#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmo n HIS 2 N 0.00 1.75 -0.78 1.61 -0.00 -1.26 -4.98 115.22 111.56 2jmo n HIS 2 Ca 0.00 -0.68 -0.30 0.00 -0.00 0.00 0.00 57.72 56.74 2jmo n HIS 2 Cb 0.00 -0.38 0.26 0.00 -0.00 0.00 0.00 29.99 29.87 2jmo n HIS 2 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 2jmo s MET 3 N -2.32 -1.76 0.00 -1.40 1.00 -1.26 -5.06 119.30 108.50 2jmo s MET 3 Ca 0.53 0.11 0.00 0.00 0.00 0.00 0.00 55.69 56.32 2jmo s MET 3 Cb 0.37 -1.52 0.00 0.00 0.00 0.00 0.00 34.83 33.68 2jmo s MET 3 CO 0.20 -4.10 0.00 0.41 0.00 0.00 0.00 175.02 171.53 2jmo n GLY 4 N 0.04 2.05 3.29 -0.03 0.00 -1.26 -5.14 105.19 104.14 2jmo n GLY 4 Ca 0.12 -0.93 -0.34 0.00 0.00 0.00 0.00 46.02 44.87 2jmo n GLY 4 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2jmo s GLU 5 N -2.00 3.28 -0.14 1.61 -1.05 -1.26 -4.98 118.70 114.16 2jmo s GLU 5 Ca 0.00 -0.71 0.15 0.00 -0.15 0.00 0.00 54.97 54.27 2jmo s GLU 5 Cb 0.00 -2.72 0.48 0.00 -0.44 0.00 0.00 34.13 31.45 2jmo s GLU 5 CO 0.00 -0.01 1.39 0.39 0.95 0.00 0.00 175.26 177.98 2jmo n GLU 6 N 4.17 2.92 -1.23 -4.83 1.02 -1.26 -5.03 120.64 116.40 2jmo n GLU 6 Ca -0.19 -2.68 -0.30 0.00 -0.02 0.00 0.00 57.16 53.97 2jmo n GLU 6 Cb 0.52 -1.73 0.12 0.00 -0.02 0.00 0.00 31.44 30.33 2jmo n GLU 6 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2jmo s GLN 7 N -2.46 1.59 0.08 3.49 1.11 -1.26 -5.07 119.66 117.15 2jmo s GLN 7 Ca 0.38 0.93 0.07 0.00 0.01 0.00 0.00 55.36 56.76 2jmo s GLN 7 Cb 0.30 -1.84 -0.03 0.00 -1.01 0.00 0.00 33.01 30.43 2jmo s GLN 7 CO 0.10 -2.04 -0.19 -0.47 0.01 0.00 0.00 175.29 172.70 2jmo s TYR 8 N -2.93 1.65 0.32 0.91 6.14 -1.26 -5.11 117.35 117.07 2jmo s TYR 8 Ca 0.63 -0.41 -0.29 0.00 0.64 0.00 0.00 57.07 57.63 2jmo s TYR 8 Cb -0.18 -0.92 -0.12 0.00 0.42 0.00 0.00 41.96 41.16 2jmo s TYR 8 CO 0.57 0.15 1.51 0.09 0.64 0.00 0.00 175.55 178.51 2jmo n ASN 9 N 1.29 3.62 -4.43 4.32 3.02 -1.26 -4.94 115.26 116.89 2jmo n ASN 9 Ca -0.19 1.18 -0.32 0.00 -0.03 0.00 0.00 54.58 55.21 2jmo n ASN 9 Cb 0.54 -1.57 0.14 0.00 -0.61 0.00 0.00 39.78 38.27 2jmo n ASN 9 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2jmo n ARG 10 N 1.47 -0.55 -1.65 3.52 5.12 -1.26 -4.86 116.66 118.46 2jmo n ARG 10 Ca 0.06 -0.12 -0.42 0.00 -1.93 0.00 0.00 57.85 55.44 2jmo n ARG 10 Cb 0.37 -1.90 0.00 0.00 -1.16 0.00 0.00 32.46 29.77 2jmo n ARG 10 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2jmo n TYR 11 N -3.82 1.72 -0.07 -1.55 4.01 -1.26 -4.91 117.16 111.28 2jmo n TYR 11 Ca 0.06 0.57 -0.14 0.00 -0.16 0.00 0.00 57.90 58.24 2jmo n TYR 11 Cb 0.55 -2.32 -0.06 0.00 -0.31 0.00 0.00 39.34 37.20 2jmo n TYR 11 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 2jmo h GLN 12 N 2.02 0.52 -6.83 -0.72 1.08 -2.04 -3.45 115.11 105.70 2jmo h GLN 12 Ca -0.45 -0.30 -0.55 0.00 -1.45 0.00 0.00 58.65 55.89 2jmo h GLN 12 Cb 1.31 0.02 0.18 0.00 -0.05 0.00 0.00 27.48 28.95 2jmo h GLN 12 CO 0.60 0.90 -0.15 1.04 -0.95 0.00 0.00 178.83 180.27 2jmo n GLN 13 N -4.38 0.33 -0.09 1.46 6.02 -1.26 -4.96 117.38 114.50 2jmo n GLN 13 Ca -0.06 0.16 -0.23 0.00 -0.01 0.00 0.00 57.00 56.87 2jmo n GLN 13 Cb 0.45 -2.04 -0.12 0.00 1.02 0.00 0.00 30.24 29.55 2jmo n GLN 13 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 2jmo n TYR 14 N -2.60 0.72 0.00 1.08 4.01 -1.26 -5.05 117.16 114.07 2jmo n TYR 14 Ca 0.11 0.24 0.00 0.00 -0.16 0.00 0.00 57.90 58.09 2jmo n TYR 14 Cb 0.50 -1.08 0.00 0.00 -0.31 0.00 0.00 39.34 38.45 2jmo n TYR 14 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jmo n GLY 15 N 1.65 0.71 3.78 2.72 0.00 -1.26 -5.10 105.19 107.68 2jmo n GLY 15 Ca -0.39 -0.14 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 2jmo n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jmo s ALA 16 N -0.67 2.94 -0.35 4.61 0.00 -1.26 -5.02 121.76 122.01 2jmo s ALA 16 Ca 0.00 0.85 0.01 0.00 0.00 0.00 0.00 51.96 52.82 2jmo s ALA 16 Cb 0.00 -3.35 0.09 0.00 0.00 0.00 0.00 23.12 19.86 2jmo s ALA 16 CO 0.00 -0.57 0.07 -1.21 0.00 0.00 0.00 175.76 174.05 2jmo s GLU 17 N -2.80 1.84 0.15 0.00 2.02 -1.26 -5.08 118.70 113.57 2jmo s GLU 17 Ca 0.64 -1.73 -0.33 0.00 0.02 0.00 0.00 54.97 53.58 2jmo s GLU 17 Cb -0.26 -3.29 -0.13 0.00 0.10 0.00 0.00 34.13 30.56 2jmo s GLU 17 CO 0.31 -0.90 1.67 -0.85 0.02 0.00 0.00 175.26 175.51 2jmo n GLU 18 N 4.42 2.38 -4.02 1.61 0.28 -1.26 -4.97 120.64 119.08 2jmo n GLU 18 Ca -0.02 0.86 -0.31 0.00 -0.16 0.00 0.00 57.16 57.53 2jmo n GLU 18 Cb 0.42 -2.67 -0.15 0.00 1.43 0.00 0.00 31.44 30.47 2jmo n GLU 18 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2jmo n VAL 20 N 4.49 -2.88 -3.84 0.00 0.31 -1.26 -4.67 118.33 110.48 2jmo n VAL 20 Ca -0.12 -0.10 -0.36 0.00 -0.01 0.00 0.00 64.34 63.75 2jmo n VAL 20 Cb 0.43 -3.66 -0.13 0.00 -0.91 0.00 0.00 33.84 29.57 2jmo n VAL 20 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2jmo s LEU 21 N -5.64 4.32 -0.23 7.52 1.43 -1.26 -4.75 118.68 120.06 2jmo s LEU 21 Ca 0.32 -1.41 0.05 0.00 -1.03 0.00 0.00 54.13 52.06 2jmo s LEU 21 Cb -0.14 -1.78 -0.17 0.00 0.03 0.00 0.00 46.19 44.12 2jmo s LEU 21 CO 0.55 -0.34 -0.16 1.67 0.23 0.00 0.00 176.35 178.30 2jmo n GLN 22 N 4.67 0.67 -0.13 1.70 7.27 -1.26 -4.55 117.38 125.75 2jmo n GLN 22 Ca -0.10 0.11 0.08 0.00 0.07 0.00 0.00 57.00 57.15 2jmo n GLN 22 Cb 0.43 -1.48 0.14 0.00 2.41 0.00 0.00 30.24 31.73 2jmo n GLN 22 CO 0.00 0.00 0.00 -1.33 0.07 0.00 0.00 177.06 175.80 2jmo n MET 23 N -3.11 1.96 -1.21 3.69 2.81 -1.26 -5.05 117.12 114.96 2jmo n MET 23 Ca -0.40 -2.40 -0.52 0.00 -1.81 0.00 0.00 57.70 52.56 2jmo n MET 23 Cb 0.99 -1.46 -0.09 0.00 -0.71 0.00 0.00 33.22 31.95 2jmo n MET 23 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jmo n GLY 24 N -1.01 -0.00 0.00 3.03 0.00 -1.26 -4.51 105.19 101.44 2jmo n GLY 24 Ca 0.14 0.88 0.00 0.00 0.00 0.00 0.00 46.02 47.04 2jmo n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jmo n GLY 25 N 4.88 2.35 2.73 -0.02 0.00 -1.26 -4.98 105.19 108.89 2jmo n GLY 25 Ca 0.36 -1.09 -0.20 0.00 0.00 0.00 0.00 46.02 45.10 2jmo n GLY 25 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jmo s VAL 26 N 0.00 0.09 -0.43 1.61 1.01 -1.25 -5.00 120.40 116.43 2jmo s VAL 26 Ca 0.00 0.26 -0.24 0.00 0.00 0.00 0.00 61.98 61.99 2jmo s VAL 26 Cb 0.00 -0.28 0.02 0.00 0.00 0.00 0.00 36.38 36.12 2jmo s VAL 26 CO 0.00 0.19 0.87 -0.76 0.00 0.00 0.00 175.10 175.40 2jmo s LEU 27 N 1.83 4.09 0.14 3.92 2.01 -1.26 -4.03 118.68 125.37 2jmo s LEU 27 Ca 0.01 0.16 -0.34 0.00 0.01 0.00 0.00 54.13 53.97 2jmo s LEU 27 Cb -0.12 -3.12 -0.15 0.00 0.01 0.00 0.00 46.19 42.81 2jmo s LEU 27 CO -0.03 -0.94 1.43 0.00 1.01 0.00 0.00 176.35 177.82 2jmo n PRO 29 N 2.78 0.19 -1.39 0.00 -0.04 -1.26 -4.38 135.00 130.90 2jmo n PRO 29 Ca 0.17 0.16 -0.35 0.00 -0.04 0.00 0.00 63.50 63.43 2jmo n PRO 29 Cb 0.25 -1.50 0.10 0.00 -0.04 0.00 0.00 33.50 32.31 2jmo n PRO 29 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2jmo n ARG 30 N -1.31 0.59 -0.02 0.54 3.00 -1.25 -4.95 116.66 113.26 2jmo n ARG 30 Ca 0.07 0.27 -0.13 0.00 -0.01 0.00 0.00 57.85 58.04 2jmo n ARG 30 Cb 0.12 -2.42 -0.09 0.00 0.00 0.00 0.00 32.46 30.07 2jmo n ARG 30 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.63 176.63 2jmo h PRO 31 N -0.24 0.08 0.08 5.56 0.13 -2.03 -3.36 132.00 132.22 2jmo h PRO 31 Ca -0.48 -0.04 -0.35 0.00 -0.87 0.00 0.00 66.00 64.25 2jmo h PRO 31 Cb 1.32 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.42 2jmo h PRO 31 CO 0.49 0.54 -2.00 0.41 -0.23 0.00 0.00 178.00 177.21 2jmo n GLY 32 N 0.21 -0.64 3.88 1.56 0.00 -1.26 -4.92 105.19 104.01 2jmo n GLY 32 Ca -0.08 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.41 2jmo n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jmo n GLY 34 N -0.98 0.91 2.27 0.00 0.00 -1.26 -3.83 105.19 102.30 2jmo n GLY 34 Ca 0.01 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.95 2jmo n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jmo n ALA 35 N -0.18 -0.66 0.00 4.61 0.00 -1.26 0.11 120.51 123.13 2jmo n ALA 35 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.40 2jmo n ALA 35 Cb 0.03 -0.71 0.00 0.00 0.00 0.00 0.00 19.45 18.77 2jmo n ALA 35 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jmo n GLY 36 N -0.48 -0.33 3.21 0.00 0.00 -1.26 -4.35 105.19 101.98 2jmo n GLY 36 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2jmo n GLY 36 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2jmo n LEU 37 N -1.33 -2.00 -4.36 0.99 -0.00 -1.26 -4.62 117.00 104.42 2jmo n LEU 37 Ca 0.00 -0.24 -0.39 0.00 -0.00 0.00 0.00 56.01 55.38 2jmo n LEU 37 Cb 0.16 -0.91 -0.12 0.00 -0.00 0.00 0.00 43.42 42.56 2jmo n LEU 37 CO 0.00 -3.20 -0.22 -0.22 -0.00 0.00 0.00 177.39 173.75 2jmo s LEU 38 N -1.38 4.29 0.67 1.47 1.98 -1.26 -3.87 118.68 120.58 2jmo s LEU 38 Ca 0.52 -0.85 -0.15 0.00 -2.89 0.00 0.00 54.13 50.76 2jmo s LEU 38 Cb -0.10 -1.95 0.00 0.00 0.66 0.00 0.00 46.19 44.80 2jmo s LEU 38 CO 0.58 -0.28 1.11 -2.16 -1.89 0.00 0.00 176.35 173.70 2jmo s PRO 39 N 1.52 2.76 0.88 0.98 0.04 -1.26 -4.94 135.00 134.99 2jmo s PRO 39 Ca 0.02 1.38 -0.14 0.00 0.04 0.00 0.00 61.00 62.30 2jmo s PRO 39 Cb -0.18 -1.95 0.01 0.00 0.04 0.00 0.00 34.50 32.42 2jmo s PRO 39 CO 0.05 -1.28 0.44 -0.85 0.04 0.00 0.00 177.00 175.40 2jmo n GLU 40 N -2.49 -0.10 0.00 4.56 0.00 -1.26 -4.72 120.64 116.63 2jmo n GLU 40 Ca 0.10 0.02 0.00 0.00 0.00 0.00 0.00 57.16 57.28 2jmo n GLU 40 Cb 0.52 -1.85 0.00 0.00 0.00 0.00 0.00 31.44 30.11 2jmo n GLU 40 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 2jmo n PRO 41 N -1.39 0.49 -3.60 3.44 -0.04 -1.26 -4.33 135.00 128.30 2jmo n PRO 41 Ca 0.08 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.25 2jmo n PRO 41 Cb 0.52 -1.07 -0.15 0.00 -0.04 0.00 0.00 33.50 32.76 2jmo n PRO 41 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2jmo s ASP 42 N -1.21 3.38 0.35 3.54 1.01 -1.26 -4.69 116.67 117.79 2jmo s ASP 42 Ca 0.00 -1.20 0.15 0.00 0.71 0.00 0.00 52.55 52.21 2jmo s ASP 42 Cb 0.00 -0.44 0.84 0.00 1.01 0.00 0.00 42.92 44.32 2jmo s ASP 42 CO 0.00 -0.41 1.39 0.06 0.21 0.00 0.00 175.17 176.42 2jmo h GLN 43 N 8.34 0.00 -0.63 8.23 -0.00 -1.93 -3.04 115.11 126.08 2jmo h GLN 43 Ca -0.18 0.00 0.12 0.00 -0.00 0.00 0.00 58.65 58.59 2jmo h GLN 43 Cb 1.04 0.00 -0.12 0.00 -0.00 0.00 0.00 27.48 28.41 2jmo h GLN 43 CO 0.41 0.00 -0.17 0.54 -0.00 0.00 0.00 178.83 179.61 2jmo n ARG 44 N -2.14 -0.07 -3.35 0.06 1.74 -1.26 -4.09 116.66 107.55 2jmo n ARG 44 Ca -0.01 0.98 -0.03 0.00 -0.77 0.00 0.00 57.85 58.02 2jmo n ARG 44 Cb 0.29 -1.46 -0.05 0.00 -1.02 0.00 0.00 32.46 30.22 2jmo n ARG 44 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 2jmo s LYS 45 N -5.76 0.46 -0.11 5.56 2.20 -1.15 -5.08 119.74 115.86 2jmo s LYS 45 Ca -0.09 0.92 -0.02 0.00 -0.36 0.00 0.00 55.97 56.42 2jmo s LYS 45 Cb 0.16 0.23 0.04 0.00 -1.51 0.00 0.00 37.83 36.75 2jmo s LYS 45 CO 0.48 -0.52 0.01 0.14 -0.36 0.00 0.00 175.35 175.11 2jmo s VAL 46 N 2.73 0.43 -0.24 4.02 -7.23 -1.26 -4.83 120.40 114.03 2jmo s VAL 46 Ca 0.11 -0.10 -0.16 0.00 -1.81 0.00 0.00 61.98 60.02 2jmo s VAL 46 Cb -0.14 -0.70 -0.04 0.00 0.56 0.00 0.00 36.38 36.06 2jmo s VAL 46 CO -0.18 0.11 0.41 -0.89 -0.31 0.00 0.00 175.10 174.24 2jmo s THR 47 N 1.93 5.17 0.31 5.32 2.01 -1.26 -1.77 115.64 127.35 2jmo s THR 47 Ca 0.03 0.69 0.26 0.00 0.31 0.00 0.00 61.69 62.98 2jmo s THR 47 Cb -0.14 -3.74 0.26 0.00 0.01 0.00 0.00 72.50 68.90 2jmo s THR 47 CO -0.06 0.19 1.77 0.00 -0.69 0.00 0.00 174.62 175.82 2jmo n GLU 49 N -2.56 -4.03 0.00 0.00 1.02 -1.26 -4.51 120.64 109.31 2jmo n GLU 49 Ca -0.02 -1.19 0.00 0.00 -0.02 0.00 0.00 57.16 55.94 2jmo n GLU 49 Cb 0.25 -1.92 0.00 0.00 -0.02 0.00 0.00 31.44 29.74 2jmo n GLU 49 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jmo n GLY 50 N 1.78 0.08 7.00 0.62 0.00 -1.08 -4.91 105.19 108.68 2jmo n GLY 50 Ca 0.10 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.83 2jmo n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jmo n GLY 51 N 0.00 1.70 0.39 -0.02 0.00 -1.26 -2.82 105.19 103.19 2jmo n GLY 51 Ca 0.00 -0.51 -0.18 0.00 0.00 0.00 0.00 46.02 45.33 2jmo n GLY 51 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2jmo h ASN 52 N 8.63 -0.89 0.00 1.61 -0.73 -1.98 -3.44 115.58 118.79 2jmo h ASN 52 Ca 0.00 0.05 0.00 0.00 1.87 0.00 0.00 56.30 58.22 2jmo h ASN 52 Cb 0.00 0.25 0.00 0.00 0.27 0.00 0.00 38.32 38.84 2jmo h ASN 52 CO 0.00 -0.57 0.00 0.61 -0.37 0.00 0.00 177.43 177.10 2jmo n GLY 53 N -1.50 0.00 3.81 1.57 0.00 -1.22 -5.17 105.19 102.69 2jmo n GLY 53 Ca -0.13 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 2jmo n GLY 53 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jmo s LEU 54 N 0.00 3.51 0.00 0.99 2.01 -1.13 -5.02 118.68 119.05 2jmo s LEU 54 Ca 0.00 -0.56 0.00 0.00 0.01 0.00 0.00 54.13 53.58 2jmo s LEU 54 Cb 0.00 -2.08 0.00 0.00 0.01 0.00 0.00 46.19 44.12 2jmo s LEU 54 CO 0.00 -0.31 0.00 0.61 1.01 0.00 0.00 176.35 177.66 2jmo n GLY 55 N -1.29 -0.90 0.13 -3.19 0.00 -1.26 -2.62 105.19 96.06 2jmo n GLY 55 Ca -0.03 0.92 -0.21 0.00 0.00 0.00 0.00 46.02 46.70 2jmo n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jmo n GLY 57 N 1.73 0.97 2.79 0.00 0.00 -1.26 -5.07 105.19 104.35 2jmo n GLY 57 Ca -0.22 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 2jmo n GLY 57 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jmo s PHE 58 N -2.00 1.74 1.00 1.61 2.19 -1.26 -5.07 117.98 116.20 2jmo s PHE 58 Ca 0.00 -1.55 -0.13 0.00 0.33 0.00 0.00 56.93 55.58 2jmo s PHE 58 Cb 0.00 -1.55 0.12 0.00 -1.31 0.00 0.00 43.02 40.28 2jmo s PHE 58 CO 0.00 -0.78 0.64 0.00 1.83 0.00 0.00 175.22 176.90 2jmo n ALA 59 N 4.84 -2.41 -4.37 11.12 0.00 -1.26 -4.50 120.51 123.94 2jmo n ALA 59 Ca -0.06 -0.80 -0.25 0.00 0.00 0.00 0.00 53.44 52.33 2jmo n ALA 59 Cb 0.44 -1.89 -0.08 0.00 0.00 0.00 0.00 19.45 17.92 2jmo n ALA 59 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 2jmo n PHE 60 N -4.14 -0.44 -3.70 0.00 -1.74 -0.73 -3.93 117.46 102.78 2jmo n PHE 60 Ca 0.07 -2.80 -0.38 0.00 -0.56 0.00 0.00 57.45 53.78 2jmo n PHE 60 Cb 0.55 0.18 -0.12 0.00 1.52 0.00 0.00 39.48 41.61 2jmo n PHE 60 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2jmo h ARG 62 N 8.27 0.00 -0.17 0.00 0.11 -1.86 2.87 114.38 123.60 2jmo h ARG 62 Ca -0.23 0.00 -0.15 0.00 0.10 0.00 0.00 59.98 59.70 2jmo h ARG 62 Cb 1.08 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.17 2jmo h ARG 62 CO 0.65 0.00 -0.47 1.49 0.10 0.00 0.00 179.97 181.74 2jmo h GLU 63 N 0.00 0.63 -0.07 0.08 4.81 -1.92 -3.29 114.58 114.82 2jmo h GLU 63 Ca 0.00 -0.44 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 2jmo h GLU 63 Cb 0.17 0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.62 2jmo h GLU 63 CO 0.00 1.06 0.00 0.00 -0.73 0.00 0.00 179.01 179.34 2jmo n LYS 65 N -0.46 -2.49 -4.63 0.00 2.85 0.96 -4.86 118.16 109.52 2jmo n LYS 65 Ca 0.05 0.03 -0.28 0.00 -1.05 0.00 0.00 58.31 57.06 2jmo n LYS 65 Cb 0.37 -4.41 -0.10 0.00 -0.65 0.00 0.00 35.03 30.23 2jmo n LYS 65 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2jmo s GLU 66 N -5.30 1.98 0.24 -1.58 0.41 -1.02 -4.86 118.70 108.57 2jmo s GLU 66 Ca 0.16 -2.17 -0.31 0.00 -0.41 0.00 0.00 54.97 52.25 2jmo s GLU 66 Cb -0.10 -1.44 -0.14 0.00 -1.78 0.00 0.00 34.13 30.68 2jmo s GLU 66 CO 0.20 -0.18 1.31 0.00 -0.49 0.00 0.00 175.26 176.10 2jmo n ALA 67 N -1.01 0.60 -1.56 5.21 0.00 -1.26 -0.59 120.51 121.90 2jmo n ALA 67 Ca -0.09 0.42 -0.51 0.00 0.00 0.00 0.00 53.44 53.26 2jmo n ALA 67 Cb 0.67 -2.20 -0.06 0.00 0.00 0.00 0.00 19.45 17.86 2jmo n ALA 67 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 2jmo n TYR 68 N 1.53 1.89 0.16 0.00 4.19 -1.25 -4.66 117.16 119.01 2jmo n TYR 68 Ca 0.12 0.24 0.10 0.00 3.31 0.00 0.00 57.90 61.66 2jmo n TYR 68 Cb 0.30 -2.56 0.08 0.00 0.49 0.00 0.00 39.34 37.65 2jmo n TYR 68 CO 0.00 0.00 0.00 1.12 0.91 0.00 0.00 176.86 178.89 2jmo h HIS 69 N 10.79 0.00 -5.39 2.98 -0.00 -1.94 -3.48 115.15 118.11 2jmo h HIS 69 Ca -0.37 0.00 -0.32 0.00 -0.00 0.00 0.00 60.37 59.68 2jmo h HIS 69 Cb 1.30 0.00 0.15 0.00 -0.00 0.00 0.00 27.41 28.87 2jmo h HIS 69 CO 0.90 0.11 -0.69 -1.91 -0.00 0.00 0.00 177.93 176.34 2jmo n GLU 70 N -2.97 -6.38 0.04 5.12 2.13 -1.26 -4.78 120.64 112.55 2jmo n GLU 70 Ca 0.01 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.61 2jmo n GLU 70 Cb 0.59 -5.61 0.00 0.00 0.27 0.00 0.00 31.44 26.69 2jmo n GLU 70 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jmo n GLY 71 N -1.28 -1.87 0.00 8.31 0.00 -1.26 -5.16 105.19 103.92 2jmo n GLY 71 Ca -0.21 0.55 0.00 0.00 0.00 0.00 0.00 46.02 46.36 2jmo n GLY 71 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jmo n GLU 72 N -2.43 0.00 0.27 1.61 -0.58 -1.26 -4.97 120.64 113.28 2jmo n GLU 72 Ca 0.00 0.00 0.16 0.00 -0.42 0.00 0.00 57.16 56.90 2jmo n GLU 72 Cb 0.00 0.00 0.75 0.00 -0.57 0.00 0.00 31.44 31.62 2jmo n GLU 72 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jmo n SER 74 N -3.06 0.07 -4.25 0.00 7.64 -1.26 -4.71 113.62 108.05 2jmo n SER 74 Ca 0.01 -1.80 -0.32 0.00 1.01 0.00 0.00 58.87 57.77 2jmo n SER 74 Cb 0.49 -0.03 -0.17 0.00 -1.01 0.00 0.00 64.21 63.49 2jmo n SER 74 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jmo s ALA 75 N -1.93 2.18 -0.06 -0.43 0.00 0.36 -5.13 121.76 116.75 2jmo s ALA 75 Ca 0.00 -1.01 -0.00 0.00 0.00 0.00 0.00 51.96 50.94 2jmo s ALA 75 Cb 0.00 -0.74 -0.03 0.00 0.00 0.00 0.00 23.12 22.35 2jmo s ALA 75 CO 0.00 0.36 -0.02 0.08 0.00 0.00 0.00 175.76 176.19 2jmo s VAL 76 N 0.05 4.12 -0.48 0.00 1.01 -1.26 -4.89 120.40 118.95 2jmo s VAL 76 Ca -0.10 -0.40 -0.27 0.00 0.00 0.00 0.00 61.98 61.21 2jmo s VAL 76 Cb -0.16 -2.75 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 2jmo s VAL 76 CO 0.06 0.54 1.99 0.12 0.00 0.00 0.00 175.10 177.81 2jmo s PHE 77 N -0.92 1.53 -0.32 5.22 2.19 -1.26 -4.94 117.98 119.48 2jmo s PHE 77 Ca 0.15 0.91 -0.25 0.00 0.33 0.00 0.00 56.93 58.06 2jmo s PHE 77 Cb -0.11 -3.97 0.01 0.00 -1.31 0.00 0.00 43.02 37.63 2jmo s PHE 77 CO 0.04 -2.65 0.86 -1.83 1.83 0.00 0.00 175.22 173.47 2jmo s GLU 78 N 6.90 3.95 0.20 10.12 1.03 -1.26 -5.03 118.70 134.61 2jmo s GLU 78 Ca 0.80 0.66 -0.26 0.00 0.03 0.00 0.00 54.97 56.20 2jmo s GLU 78 Cb -0.18 -3.75 -0.08 0.00 -0.80 0.00 0.00 34.13 29.32 2jmo s GLU 78 CO 0.26 -0.77 0.83 0.00 -1.33 0.00 0.00 175.26 174.25 2jmo s ALA 79 N 3.18 3.40 -2.00 -0.84 0.00 -1.26 -5.35 121.76 118.89 2jmo s ALA 79 Ca 0.36 0.42 0.19 0.00 0.00 0.00 0.00 51.96 52.93 2jmo s ALA 79 Cb -0.13 -3.03 1.14 0.00 0.00 0.00 0.00 23.12 21.11 2jmo s ALA 79 CO 0.14 0.27 1.54 0.43 0.00 0.00 0.00 175.76 178.13