#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmc s ALA 2 N 0.00 1.97 0.39 4.61 0.00 -1.26 -4.96 121.76 122.52 2jmc s ALA 2 Ca 0.00 -1.65 -0.25 0.00 0.00 0.00 0.00 51.96 50.06 2jmc s ALA 2 Cb 0.00 -4.53 -0.09 0.00 0.00 0.00 0.00 23.12 18.50 2jmc s ALA 2 CO 0.00 -4.44 1.11 0.00 0.00 0.00 0.00 175.76 172.44 2jmc s MET 3 N 6.47 4.12 0.45 0.00 0.00 -1.26 -5.05 119.30 124.03 2jmc s MET 3 Ca 0.63 1.69 0.08 0.00 0.00 0.00 0.00 55.69 58.10 2jmc s MET 3 Cb -0.05 -2.64 0.02 0.00 0.00 0.00 0.00 34.83 32.15 2jmc s MET 3 CO -0.02 -0.22 0.55 0.20 0.00 0.00 0.00 175.02 175.53 2jmc s GLY 4 N -1.31 1.99 0.39 3.16 0.00 -1.26 -5.02 107.32 105.26 2jmc s GLY 4 Ca 0.57 -1.78 0.18 0.00 0.00 0.00 0.00 44.72 43.68 2jmc s GLY 4 CO 0.34 -1.60 1.80 -0.56 0.00 0.00 0.00 173.10 173.08 2jmc h PRO 5 N 0.68 0.00 -4.11 2.90 0.13 -1.96 -3.39 132.00 126.24 2jmc h PRO 5 Ca -0.39 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.11 2jmc h PRO 5 Cb 1.28 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 32.01 2jmc h PRO 5 CO 0.48 0.36 -0.73 1.03 -0.23 0.00 0.00 178.00 178.91 2jmc s ARG 6 N -3.86 1.24 -0.20 0.86 0.52 -1.26 -4.99 118.95 111.25 2jmc s ARG 6 Ca -0.01 -1.67 0.01 0.00 -0.52 0.00 0.00 55.73 53.54 2jmc s ARG 6 Cb 0.12 -2.75 0.03 0.00 0.52 0.00 0.00 34.95 32.87 2jmc s ARG 6 CO 0.69 -0.98 -0.17 -1.21 0.02 0.00 0.00 175.30 173.65 2jmc s GLU 7 N 1.03 2.82 -0.18 3.54 2.02 -1.26 0.21 118.70 126.89 2jmc s GLU 7 Ca 0.11 -0.95 -0.07 0.00 0.02 0.00 0.00 54.97 54.08 2jmc s GLU 7 Cb -0.19 -2.67 -0.04 0.00 0.10 0.00 0.00 34.13 31.32 2jmc s GLU 7 CO -0.13 -0.30 0.07 0.54 0.02 0.00 0.00 175.26 175.46 2jmc s VAL 8 N 1.25 4.83 -0.10 2.63 0.11 0.20 -4.70 120.40 124.62 2jmc s VAL 8 Ca 0.02 -0.02 0.02 0.00 -2.93 0.00 0.00 61.98 59.06 2jmc s VAL 8 Cb -0.15 -3.17 0.02 0.00 -1.53 0.00 0.00 36.38 31.55 2jmc s VAL 8 CO -0.11 0.47 -0.14 0.42 -3.33 0.00 0.00 175.10 172.41 2jmc s THR 9 N 0.31 1.36 0.08 5.04 -4.23 -1.26 0.91 115.64 117.85 2jmc s THR 9 Ca 0.04 -0.56 -0.22 0.00 -1.18 0.00 0.00 61.69 59.76 2jmc s THR 9 Cb -0.12 -1.25 -0.07 0.00 1.34 0.00 0.00 72.50 72.40 2jmc s THR 9 CO 0.00 0.41 0.67 -0.04 -0.54 0.00 0.00 174.62 175.13 2jmc s MET 10 N 0.97 4.39 -0.05 3.99 -1.94 -0.97 -4.89 119.30 120.79 2jmc s MET 10 Ca -0.08 0.93 0.04 0.00 -1.71 0.00 0.00 55.69 54.87 2jmc s MET 10 Cb -0.15 -3.29 -0.02 0.00 2.01 0.00 0.00 34.83 33.38 2jmc s MET 10 CO -0.01 0.50 -0.15 0.21 -0.01 0.00 0.00 175.02 175.56 2jmc s LYS 11 N -0.75 2.53 -0.18 2.03 2.20 -1.26 -1.36 119.74 122.95 2jmc s LYS 11 Ca 0.33 -0.72 -0.28 0.00 -0.36 0.00 0.00 55.97 54.94 2jmc s LYS 11 Cb -0.21 -2.36 -0.06 0.00 -1.51 0.00 0.00 37.83 33.69 2jmc s LYS 11 CO 0.22 0.59 2.19 1.17 -0.36 0.00 0.00 175.35 179.15 2jmc n LYS 12 N 2.41 2.11 -0.41 4.03 4.81 -1.25 -1.42 118.16 128.43 2jmc n LYS 12 Ca -0.17 0.62 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 2jmc n LYS 12 Cb 0.52 -3.20 0.00 0.00 0.02 0.00 0.00 35.03 32.37 2jmc n LYS 12 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2jmc n GLY 13 N 5.57 1.18 3.58 3.14 0.00 0.56 -5.01 105.19 114.22 2jmc n GLY 13 Ca 0.28 -0.28 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 2jmc n GLY 13 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jmc s ASP 14 N -2.28 4.28 -0.34 1.61 2.15 -0.51 -4.90 116.67 116.69 2jmc s ASP 14 Ca 0.00 -0.64 -0.07 0.00 0.43 0.00 0.00 52.55 52.27 2jmc s ASP 14 Cb 0.00 -0.72 0.04 0.00 -0.30 0.00 0.00 42.92 41.93 2jmc s ASP 14 CO 0.00 0.07 0.11 -0.63 -0.17 0.00 0.00 175.17 174.55 2jmc s ILE 15 N -1.97 3.87 -0.13 4.11 1.01 -1.26 -0.53 121.20 126.31 2jmc s ILE 15 Ca 0.27 -1.07 -0.01 0.00 0.00 0.00 0.00 60.65 59.85 2jmc s ILE 15 Cb -0.08 -3.17 -0.02 0.00 0.01 0.00 0.00 42.46 39.20 2jmc s ILE 15 CO 0.17 -0.16 -0.10 -0.76 0.00 0.00 0.00 174.94 174.09 2jmc s LEU 16 N 1.42 2.91 0.07 2.97 1.02 -1.04 -4.95 118.68 121.09 2jmc s LEU 16 Ca -0.01 -0.24 -0.37 0.00 0.02 0.00 0.00 54.13 53.54 2jmc s LEU 16 Cb -0.19 -1.66 -0.18 0.00 0.02 0.00 0.00 46.19 44.17 2jmc s LEU 16 CO 0.03 0.19 1.13 0.41 0.02 0.00 0.00 176.35 178.14 2jmc n THR 17 N 3.34 0.32 -0.99 5.49 -1.04 -1.16 -2.18 114.28 118.04 2jmc n THR 17 Ca -0.18 -0.08 -0.30 0.00 -2.04 0.00 0.00 64.05 61.45 2jmc n THR 17 Cb 0.53 -0.42 -0.02 0.00 -1.82 0.00 0.00 70.33 68.59 2jmc n THR 17 CO 0.00 0.00 0.00 -0.11 -0.64 0.00 0.00 175.07 174.32 2jmc n LEU 18 N 1.96 5.86 0.00 -4.42 -0.00 0.10 -2.65 117.00 117.86 2jmc n LEU 18 Ca 0.18 -3.33 -0.11 0.00 -0.00 0.00 0.00 56.01 52.75 2jmc n LEU 18 Cb 0.16 -1.25 0.11 0.00 -0.00 0.00 0.00 43.42 42.44 2jmc n LEU 18 CO 0.61 0.87 0.13 0.18 -0.00 0.00 0.00 177.39 179.17 2jmc n LEU 19 N 4.63 0.00 -4.49 -1.96 4.32 -0.02 -4.49 117.00 114.99 2jmc n LEU 19 Ca 0.54 -0.33 -0.42 0.00 -0.02 0.00 0.00 56.01 55.78 2jmc n LEU 19 Cb 0.21 -0.53 -0.13 0.00 -1.62 0.00 0.00 43.42 41.35 2jmc n LEU 19 CO 0.80 -2.09 2.16 -3.20 -1.22 0.00 0.00 177.39 173.84 2jmc n ASN 20 N -1.74 0.66 -2.02 -1.43 5.15 -1.25 -4.34 115.26 110.28 2jmc n ASN 20 Ca 0.05 0.11 -0.15 0.00 -0.60 0.00 0.00 54.58 53.99 2jmc n ASN 20 Cb 0.22 -1.03 0.21 0.00 -0.53 0.00 0.00 39.78 38.66 2jmc n ASN 20 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2jmc n SER 21 N 11.14 4.04 0.07 1.20 7.64 -1.26 -1.57 113.62 134.87 2jmc n SER 21 Ca 0.60 -3.30 -0.13 0.00 1.01 0.00 0.00 58.87 57.06 2jmc n SER 21 Cb 0.11 -0.77 -0.06 0.00 -1.01 0.00 0.00 64.21 62.47 2jmc n SER 21 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jmc h THR 22 N 1.51 0.20 -1.65 0.44 1.03 -1.85 -3.39 112.91 109.20 2jmc h THR 22 Ca 0.44 0.00 -0.61 0.00 -0.01 0.00 0.00 66.41 66.23 2jmc h THR 22 Cb 2.49 0.20 -0.01 0.00 -1.07 0.00 0.00 68.15 69.76 2jmc h THR 22 CO 0.87 0.00 1.48 0.59 -0.01 0.00 0.00 175.52 178.44 2jmc n ASN 23 N -5.44 2.82 0.26 0.00 4.13 -1.20 -4.81 115.26 111.02 2jmc n ASN 23 Ca -0.06 0.24 0.08 0.00 1.68 0.00 0.00 54.58 56.53 2jmc n ASN 23 Cb 0.36 -1.45 0.65 0.00 -1.54 0.00 0.00 39.78 37.80 2jmc n ASN 23 CO 0.00 0.00 0.00 0.07 0.28 0.00 0.00 177.26 177.61 2jmc h LYS 24 N 14.33 0.00 -0.02 3.52 -0.00 -2.00 0.19 116.57 132.58 2jmc h LYS 24 Ca -0.35 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.30 2jmc h LYS 24 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.50 2jmc h LYS 24 CO 0.99 0.02 -0.06 -0.25 -0.00 0.00 0.00 179.45 180.15 2jmc n ASP 25 N -4.44 2.09 -3.60 7.07 8.00 -1.26 -4.77 116.55 119.63 2jmc n ASP 25 Ca -0.03 -1.64 -0.04 0.00 0.71 0.00 0.00 54.79 53.79 2jmc n ASP 25 Cb 0.11 0.05 -0.06 0.00 -0.02 0.00 0.00 41.12 41.20 2jmc n ASP 25 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 2jmc s TRP 26 N -2.09 -1.15 -0.29 1.24 0.52 0.05 -4.12 118.94 113.10 2jmc s TRP 26 Ca 0.31 1.94 -0.08 0.00 0.02 0.00 0.00 56.10 58.29 2jmc s TRP 26 Cb 0.20 0.58 -0.00 0.00 -1.15 0.00 0.00 33.47 33.10 2jmc s TRP 26 CO 0.36 -0.62 0.10 -1.58 0.02 0.00 0.00 176.95 175.23 2jmc s TRP 27 N 2.78 3.15 0.28 -1.98 0.52 0.39 -3.27 118.94 120.81 2jmc s TRP 27 Ca -0.01 -0.74 -0.30 0.00 0.02 0.00 0.00 56.10 55.07 2jmc s TRP 27 Cb -0.12 -2.29 -0.10 0.00 -1.15 0.00 0.00 33.47 29.81 2jmc s TRP 27 CO -0.17 -0.50 1.41 0.21 0.02 0.00 0.00 176.95 177.92 2jmc s LYS 28 N 1.56 4.28 -0.07 4.98 2.20 -0.61 -3.01 119.74 129.07 2jmc s LYS 28 Ca 0.04 2.30 -0.07 0.00 -0.36 0.00 0.00 55.97 57.88 2jmc s LYS 28 Cb -0.17 -3.09 0.02 0.00 -1.51 0.00 0.00 37.83 33.08 2jmc s LYS 28 CO 0.04 -0.37 0.20 0.14 -0.36 0.00 0.00 175.35 174.99 2jmc s VAL 29 N -0.34 0.00 0.41 4.02 -7.23 -1.08 -0.84 120.40 115.34 2jmc s VAL 29 Ca 0.56 -0.02 0.08 0.00 -1.81 0.00 0.00 61.98 60.79 2jmc s VAL 29 Cb -0.42 -0.29 0.00 0.00 0.56 0.00 0.00 36.38 36.24 2jmc s VAL 29 CO 0.47 -0.01 0.51 -0.70 -0.31 0.00 0.00 175.10 175.05 2jmc s GLU 30 N 0.05 2.80 0.00 4.82 2.12 -1.08 -3.66 118.70 123.75 2jmc s GLU 30 Ca -0.01 -1.27 0.00 0.00 0.36 0.00 0.00 54.97 54.05 2jmc s GLU 30 Cb -0.02 -2.68 0.00 0.00 0.26 0.00 0.00 34.13 31.69 2jmc s GLU 30 CO 0.00 -0.20 0.00 0.28 -0.54 0.00 0.00 175.26 174.80 2jmc n VAL 31 N -1.75 0.00 0.00 3.70 0.31 -1.21 -3.00 118.33 116.38 2jmc n VAL 31 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 2jmc n VAL 31 Cb 0.59 -1.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.53 2jmc n VAL 31 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2jmc n ASN 32 N -2.69 0.00 0.00 4.52 0.23 -1.26 -4.96 115.26 111.10 2jmc n ASN 32 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 2jmc n ASN 32 Cb 0.38 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.08 2jmc n ASN 32 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 2jmc n ASP 33 N -0.08 0.00 -3.51 0.53 2.03 -1.26 -5.13 116.55 109.13 2jmc n ASP 33 Ca 0.00 0.00 -0.10 0.00 0.52 0.00 0.00 54.79 55.21 2jmc n ASP 33 Cb 0.00 0.00 0.03 0.00 -0.72 0.00 0.00 41.12 40.43 2jmc n ASP 33 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2jmc n ARG 34 N -1.09 0.81 -3.21 -0.67 1.74 -1.26 -5.04 116.66 107.94 2jmc n ARG 34 Ca 0.00 -1.62 0.00 0.00 -0.77 0.00 0.00 57.85 55.46 2jmc n ARG 34 Cb 0.00 -0.11 0.00 0.00 -1.02 0.00 0.00 32.46 31.33 2jmc n ARG 34 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jmc n GLN 35 N -1.63 -1.25 -2.55 5.56 10.64 -1.26 -3.30 117.38 123.59 2jmc n GLN 35 Ca 0.08 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.25 2jmc n GLN 35 Cb 0.31 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.69 2jmc n GLN 35 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2jmc n GLY 36 N -0.00 -0.54 3.65 2.61 0.00 -1.24 -3.46 105.19 106.21 2jmc n GLY 36 Ca 0.00 -1.48 -0.38 0.00 0.00 0.00 0.00 46.02 44.16 2jmc n GLY 36 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2jmc s PHE 37 N -2.62 3.33 0.19 1.61 0.08 -1.26 -2.62 117.98 116.69 2jmc s PHE 37 Ca 0.00 0.44 0.08 0.00 0.12 0.00 0.00 56.93 57.58 2jmc s PHE 37 Cb 0.00 -2.45 -0.04 0.00 -0.57 0.00 0.00 43.02 39.96 2jmc s PHE 37 CO 0.00 -0.03 -0.17 0.14 -0.10 0.00 0.00 175.22 175.06 2jmc s VAL 38 N 1.38 1.82 -0.20 -0.44 -7.23 -1.16 -4.89 120.40 109.67 2jmc s VAL 38 Ca 0.14 -2.07 -0.29 0.00 -1.81 0.00 0.00 61.98 57.95 2jmc s VAL 38 Cb -0.15 -1.95 -0.03 0.00 0.56 0.00 0.00 36.38 34.81 2jmc s VAL 38 CO 0.07 -0.44 1.59 -2.16 -0.31 0.00 0.00 175.10 173.85 2jmc s PRO 39 N -3.20 3.87 0.52 4.82 0.04 -1.26 0.15 135.00 139.93 2jmc s PRO 39 Ca 0.19 1.72 0.22 0.00 0.04 0.00 0.00 61.00 63.17 2jmc s PRO 39 Cb -0.04 -4.01 1.20 0.00 0.04 0.00 0.00 34.50 31.69 2jmc s PRO 39 CO 0.07 -1.20 1.63 0.00 0.04 0.00 0.00 177.00 177.54 2jmc h ALA 40 N 10.41 1.29 0.00 8.56 0.00 -1.86 0.34 119.26 137.99 2jmc h ALA 40 Ca -0.34 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.50 2jmc h ALA 40 Cb 1.15 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2jmc h ALA 40 CO 0.99 -0.29 -0.35 0.00 0.00 0.00 0.00 179.25 179.61 2jmc h ALA 41 N 1.26 1.21 -0.00 0.00 0.00 -1.89 -2.39 119.26 117.45 2jmc h ALA 41 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 2jmc h ALA 41 Cb 0.66 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2jmc h ALA 41 CO 0.00 0.43 -0.34 0.66 0.00 0.00 0.00 179.25 180.00 2jmc n TYR 42 N -3.81 0.00 -4.40 0.00 4.02 0.12 -4.73 117.16 108.36 2jmc n TYR 42 Ca -0.01 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.68 2jmc n TYR 42 Cb 0.43 -0.32 -0.06 0.00 -0.02 0.00 0.00 39.34 39.37 2jmc n TYR 42 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 176.86 177.18 2jmc n VAL 43 N -1.49 0.00 -3.55 -0.72 0.24 -0.90 0.23 118.33 112.14 2jmc n VAL 43 Ca 0.06 -1.86 -0.09 0.00 -2.04 0.00 0.00 64.34 60.41 2jmc n VAL 43 Cb 0.34 0.65 -0.04 0.00 -1.47 0.00 0.00 33.84 33.32 2jmc n VAL 43 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2jmc s LYS 44 N -3.22 0.65 0.35 7.34 2.20 -0.26 -4.73 119.74 122.06 2jmc s LYS 44 Ca 0.15 -0.05 -0.26 0.00 -0.36 0.00 0.00 55.97 55.45 2jmc s LYS 44 Cb 0.01 0.30 -0.09 0.00 -1.51 0.00 0.00 37.83 36.54 2jmc s LYS 44 CO 0.11 -0.25 1.02 0.15 -0.36 0.00 0.00 175.35 176.03 2jmc s LYS 45 N -2.02 4.41 0.38 4.03 1.02 -1.26 -0.24 119.74 126.06 2jmc s LYS 45 Ca 0.02 1.52 0.02 0.00 0.02 0.00 0.00 55.97 57.54 2jmc s LYS 45 Cb -0.01 -2.78 0.02 0.00 -0.52 0.00 0.00 37.83 34.54 2jmc s LYS 45 CO -0.03 0.08 0.15 1.28 -0.92 0.00 0.00 175.35 175.91 2jmc n LEU 46 N 0.43 0.00 -4.13 3.17 4.77 -1.18 -4.82 117.00 115.23 2jmc n LEU 46 Ca 0.03 -2.16 -0.34 0.00 -0.03 0.00 0.00 56.01 53.51 2jmc n LEU 46 Cb 0.49 0.11 -0.14 0.00 -2.33 0.00 0.00 43.42 41.54 2jmc n LEU 46 CO 0.47 -0.41 -0.41 -0.62 -1.33 0.00 0.00 177.39 175.09 2jmc s ASP 47 N -3.15 4.57 -0.11 -1.43 -1.08 -1.26 -4.91 116.67 109.30 2jmc s ASP 47 Ca 0.11 -1.24 -0.09 0.00 -0.52 0.00 0.00 52.55 50.82 2jmc s ASP 47 Cb -0.01 -1.63 -0.03 0.00 -1.46 0.00 0.00 42.92 39.79 2jmc s ASP 47 CO 0.07 -0.20 -0.17 -0.24 0.52 0.00 0.00 175.17 175.15 2jmc n SER 48 N 4.55 1.27 0.00 -0.34 2.88 -1.26 -5.05 113.62 115.67 2jmc n SER 48 Ca -0.14 0.41 0.00 0.00 -1.33 0.00 0.00 58.87 57.80 2jmc n SER 48 Cb 0.44 -0.72 0.00 0.00 -0.75 0.00 0.00 64.21 63.17 2jmc n SER 48 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jmc n GLY 49 N 1.59 3.13 0.13 0.46 0.00 -1.26 -4.91 105.19 104.32 2jmc n GLY 49 Ca -0.07 -0.85 -0.14 0.00 0.00 0.00 0.00 46.02 44.97 2jmc n GLY 49 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jmc h THR 50 N 0.00 0.83 0.00 2.61 1.03 -2.05 -3.46 112.91 111.87 2jmc h THR 50 Ca 0.00 -0.04 0.00 0.00 -0.01 0.00 0.00 66.41 66.36 2jmc h THR 50 Cb 0.00 0.86 0.00 0.00 -1.07 0.00 0.00 68.15 67.94 2jmc h THR 50 CO 0.00 0.01 0.00 0.61 -0.01 0.00 0.00 175.52 176.13 2jmc n GLY 51 N -1.15 0.00 3.97 2.99 0.00 -1.26 -5.17 105.19 104.57 2jmc n GLY 51 Ca -0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.74 2jmc n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jmc s LYS 52 N 0.00 2.61 -0.44 1.61 -0.14 -1.26 -5.10 119.74 117.02 2jmc s LYS 52 Ca 0.00 -1.45 0.03 0.00 -1.36 0.00 0.00 55.97 53.19 2jmc s LYS 52 Cb 0.00 -2.60 0.12 0.00 -1.68 0.00 0.00 37.83 33.67 2jmc s LYS 52 CO 0.00 -0.39 0.19 -1.21 -0.76 0.00 0.00 175.35 173.17 2jmc s GLU 53 N -4.35 1.62 0.18 1.68 2.02 -1.26 -4.87 118.70 113.71 2jmc s GLU 53 Ca 0.53 -2.20 0.10 0.00 0.02 0.00 0.00 54.97 53.42 2jmc s GLU 53 Cb -0.07 -3.00 -0.04 0.00 0.10 0.00 0.00 34.13 31.11 2jmc s GLU 53 CO 0.32 -1.07 -0.20 -0.48 0.02 0.00 0.00 175.26 173.85 2jmc s LEU 54 N 0.28 2.44 -0.08 1.80 2.34 -1.26 0.00 118.68 124.21 2jmc s LEU 54 Ca 0.15 -0.87 -0.03 0.00 0.06 0.00 0.00 54.13 53.45 2jmc s LEU 54 Cb -0.23 -0.95 0.04 0.00 -0.56 0.00 0.00 46.19 44.48 2jmc s LEU 54 CO -0.04 0.02 0.08 0.68 -1.06 0.00 0.00 176.35 176.03 2jmc s VAL 55 N -1.92 -0.13 0.51 1.48 -7.23 -0.93 -3.12 120.40 109.06 2jmc s VAL 55 Ca 0.18 0.28 -0.21 0.00 -1.81 0.00 0.00 61.98 60.42 2jmc s VAL 55 Cb -0.06 -0.27 -0.06 0.00 0.56 0.00 0.00 36.38 36.55 2jmc s VAL 55 CO 0.08 0.07 1.17 -0.22 -0.31 0.00 0.00 175.10 175.89 2jmc s LEU 56 N 2.18 3.87 -0.50 1.32 1.98 0.67 -2.49 118.68 125.71 2jmc s LEU 56 Ca 0.04 2.31 -0.20 0.00 -2.89 0.00 0.00 54.13 53.40 2jmc s LEU 56 Cb -0.13 -4.40 0.05 0.00 0.66 0.00 0.00 46.19 42.38 2jmc s LEU 56 CO -0.05 -1.15 0.65 0.00 -1.89 0.00 0.00 176.35 173.92 2jmc s ALA 57 N -1.60 3.36 -0.02 5.97 0.00 0.31 -1.10 121.76 128.68 2jmc s ALA 57 Ca 0.69 -1.65 -0.25 0.00 0.00 0.00 0.00 51.96 50.75 2jmc s ALA 57 Cb -0.28 -3.38 -0.20 0.00 0.00 0.00 0.00 23.12 19.26 2jmc s ALA 57 CO 0.33 -2.02 1.22 -0.07 0.00 0.00 0.00 175.76 175.21 2jmc h LEU 58 N 9.82 0.12 -9.30 0.00 3.38 0.26 0.16 115.31 119.75 2jmc h LEU 58 Ca -0.27 -0.56 -0.57 0.00 0.09 0.00 0.00 57.88 56.56 2jmc h LEU 58 Cb 1.09 -0.03 -0.14 0.00 0.09 0.00 0.00 40.66 41.67 2jmc h LEU 58 CO 0.97 0.66 -0.69 -0.31 0.09 0.00 0.00 178.44 179.16 2jmc s TYR 59 N -3.97 2.23 0.00 1.13 2.02 0.05 -4.64 117.35 114.17 2jmc s TYR 59 Ca -0.16 -0.54 -0.27 0.00 -0.37 0.00 0.00 57.07 55.73 2jmc s TYR 59 Cb 0.02 -1.23 -0.04 0.00 -0.40 0.00 0.00 41.96 40.31 2jmc s TYR 59 CO 0.70 0.50 0.87 0.16 -1.57 0.00 0.00 175.55 176.21 2jmc s ASP 60 N -3.54 7.26 0.31 2.29 1.47 -1.26 -4.34 116.67 118.86 2jmc s ASP 60 Ca 0.31 1.52 0.03 0.00 1.18 0.00 0.00 52.55 55.59 2jmc s ASP 60 Cb 0.02 -2.51 -0.06 0.00 -0.34 0.00 0.00 42.92 40.02 2jmc s ASP 60 CO 0.15 -0.15 0.07 -0.47 0.68 0.00 0.00 175.17 175.44 2jmc s TYR 61 N 0.65 1.85 -0.12 2.11 6.14 -0.47 -4.94 117.35 122.58 2jmc s TYR 61 Ca 0.45 -1.01 -0.04 0.00 0.64 0.00 0.00 57.07 57.11 2jmc s TYR 61 Cb -0.20 -1.18 0.06 0.00 0.42 0.00 0.00 41.96 41.06 2jmc s TYR 61 CO 0.25 -0.08 0.24 -1.14 0.64 0.00 0.00 175.55 175.45 2jmc s GLN 62 N -3.93 0.12 -0.07 4.97 -0.44 -1.26 -2.30 119.66 116.75 2jmc s GLN 62 Ca 0.37 0.69 0.05 0.00 -2.50 0.00 0.00 55.36 53.96 2jmc s GLN 62 Cb 0.08 -0.10 -0.00 0.00 -1.64 0.00 0.00 33.01 31.35 2jmc s GLN 62 CO 0.15 -0.28 -0.23 -2.00 0.50 0.00 0.00 175.29 173.43 2jmc s GLU 63 N 2.30 2.59 -0.64 1.67 -6.30 0.26 -4.98 118.70 113.61 2jmc s GLU 63 Ca 0.01 -0.83 0.01 0.00 -2.50 0.00 0.00 54.97 51.67 2jmc s GLU 63 Cb -0.12 -2.09 0.16 0.00 0.00 0.00 0.00 34.13 32.08 2jmc s GLU 63 CO -0.08 0.26 0.43 -1.54 0.02 0.00 0.00 175.26 174.36 2jmc s SER 64 N 0.11 4.91 0.00 -1.70 1.04 -1.26 -0.62 113.70 116.18 2jmc s SER 64 Ca -0.10 -3.25 0.00 0.00 0.48 0.00 0.00 55.95 53.08 2jmc s SER 64 Cb -0.15 -1.74 0.00 0.00 0.10 0.00 0.00 66.02 64.23 2jmc s SER 64 CO 0.06 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.65 2jmc n GLY 65 N 2.87 -1.88 2.89 7.32 0.00 0.57 -4.67 105.19 112.29 2jmc n GLY 65 Ca 0.11 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 2jmc n GLY 65 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jmc n ASP 66 N 0.00 0.42 -4.19 1.61 5.75 -1.22 -4.88 116.55 114.04 2jmc n ASP 66 Ca 0.00 0.34 -0.29 0.00 -0.01 0.00 0.00 54.79 54.84 2jmc n ASP 66 Cb 0.00 -0.78 -0.16 0.00 -1.03 0.00 0.00 41.12 39.15 2jmc n ASP 66 CO 0.00 0.00 0.00 0.20 -0.11 0.00 0.00 177.20 177.29 2jmc s ASN 67 N 6.52 2.57 0.30 -1.12 0.02 -1.26 -4.93 114.94 117.05 2jmc s ASN 67 Ca 1.10 -0.43 -0.29 0.00 -1.02 0.00 0.00 52.86 52.22 2jmc s ASN 67 Cb -1.17 -0.74 -0.13 0.00 0.02 0.00 0.00 41.25 39.24 2jmc s ASN 67 CO 0.48 0.19 1.37 0.00 0.02 0.00 0.00 177.10 179.16 2jmc n ALA 68 N 3.09 1.41 -2.06 0.60 0.00 -1.26 -4.30 120.51 117.99 2jmc n ALA 68 Ca -0.18 0.38 -0.28 0.00 0.00 0.00 0.00 53.44 53.36 2jmc n ALA 68 Cb 0.52 -2.29 -0.06 0.00 0.00 0.00 0.00 19.45 17.62 2jmc n ALA 68 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2jmc n PRO 69 N 1.19 1.59 0.00 0.00 -0.04 -1.26 -4.67 135.00 131.81 2jmc n PRO 69 Ca 0.07 -2.46 0.14 0.00 -0.04 0.00 0.00 63.50 61.21 2jmc n PRO 69 Cb 0.35 -3.73 0.64 0.00 -0.04 0.00 0.00 33.50 30.72 2jmc n PRO 69 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2jmc n SER 70 N 14.40 0.29 -4.25 3.54 2.88 -1.26 -4.87 113.62 124.35 2jmc n SER 70 Ca 0.45 -0.34 -0.19 0.00 -1.33 0.00 0.00 58.87 57.45 2jmc n SER 70 Cb 0.46 -0.15 -0.10 0.00 -0.75 0.00 0.00 64.21 63.67 2jmc n SER 70 CO 0.00 0.00 0.00 -0.72 -1.23 0.00 0.00 175.04 173.09 2jmc s TYR 71 N -2.57 1.68 0.67 0.66 -0.85 -1.26 -5.15 117.35 110.53 2jmc s TYR 71 Ca 0.27 -1.19 -0.12 0.00 -0.52 0.00 0.00 57.07 55.51 2jmc s TYR 71 Cb 0.20 -1.01 -0.00 0.00 0.38 0.00 0.00 41.96 41.53 2jmc s TYR 71 CO 0.49 -0.29 1.06 -1.54 -1.52 0.00 0.00 175.55 173.74 2jmc s SER 72 N -3.40 5.45 0.50 -0.18 1.04 -1.26 -5.02 113.70 110.82 2jmc s SER 72 Ca 0.35 1.68 -0.21 0.00 0.48 0.00 0.00 55.95 58.25 2jmc s SER 72 Cb 0.07 -2.51 -0.07 0.00 0.10 0.00 0.00 66.02 63.61 2jmc s SER 72 CO 0.15 -1.40 1.15 -2.16 0.98 0.00 0.00 173.24 171.96 2jmc s PRO 73 N -4.79 3.56 0.65 4.02 0.04 -1.26 -5.02 135.00 132.20 2jmc s PRO 73 Ca 0.60 1.69 -0.15 0.00 0.04 0.00 0.00 61.00 63.17 2jmc s PRO 73 Cb -0.15 -2.20 -0.01 0.00 0.04 0.00 0.00 34.50 32.18 2jmc s PRO 73 CO 0.50 -0.69 1.11 -1.25 0.04 0.00 0.00 177.00 176.71 2jmc s PRO 74 N -2.99 2.85 0.04 0.56 0.04 -1.26 -4.98 135.00 129.26 2jmc s PRO 74 Ca 0.68 1.41 -0.31 0.00 0.04 0.00 0.00 61.00 62.82 2jmc s PRO 74 Cb -0.26 -1.96 -0.06 0.00 0.04 0.00 0.00 34.50 32.26 2jmc s PRO 74 CO 0.31 -1.21 1.41 -1.25 0.04 0.00 0.00 177.00 176.30 2jmc s PRO 75 N -4.03 4.29 1.02 0.56 0.04 -1.26 -4.98 135.00 130.63 2jmc s PRO 75 Ca 0.67 2.03 -0.13 0.00 0.04 0.00 0.00 61.00 63.61 2jmc s PRO 75 Cb -0.21 -3.47 0.20 0.00 0.04 0.00 0.00 34.50 31.06 2jmc s PRO 75 CO 0.40 -0.54 1.09 -1.25 0.04 0.00 0.00 177.00 176.75 2jmc s PRO 76 N 2.00 0.29 0.00 0.56 0.04 -1.26 -5.15 135.00 131.48 2jmc s PRO 76 Ca 0.65 0.48 0.16 0.00 0.04 0.00 0.00 61.00 62.32 2jmc s PRO 76 Cb -0.34 -1.72 0.93 0.00 0.04 0.00 0.00 34.50 33.41 2jmc s PRO 76 CO 0.28 -2.82 1.34 -0.35 0.04 0.00 0.00 177.00 175.50