 -0.05 0.06 0.00 0.00 0.00 0.00 46.02 45.95 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 -1.42 2.43 0.00 1.61 3.00 -0.88 -4.04 118.16 118.86 2mob n LYS 61 Ca 0.05 -0.14 0.00 0.00 -0.00 0.00 0.00 58.31 58.22 2mob n LYS 61 Cb 0.14 -1.15 0.00 0.00 0.00 0.00 0.00 35.03 34.02 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 -1.10 0.00 0.01 3.14 0.00 0.59 -4.65 120.51 118.50 2mob n ALA 62 Ca 0.03 -0.01 -0.07 0.00 0.00 0.00 0.00 53.44 53.40 2mob n ALA 62 Cb 0.23 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.55 2mob n ALA 62 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2mob h LYS 63 N 0.00 0.00 -6.39 0.00 1.57 -1.84 -3.45 116.57 106.46 2mob h LYS 63 Ca 0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 2mob h LYS 63 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2mob h LYS 63 CO 0.00 0.59 0.88 -0.80 -0.57 0.00 0.00 179.45 179.55 2mob s ASN 64 N -6.21 6.79 0.18 0.86 0.01 -1.24 -4.91 114.94 110.40 2mob s ASN 64 Ca -0.03 2.20 -0.12 0.00 -0.71 0.00 0.00 52.86 54.21 2mob s ASN 64 Cb 0.09 -2.56 0.08 0.00 0.41 0.00 0.00 41.25 39.27 2mob s ASN 64 CO 0.82 -0.77 1.75 1.55 -1.51 0.00 0.00 177.10 178.95 2mob h PRO 65 N 7.99 0.88 0.00 -0.60 0.13 -1.88 -3.35 132.00 135.17 2mob h PRO 65 Ca -0.39 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2mob h PRO 65 Cb 1.18 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2mob h PRO 65 CO 0.91 0.72 0.00 0.45 -0.23 0.00 0.00 178.00 179.85 2mob n SER 66 N -4.51 0.00 -4.78 1.44 2.88 -1.26 -4.97 113.62 102.43 2mob n SER 66 Ca 0.04 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.27 2mob n SER 66 Cb 0.13 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.53 2mob n SER 66 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2mob s ILE 67 N 0.00 4.55 -0.18 2.46 1.09 -1.26 -4.68 121.20 123.18 2mob s ILE 67 Ca 0.00 -0.76 -0.07 0.00 -1.10 0.00 0.00 60.65 58.72 2mob s ILE 67 Cb 0.00 -3.19 -0.04 0.00 -1.06 0.00 0.00 42.46 38.17 2mob s ILE 67 CO 0.00 0.13 0.07 0.54 -0.10 0.00 0.00 174.94 175.57 2mob s VAL 68 N -1.39 4.84 -0.40 2.92 0.11 -0.21 -4.93 120.40 121.34 2mob s VAL 68 Ca 0.29 -0.02 -0.02 0.00 -2.93 0.00 0.00 61.98 59.30 2mob s VAL 68 Cb -0.12 -3.18 0.11 0.00 -1.53 0.00 0.00 36.38 31.66 2mob s VAL 68 CO 0.22 0.47 0.18 -0.69 -3.33 0.00 0.00 175.10 171.95 2mob s VAL 69 N 0.31 3.16 -1.21 2.04 1.01 -1.26 0.12 120.40 124.57 2mob s VAL 69 Ca 0.04 -2.07 -0.13 0.00 0.00 0.00 0.00 61.98 59.81 2mob s VAL 69 Cb -0.12 -3.18 0.17 0.00 0.00 0.00 0.00 36.38 33.25 2mob s VAL 69 CO 0.00 -0.67 1.46 -0.62 0.00 0.00 0.00 175.10 175.27 2mob n GLU 70 N 4.56 3.38 -2.58 2.72 -0.58 0.90 -4.94 120.64 124.10 2mob n GLU 70 Ca -0.02 -3.85 -0.41 0.00 -0.42 0.00 0.00 57.16 52.47 2mob n GLU 70 Cb 0.41 -3.03 -0.03 0.00 -0.57 0.00 0.00 31.44 28.23 2mob n GLU 70 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2mob s ASP 71 N 2.70 6.47 0.33 1.62 1.01 -1.26 -1.16 116.67 126.38 2mob s ASP 71 Ca 0.43 -1.38 -0.07 0.00 0.71 0.00 0.00 52.55 52.23 2mob s ASP 71 Cb -0.02 -2.56 -0.06 0.00 1.01 0.00 0.00 42.92 41.29 2mob s ASP 71 CO 0.00 -1.52 0.64 -0.75 0.21 0.00 0.00 175.17 173.75 2mob s LYS 72 N 4.95 3.70 0.18 8.23 2.20 0.64 -4.93 119.74 134.70 2mob s LYS 72 Ca 0.44 0.20 0.12 0.00 -0.36 0.00 0.00 55.97 56.37 2mob s LYS 72 Cb -0.01 -2.54 0.64 0.00 -1.51 0.00 0.00 37.83 34.40 2mob s LYS 72 CO -0.07 0.12 1.35 0.00 -0.36 0.00 0.00 175.35 176.39 2mob n ALA 73 N -1.03 1.00 -2.09 3.13 0.00 -1.26 -2.51 120.51 117.74 2mob n ALA 73 Ca 0.00 0.11 -0.00 0.00 0.00 0.00 0.00 53.44 53.55 2mob n ALA 73 Cb 0.54 -1.15 -0.00 0.00 0.00 0.00 0.00 19.45 18.83 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 -1.38 0.72 3.15 0.00 0.00 -1.26 -4.95 105.19 101.47 2mob n GLY 74 Ca -0.01 -0.16 0.04 0.00 0.00 0.00 0.00 46.02 45.90 2mob n GLY 74 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2mob s PHE 75 N 0.00 -1.58 -1.23 1.61 0.08 -1.05 -4.64 117.98 111.18 2mob s PHE 75 Ca 0.06 1.58 -0.13 0.00 0.12 0.00 0.00 56.93 58.57 2mob s PHE 75 Cb 0.07 0.52 0.17 0.00 -0.57 0.00 0.00 43.02 43.21 2mob s PHE 75 CO -0.03 -0.87 1.53 1.87 -0.10 0.00 0.00 175.22 177.62 2mob n TRP 76 N 5.43 4.53 -4.00 0.36 -0.00 -0.21 -0.26 117.44 123.28 2mob n TRP 76 Ca -0.01 -3.24 -0.35 0.00 -0.00 0.00 0.00 57.50 53.90 2mob n TRP 76 Cb 0.52 -2.13 -0.08 0.00 -0.00 0.00 0.00 31.31 29.61 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 1.25 3.35 0.04 5.87 0.52 -0.31 -0.71 118.94 128.94 2mob s TRP 77 Ca 0.42 0.26 0.01 0.00 0.02 0.00 0.00 56.10 56.80 2mob s TRP 77 Cb -0.00 -2.00 -0.03 0.00 -1.15 0.00 0.00 33.47 30.30 2mob s TRP 77 CO 0.00 0.39 -0.05 0.42 0.02 0.00 0.00 176.95 177.74 2mob s ILE 78 N -0.25 0.28 0.12 2.03 1.09 -0.82 0.31 121.20 123.95 2mob s ILE 78 Ca 0.09 -1.18 0.07 0.00 -1.10 0.00 0.00 60.65 58.53 2mob s ILE 78 Cb -0.12 -0.66 -0.04 0.00 -1.06 0.00 0.00 42.46 40.58 2mob s ILE 78 CO 0.01 -0.58 -0.16 -1.59 -0.10 0.00 0.00 174.94 172.52 2mob s LYS 79 N -2.07 1.05 0.33 2.79 -2.85 0.34 0.28 119.74 119.61 2mob s LYS 79 Ca -0.09 -1.20 0.07 0.00 -1.00 0.00 0.00 55.97 53.76 2mob s LYS 79 Cb -0.06 -1.08 -0.03 0.00 -2.06 0.00 0.00 37.83 34.60 2mob s LYS 79 CO -0.02 0.23 0.26 0.00 0.10 0.00 0.00 175.35 175.92 2mob s ALA 80 N -1.72 1.90 -0.43 0.59 0.00 -0.94 -1.05 121.76 120.12 2mob s ALA 80 Ca 0.07 -2.01 0.07 0.00 0.00 0.00 0.00 51.96 50.09 2mob s ALA 80 Cb -0.07 1.44 0.42 0.00 0.00 0.00 0.00 23.12 24.90 2mob s ALA 80 CO 0.04 -0.64 1.08 -0.25 0.00 0.00 0.00 175.76 175.99 2mob n ASP 81 N -1.49 4.28 0.00 0.00 8.00 -1.26 -0.93 116.55 125.15 2mob n ASP 81 Ca 0.07 -3.59 0.00 0.00 0.71 0.00 0.00 54.79 51.97 2mob n ASP 81 Cb 0.63 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 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 -0.41 1.37 3.89 0.44 0.00 -1.26 -4.69 105.19 104.53 2mob n GLY 82 Ca 0.35 0.28 -0.35 0.00 0.00 0.00 0.00 46.02 46.30 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 3.92 0.24 4.61 0.00 -1.26 -4.56 121.76 123.71 2mob s ALA 83 Ca 0.00 -0.71 0.07 0.00 0.00 0.00 0.00 51.96 51.33 2mob s ALA 83 Cb 0.00 -1.93 -0.05 0.00 0.00 0.00 0.00 23.12 21.14 2mob s ALA 83 CO 0.00 0.70 -0.11 -1.50 0.00 0.00 0.00 175.76 174.85 2mob s ILE 84 N -1.22 1.74 0.24 0.00 1.10 -1.06 -5.04 121.20 116.95 2mob s ILE 84 Ca 0.23 -2.19 0.04 0.00 -0.51 0.00 0.00 60.65 58.23 2mob s ILE 84 Cb -0.12 -2.23 -0.05 0.00 0.15 0.00 0.00 42.46 40.21 2mob s ILE 84 CO 0.14 -0.46 -0.02 -0.70 -2.11 0.00 0.00 174.94 171.78 2mob s GLU 85 N -3.67 1.37 0.27 3.50 -6.30 -1.26 -2.31 118.70 110.29 2mob s GLU 85 Ca 0.26 -1.68 0.04 0.00 -2.50 0.00 0.00 54.97 51.08 2mob s GLU 85 Cb 0.01 -0.74 -0.03 0.00 0.00 0.00 0.00 34.13 33.36 2mob s GLU 85 CO 0.09 -0.05 0.21 0.42 0.02 0.00 0.00 175.26 175.95 2mob s ILE 86 N -3.32 0.01 0.28 -3.70 -1.09 -1.06 -4.90 121.20 107.42 2mob s ILE 86 Ca 0.28 -2.00 -0.08 0.00 -2.23 0.00 0.00 60.65 56.62 2mob s ILE 86 Cb 0.05 -2.50 -0.00 0.00 -1.58 0.00 0.00 42.46 38.43 2mob s ILE 86 CO 0.09 0.00 0.45 -1.81 -1.23 0.00 0.00 174.94 172.44 2mob s ASP 87 N -3.28 0.29 0.00 3.58 1.01 -1.26 -2.28 116.67 114.74 2mob s ASP 87 Ca 0.40 -1.19 0.00 0.00 0.71 0.00 0.00 52.55 52.47 2mob s ASP 87 Cb 0.04 0.60 0.00 0.00 1.01 0.00 0.00 42.92 44.58 2mob s ASP 87 CO 0.20 -1.19 0.00 0.00 0.21 0.00 0.00 175.17 174.40 2mob n ALA 88 N -0.44 1.30 -0.33 5.23 0.00 -1.26 -4.79 120.51 120.23 2mob n ALA 88 Ca -0.01 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 2mob n ALA 88 Cb 0.62 0.00 0.32 0.00 0.00 0.00 0.00 19.45 20.40 2mob n ALA 88 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2mob h ALA 89 N 0.00 1.30 -1.01 0.00 0.00 -1.92 1.76 119.26 119.40 2mob h ALA 89 Ca 0.00 0.31 0.23 0.00 0.00 0.00 0.00 54.91 55.45 2mob h ALA 89 Cb 0.00 0.51 -0.11 0.00 0.00 0.00 0.00 17.79 18.20 2mob h ALA 89 CO 0.00 -0.60 0.62 1.49 0.00 0.00 0.00 179.25 180.76 2mob h GLU 90 N 0.04 0.56 -0.59 0.00 4.81 -1.91 0.62 114.58 118.11 2mob h GLU 90 Ca 0.62 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.78 2mob h GLU 90 Cb 1.33 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 30.55 2mob h GLU 90 CO -0.85 0.37 0.22 0.00 -0.73 0.00 0.00 179.01 178.02 2mob h ALA 91 N 1.66 0.76 0.40 2.92 0.00 0.23 -2.65 119.26 122.58 2mob h ALA 91 Ca 0.60 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.31 2mob h ALA 91 Cb 1.20 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.76 2mob h ALA 91 CO -0.37 0.39 -0.19 0.78 0.00 0.00 0.00 179.25 179.86 2mob h GLY 92 N 0.81 -0.56 -1.68 0.00 0.00 0.49 -1.00 103.07 101.14 2mob h GLY 92 Ca 0.19 0.21 0.51 0.00 0.00 0.00 0.00 47.33 48.24 2mob h GLY 92 CO -0.01 -0.20 1.18 -1.84 0.00 0.00 0.00 176.54 175.67 2mob n GLU 93 N -3.64 -0.01 0.00 4.80 0.28 -0.27 0.29 120.64 122.09 2mob n GLU 93 Ca -0.07 1.03 0.00 0.00 -0.16 0.00 0.00 57.16 57.97 2mob n GLU 93 Cb 0.21 -2.29 0.00 0.00 1.43 0.00 0.00 31.44 30.79 2mob n GLU 93 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 2mob n LEU 94 N -3.96 0.24 -0.08 -1.84 0.00 -0.89 -4.62 117.00 105.84 2mob n LEU 94 Ca 0.40 0.60 -0.11 0.00 0.00 0.00 0.00 56.01 56.90 2mob n LEU 94 Cb 1.75 -0.44 -0.06 0.00 0.00 0.00 0.00 43.42 44.67 2mob n LEU 94 CO 0.35 -0.44 -0.25 -0.07 0.00 0.00 0.00 177.39 176.98 2mob h LEU 95 N 0.00 0.00 -1.19 -1.96 4.07 0.60 -3.50 115.31 113.34 2mob h LEU 95 Ca 0.00 -0.31 0.00 0.00 0.08 0.00 0.00 57.88 57.65 2mob h LEU 95 Cb 0.00 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.74 2mob h LEU 95 CO 0.00 1.00 0.00 0.61 -1.08 0.00 0.00 178.44 178.97 2mob n GLY 96 N 1.58 0.47 0.00 0.83 0.00 0.84 -5.00 105.19 103.91 2mob n GLY 96 Ca -0.15 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.60 0.00 -0.15 1.61 5.02 -1.26 -4.95 118.16 117.83 2mob n LYS 97 Ca 0.00 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.32 2mob n LYS 97 Cb 0.30 0.00 0.10 0.00 -0.02 0.00 0.00 35.03 35.40 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 1.66 0.00 1.97 -0.04 -1.26 -4.84 135.00 132.49 2mob n PRO 98 Ca 0.00 -0.78 0.00 0.00 -0.04 0.00 0.00 63.50 62.68 2mob n PRO 98 Cb 0.00 -1.32 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 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 0.12 0.00 0.00 0.54 -1.74 -1.26 -0.47 117.46 114.65 2mob n PHE 99 Ca 0.07 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.96 2mob n PHE 99 Cb 0.27 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.27 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 0.20 5.98 3.41 -1.23 -0.77 113.62 121.21 2mob n SER 100 Ca 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.53 2mob n SER 100 Cb 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 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 -1.00 -3.33 2.07 -1.90 2.80 116.25 114.89 2mob h VAL 101 Ca 0.00 -0.16 0.01 0.00 0.82 0.00 0.00 66.70 67.37 2mob h VAL 101 Cb 0.00 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.72 2mob h VAL 101 CO 0.00 0.00 0.66 0.22 0.02 0.00 0.00 177.57 178.47 2mob h TYR 102 N -0.69 1.25 -0.71 1.57 3.20 0.14 2.04 116.97 123.77 2mob h TYR 102 Ca -0.05 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.80 2mob h TYR 102 Cb 0.40 -0.42 -0.03 0.00 1.54 0.00 0.00 36.73 38.21 2mob h TYR 102 CO 0.07 0.78 0.25 0.22 -1.64 0.00 0.00 178.16 177.85 2mob h ASP 103 N 1.35 0.99 0.28 -2.11 3.58 -1.47 -2.77 116.42 116.27 2mob h ASP 103 Ca 0.37 -0.16 -0.34 0.00 0.42 0.00 0.00 57.03 57.32 2mob h ASP 103 Cb -0.14 -0.26 0.01 0.00 1.72 0.00 0.00 39.33 40.66 2mob h ASP 103 CO -0.08 0.91 -1.63 0.17 -2.88 0.00 0.00 179.24 175.72 2mob h LEU 104 N 1.04 0.62 -1.59 2.28 8.10 0.65 -1.07 115.31 125.35 2mob h LEU 104 Ca 0.23 -0.83 0.06 0.00 0.11 0.00 0.00 57.88 57.46 2mob h LEU 104 Cb 0.25 -0.20 -0.01 0.00 -0.44 0.00 0.00 40.66 40.26 2mob h LEU 104 CO -0.01 1.69 0.56 -0.07 -4.11 0.00 0.00 178.44 176.49 2mob h LEU 105 N 0.11 0.00 0.00 0.17 3.38 0.33 2.73 115.31 122.03 2mob h LEU 105 Ca -0.30 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.44 2mob h LEU 105 Cb 2.10 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.81 2mob h LEU 105 CO 0.20 0.00 -1.86 -0.38 0.09 0.00 0.00 178.44 176.49 2mob n ILE 106 N -3.10 0.87 1.10 1.22 2.08 -1.06 -4.51 119.36 115.96 2mob n ILE 106 Ca 0.04 -0.46 0.12 0.00 0.56 0.00 0.00 62.75 63.00 2mob n ILE 106 Cb 0.66 -0.80 0.15 0.00 -0.75 0.00 0.00 39.64 38.90 2mob n ILE 106 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 2mob n ASN 107 N -2.63 1.90 -0.03 4.38 0.23 -0.31 -4.07 115.26 114.72 2mob n ASN 107 Ca -0.23 -1.44 0.14 0.00 -0.53 0.00 0.00 54.58 52.52 2mob n ASN 107 Cb 0.87 0.27 0.58 0.00 -2.08 0.00 0.00 39.78 39.42 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 0.06 0.00 0.05 3.53 3.14 0.90 -3.95 118.33 122.07 2mob n VAL 108 Ca 0.12 -0.02 0.16 0.00 -2.96 0.00 0.00 64.34 61.64 2mob n VAL 108 Cb 0.45 -0.25 0.32 0.00 -1.06 0.00 0.00 33.84 33.31 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 0.17 0.00 0.00 6.55 0.87 -1.74 0.22 113.55 119.62 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 0.42 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 2mob h SER 109 CO 0.00 0.00 0.07 -1.54 -0.53 0.00 0.00 176.83 174.83 2mob n SER 110 N -2.98 0.00 0.00 6.23 3.41 -1.25 -3.41 113.62 115.62 2mob n SER 110 Ca 0.11 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.87 2mob n SER 110 Cb 1.18 -0.14 0.00 0.00 -0.26 0.00 0.00 64.21 64.99 2mob n SER 110 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2mob n THR 111 N -1.05 0.00 -1.09 6.66 -2.24 0.07 -4.25 114.28 112.38 2mob n THR 111 Ca 0.00 0.72 -0.03 0.00 -2.27 0.00 0.00 64.05 62.47 2mob n THR 111 Cb 0.07 -1.50 -0.01 0.00 -2.10 0.00 0.00 70.33 66.79 2mob n THR 111 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2mob n VAL 112 N -1.43 0.00 0.02 2.28 0.31 -1.22 -4.39 118.33 113.90 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 0.00 -1.07 0.00 0.00 -0.91 0.00 0.00 33.84 31.86 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 0.43 -1.84 3.22 2.92 0.00 -1.26 -5.05 105.19 103.62 2mob n GLY 113 Ca -0.03 0.46 -0.13 0.00 0.00 0.00 0.00 46.02 46.32 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 -1.11 1.11 -0.47 1.61 6.06 -1.16 -4.92 118.95 120.07 2mob s ARG 114 Ca 0.00 -1.55 0.06 0.00 -2.50 0.00 0.00 55.73 51.75 2mob s ARG 114 Cb 0.00 -0.09 0.25 0.00 0.06 0.00 0.00 34.95 35.18 2mob s ARG 114 CO 0.00 -0.21 0.85 0.00 -2.50 0.00 0.00 175.30 173.44 2mob n ALA 115 N -0.23 -0.65 -2.11 6.12 0.00 -1.20 -3.90 120.51 118.54 2mob n ALA 115 Ca -0.05 -1.78 -0.42 0.00 0.00 0.00 0.00 53.44 51.20 2mob n ALA 115 Cb 0.64 -1.23 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 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 0.28 3.26 0.07 0.00 5.04 0.39 -4.69 117.35 121.70 2mob s TYR 116 Ca 0.32 1.11 -0.20 0.00 -2.44 0.00 0.00 57.07 55.85 2mob s TYR 116 Cb 0.23 -3.63 -0.07 0.00 0.35 0.00 0.00 41.96 38.85 2mob s TYR 116 CO -0.20 -2.06 0.60 0.99 -1.34 0.00 0.00 175.55 173.53 2mob s THR 117 N 0.61 4.73 -0.46 4.34 2.01 -1.26 0.13 115.64 125.74 2mob s THR 117 Ca 0.60 1.28 0.03 0.00 0.31 0.00 0.00 61.69 63.92 2mob s THR 117 Cb -0.36 -3.93 0.48 0.00 0.01 0.00 0.00 72.50 68.70 2mob s THR 117 CO 0.34 0.52 1.65 0.18 -0.69 0.00 0.00 174.62 176.62 2mob n LEU 118 N 1.93 6.08 0.00 4.42 4.77 0.35 -4.91 117.00 129.63 2mob n LEU 118 Ca -0.09 -4.28 0.00 0.00 -0.03 0.00 0.00 56.01 51.61 2mob n LEU 118 Cb 0.51 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 2mob n LEU 118 CO 0.42 1.60 0.00 0.61 -1.33 0.00 0.00 177.39 178.69 2mob n GLY 119 N -0.92 0.55 0.01 -0.72 0.00 -1.26 -2.62 105.19 100.23 2mob n GLY 119 Ca 0.51 -0.01 0.01 0.00 0.00 0.00 0.00 46.02 46.54 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 0.15 -3.66 2.61 -2.24 -1.26 -5.05 114.28 104.84 2mob n THR 120 Ca 0.00 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2mob n THR 120 Cb 0.00 -0.05 0.00 0.00 -2.10 0.00 0.00 70.33 68.18 2mob n THR 120 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2mob n LYS 121 N -1.92 2.19 -4.15 -0.78 5.02 -1.08 -3.97 118.16 113.47 2mob n LYS 121 Ca -0.05 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.15 2mob n LYS 121 Cb 0.37 0.00 -0.10 0.00 -0.02 0.00 0.00 35.03 35.28 2mob n LYS 121 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 2mob s PHE 122 N -0.34 0.80 -0.07 2.13 5.36 -0.96 -0.50 117.98 124.39 2mob s PHE 122 Ca 0.00 -1.05 -0.06 0.00 -0.96 0.00 0.00 56.93 54.86 2mob s PHE 122 Cb 0.00 -0.49 0.02 0.00 -0.34 0.00 0.00 43.02 42.21 2mob s PHE 122 CO 0.00 -0.32 0.19 0.99 -1.46 0.00 0.00 175.22 174.62 2mob s THR 123 N -3.82 -0.00 0.07 0.12 2.01 0.34 -2.56 115.64 111.80 2mob s THR 123 Ca 0.14 0.01 0.03 0.00 0.31 0.00 0.00 61.69 62.18 2mob s THR 123 Cb 0.07 -0.27 -0.03 0.00 0.01 0.00 0.00 72.50 72.27 2mob s THR 123 CO -0.04 0.00 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.18 2mob s ILE 124 N 0.18 0.72 0.19 1.82 1.09 -0.98 0.15 121.20 124.37 2mob s ILE 124 Ca -0.01 -1.49 -0.03 0.00 -1.10 0.00 0.00 60.65 58.02 2mob s ILE 124 Cb -0.02 -1.15 0.01 0.00 -1.06 0.00 0.00 42.46 40.24 2mob s ILE 124 CO -0.00 -0.57 0.30 1.07 -0.10 0.00 0.00 174.94 175.64 2mob n THR 125 N 0.77 0.00 0.00 2.92 5.66 -1.25 -2.55 114.28 119.82 2mob n THR 125 Ca -0.18 -0.79 0.00 0.00 -3.05 0.00 0.00 64.05 60.03 2mob n THR 125 Cb 0.57 0.55 0.00 0.00 -1.55 0.00 0.00 70.33 69.90 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 -1.67 0.00 -4.64 1.09 3.41 -1.26 -2.99 113.62 107.56 2mob n SER 126 Ca -0.01 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.21 2mob n SER 126 Cb 0.31 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.18 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 4.12 0.00 4.33 2.02 -1.26 -4.48 118.70 123.44 2mob s GLU 127 Ca 0.00 0.26 0.00 0.00 0.02 0.00 0.00 54.97 55.25 2mob s GLU 127 Cb 0.00 -3.59 0.00 0.00 0.10 0.00 0.00 34.13 30.64 2mob s GLU 127 CO 0.00 -0.19 0.00 1.28 0.02 0.00 0.00 175.26 176.37