#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmc n ALA 2 N 0.00 0.00 -2.24 4.61 0.00 -1.26 -4.88 120.51 116.74 2jmc n ALA 2 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.03 2jmc n ALA 2 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2jmc n ALA 2 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2jmc s MET 3 N -1.94 4.57 0.26 0.00 1.00 -1.26 -4.81 119.30 117.12 2jmc s MET 3 Ca 0.00 1.66 0.00 0.00 0.00 0.00 0.00 55.69 57.35 2jmc s MET 3 Cb 0.00 -3.33 0.00 0.00 0.00 0.00 0.00 34.83 31.50 2jmc s MET 3 CO 0.00 0.01 0.00 0.41 0.00 0.00 0.00 175.02 175.44 2jmc n GLY 4 N 2.43 -3.53 0.20 -0.03 0.00 -1.24 -1.50 105.19 101.51 2jmc n GLY 4 Ca 0.04 -1.04 0.07 0.00 0.00 0.00 0.00 46.02 45.09 2jmc n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jmc h PRO 5 N 0.37 0.00 -4.74 1.61 0.13 -1.91 -3.40 132.00 124.06 2jmc h PRO 5 Ca 0.00 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.45 2jmc h PRO 5 Cb 0.24 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 31.02 2jmc h PRO 5 CO 0.00 0.32 -0.71 -0.98 -0.23 0.00 0.00 178.00 176.39 2jmc s ARG 6 N -3.84 2.13 -0.24 0.86 1.70 -1.26 -5.00 118.95 113.29 2jmc s ARG 6 Ca -0.01 -1.49 -0.04 0.00 -0.47 0.00 0.00 55.73 53.72 2jmc s ARG 6 Cb 0.12 -3.16 0.00 0.00 -0.57 0.00 0.00 34.95 31.35 2jmc s ARG 6 CO 0.67 -0.73 -0.02 -1.83 -1.08 0.00 0.00 175.30 172.31 2jmc s GLU 7 N 1.12 3.17 -0.07 3.89 -1.05 -1.26 -1.59 118.70 122.91 2jmc s GLU 7 Ca -0.01 -0.77 -0.14 0.00 -0.15 0.00 0.00 54.97 53.90 2jmc s GLU 7 Cb -0.20 -3.08 -0.05 0.00 -0.44 0.00 0.00 34.13 30.36 2jmc s GLU 7 CO -0.04 -0.30 0.36 0.54 0.95 0.00 0.00 175.26 176.76 2jmc s VAL 8 N 1.44 5.17 0.07 1.83 0.11 -0.82 -4.83 120.40 123.37 2jmc s VAL 8 Ca 0.04 0.71 0.07 0.00 -2.93 0.00 0.00 61.98 59.86 2jmc s VAL 8 Cb -0.15 -3.67 -0.03 0.00 -1.53 0.00 0.00 36.38 31.00 2jmc s VAL 8 CO -0.02 0.51 -0.19 0.42 -3.33 0.00 0.00 175.10 172.49 2jmc s THR 9 N -0.48 1.49 -0.16 5.04 -4.23 -1.26 0.17 115.64 116.21 2jmc s THR 9 Ca 0.21 -1.33 0.00 0.00 -1.18 0.00 0.00 61.69 59.40 2jmc s THR 9 Cb -0.15 -1.35 0.00 0.00 1.34 0.00 0.00 72.50 72.34 2jmc s THR 9 CO 0.10 -0.02 -0.15 -0.04 -0.54 0.00 0.00 174.62 173.97 2jmc s MET 10 N -1.58 3.19 -0.12 3.99 -1.94 -1.06 -4.90 119.30 116.88 2jmc s MET 10 Ca 0.04 -0.76 -0.05 0.00 -1.71 0.00 0.00 55.69 53.21 2jmc s MET 10 Cb -0.09 -2.64 -0.04 0.00 2.01 0.00 0.00 34.83 34.07 2jmc s MET 10 CO 0.03 -0.03 0.08 0.21 -0.01 0.00 0.00 175.02 175.29 2jmc s LYS 11 N 0.93 3.41 -0.27 2.03 2.20 -1.26 -1.70 119.74 125.08 2jmc s LYS 11 Ca -0.03 -0.27 -0.33 0.00 -0.36 0.00 0.00 55.97 54.98 2jmc s LYS 11 Cb -0.15 -3.06 -0.10 0.00 -1.51 0.00 0.00 37.83 33.01 2jmc s LYS 11 CO -0.02 0.64 2.14 1.17 -0.36 0.00 0.00 175.35 178.92 2jmc n LYS 12 N 2.38 1.48 -0.83 4.03 4.81 -1.26 -1.64 118.16 127.14 2jmc n LYS 12 Ca -0.19 0.44 0.00 0.00 -0.87 0.00 0.00 58.31 57.69 2jmc n LYS 12 Cb 0.54 -2.69 0.00 0.00 0.02 0.00 0.00 35.03 32.89 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 5.96 1.09 3.19 3.14 0.00 0.95 -4.98 105.19 114.54 2jmc n GLY 13 Ca 0.35 -0.26 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.35 2.30 -0.59 1.61 2.15 -0.65 -4.88 116.67 114.26 2jmc s ASP 14 Ca 0.00 -0.36 -0.20 0.00 0.43 0.00 0.00 52.55 52.42 2jmc s ASP 14 Cb 0.00 -0.34 0.08 0.00 -0.30 0.00 0.00 42.92 42.36 2jmc s ASP 14 CO 0.00 0.22 0.77 -0.63 -0.17 0.00 0.00 175.17 175.36 2jmc s ILE 15 N -0.35 4.68 -0.21 4.11 1.01 -1.26 -1.00 121.20 128.17 2jmc s ILE 15 Ca 0.05 -0.62 -0.08 0.00 0.00 0.00 0.00 60.65 60.00 2jmc s ILE 15 Cb -0.09 -4.50 -0.04 0.00 0.01 0.00 0.00 42.46 37.85 2jmc s ILE 15 CO -0.00 -1.13 0.08 -0.76 0.00 0.00 0.00 174.94 173.12 2jmc s LEU 16 N 3.11 3.73 -0.22 2.97 1.02 -0.84 -4.91 118.68 123.54 2jmc s LEU 16 Ca 0.16 -0.01 -0.43 0.00 0.02 0.00 0.00 54.13 53.88 2jmc s LEU 16 Cb -0.20 -1.97 -0.19 0.00 0.02 0.00 0.00 46.19 43.85 2jmc s LEU 16 CO 0.09 0.09 1.37 0.41 0.02 0.00 0.00 176.35 178.34 2jmc n THR 17 N 4.08 0.03 -1.04 5.49 -1.04 -1.25 -2.33 114.28 118.22 2jmc n THR 17 Ca -0.16 -0.01 -0.43 0.00 -2.04 0.00 0.00 64.05 61.41 2jmc n THR 17 Cb 0.52 -0.39 -0.07 0.00 -1.82 0.00 0.00 70.33 68.57 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 2.98 3.46 0.00 -4.42 -0.00 0.14 -2.75 117.00 116.41 2jmc n LEU 18 Ca 0.25 -2.62 -0.17 0.00 -0.00 0.00 0.00 56.01 53.47 2jmc n LEU 18 Cb 0.04 -1.00 0.16 0.00 -0.00 0.00 0.00 43.42 42.62 2jmc n LEU 18 CO 0.75 -0.72 0.19 0.18 -0.00 0.00 0.00 177.39 177.79 2jmc n LEU 19 N 7.94 0.00 -4.32 -1.96 4.32 -0.02 -4.64 117.00 118.31 2jmc n LEU 19 Ca 0.49 -0.49 -0.58 0.00 -0.02 0.00 0.00 56.01 55.42 2jmc n LEU 19 Cb 0.41 -0.63 -0.11 0.00 -1.62 0.00 0.00 43.42 41.47 2jmc n LEU 19 CO 1.07 -2.30 1.73 -3.20 -1.22 0.00 0.00 177.39 173.47 2jmc n ASN 20 N -3.48 1.17 -1.75 -1.43 5.15 -1.25 -4.40 115.26 109.27 2jmc n ASN 20 Ca 0.08 0.62 0.06 0.00 -0.60 0.00 0.00 54.58 54.74 2jmc n ASN 20 Cb 0.33 -1.00 0.37 0.00 -0.53 0.00 0.00 39.78 38.95 2jmc n ASN 20 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2jmc n SER 21 N 8.06 5.24 -0.25 1.20 3.41 -1.26 -1.66 113.62 128.37 2jmc n SER 21 Ca 0.50 -2.82 -0.06 0.00 -0.26 0.00 0.00 58.87 56.23 2jmc n SER 21 Cb 0.04 -0.66 -0.06 0.00 -0.26 0.00 0.00 64.21 63.26 2jmc n SER 21 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2jmc n THR 22 N 0.59 -0.40 -1.42 6.66 -2.24 -1.26 -4.35 114.28 111.86 2jmc n THR 22 Ca 0.25 1.49 -0.34 0.00 -2.27 0.00 0.00 64.05 63.18 2jmc n THR 22 Cb 1.10 -1.85 0.09 0.00 -2.10 0.00 0.00 70.33 67.57 2jmc n THR 22 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2jmc s ASN 23 N -5.13 4.19 -0.21 3.42 -0.87 -1.24 -4.98 114.94 110.12 2jmc s ASN 23 Ca -0.07 2.34 -0.17 0.00 -1.57 0.00 0.00 52.86 53.39 2jmc s ASN 23 Cb 0.06 -2.59 -0.19 0.00 -0.02 0.00 0.00 41.25 38.52 2jmc s ASN 23 CO 0.36 -2.27 0.13 2.29 -2.57 0.00 0.00 177.10 175.05 2jmc n LYS 24 N -2.76 0.61 0.13 -0.60 2.85 -1.26 -4.29 118.16 112.84 2jmc n LYS 24 Ca 0.13 0.45 0.12 0.00 -1.05 0.00 0.00 58.31 57.97 2jmc n LYS 24 Cb 0.50 -1.69 0.26 0.00 -0.65 0.00 0.00 35.03 33.45 2jmc n LYS 24 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 2jmc h ASP 25 N -0.75 0.00 -3.34 -5.58 3.32 -1.94 -3.43 116.42 104.69 2jmc h ASP 25 Ca -0.43 -0.04 -0.56 0.00 0.02 0.00 0.00 57.03 56.02 2jmc h ASP 25 Cb 1.52 0.00 -0.38 0.00 0.22 0.00 0.00 39.33 40.70 2jmc h ASP 25 CO -0.18 0.02 -0.79 0.26 -1.72 0.00 0.00 179.24 176.82 2jmc s TRP 26 N -3.17 1.80 -0.23 4.55 0.52 -1.26 -1.70 118.94 119.46 2jmc s TRP 26 Ca 0.08 -1.16 -0.06 0.00 0.02 0.00 0.00 56.10 54.98 2jmc s TRP 26 Cb 0.10 -1.36 -0.02 0.00 -1.15 0.00 0.00 33.47 31.04 2jmc s TRP 26 CO 0.66 -0.64 0.02 -1.58 0.02 0.00 0.00 176.95 175.43 2jmc s TRP 27 N 1.60 3.04 0.21 -1.98 0.52 0.46 -3.65 118.94 119.14 2jmc s TRP 27 Ca 0.00 -0.60 -0.30 0.00 0.02 0.00 0.00 56.10 55.22 2jmc s TRP 27 Cb -0.15 -2.17 -0.09 0.00 -1.15 0.00 0.00 33.47 29.90 2jmc s TRP 27 CO -0.08 -0.41 1.38 0.21 0.02 0.00 0.00 176.95 178.08 2jmc s LYS 28 N 1.49 4.32 -0.07 4.98 2.20 -0.67 -2.90 119.74 129.09 2jmc s LYS 28 Ca 0.06 2.18 -0.06 0.00 -0.36 0.00 0.00 55.97 57.78 2jmc s LYS 28 Cb -0.15 -3.16 0.02 0.00 -1.51 0.00 0.00 37.83 33.03 2jmc s LYS 28 CO 0.01 -0.35 0.18 0.14 -0.36 0.00 0.00 175.35 174.97 2jmc s VAL 29 N 0.16 0.00 0.39 4.02 -7.23 -0.92 -0.84 120.40 115.98 2jmc s VAL 29 Ca 0.59 -0.02 -0.00 0.00 -1.81 0.00 0.00 61.98 60.74 2jmc s VAL 29 Cb -0.39 -0.27 -0.02 0.00 0.56 0.00 0.00 36.38 36.26 2jmc s VAL 29 CO 0.40 -0.01 0.61 -0.70 -0.31 0.00 0.00 175.10 175.09 2jmc s GLU 30 N 0.06 3.36 -0.36 4.82 2.12 -1.11 -2.60 118.70 124.98 2jmc s GLU 30 Ca -0.00 -0.33 0.01 0.00 0.36 0.00 0.00 54.97 55.01 2jmc s GLU 30 Cb -0.01 -2.60 0.15 0.00 0.26 0.00 0.00 34.13 31.92 2jmc s GLU 30 CO 0.00 -0.02 0.26 0.08 -0.54 0.00 0.00 175.26 175.05 2jmc s VAL 31 N -2.44 0.04 0.00 3.70 1.01 0.64 -3.75 120.40 119.60 2jmc s VAL 31 Ca 0.43 -1.63 0.00 0.00 0.00 0.00 0.00 61.98 60.78 2jmc s VAL 31 Cb -0.10 -1.02 0.00 0.00 0.00 0.00 0.00 36.38 35.26 2jmc s VAL 31 CO 0.38 -0.92 0.00 0.59 0.00 0.00 0.00 175.10 175.15 2jmc n ASN 32 N 3.97 0.00 0.00 3.32 5.03 -1.26 -0.58 115.26 125.74 2jmc n ASN 32 Ca 0.14 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.59 2jmc n ASN 32 Cb 0.40 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.16 2jmc n ASN 32 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 2jmc n ASP 33 N 1.31 0.16 -4.12 6.41 8.00 -1.26 -5.05 116.55 121.99 2jmc n ASP 33 Ca 0.00 -1.02 -0.30 0.00 0.71 0.00 0.00 54.79 54.18 2jmc n ASP 33 Cb 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 41.12 40.93 2jmc n ASP 33 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2jmc s ARG 34 N -0.02 2.62 0.30 -1.24 0.52 0.26 -5.05 118.95 116.33 2jmc s ARG 34 Ca 0.00 -0.71 0.06 0.00 -0.52 0.00 0.00 55.73 54.55 2jmc s ARG 34 Cb 0.00 -2.12 -0.06 0.00 0.52 0.00 0.00 34.95 33.29 2jmc s ARG 34 CO 0.00 0.01 -0.02 -0.65 0.02 0.00 0.00 175.30 174.66 2jmc s GLN 35 N 0.78 1.59 0.00 3.54 -0.21 -1.26 0.23 119.66 124.33 2jmc s GLN 35 Ca -0.10 -1.83 0.00 0.00 0.02 0.00 0.00 55.36 53.45 2jmc s GLN 35 Cb -0.16 -1.05 0.00 0.00 1.00 0.00 0.00 33.01 32.80 2jmc s GLN 35 CO 0.01 -0.04 0.00 0.41 -2.12 0.00 0.00 175.29 173.54 2jmc n GLY 36 N -0.62 0.38 3.73 3.09 0.00 -1.07 -4.14 105.19 106.55 2jmc n GLY 36 Ca -0.04 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.56 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 -2.00 3.76 0.04 1.61 0.08 -1.26 -2.17 117.98 118.03 2jmc s PHE 37 Ca 0.00 1.68 -0.01 0.00 0.12 0.00 0.00 56.93 58.72 2jmc s PHE 37 Cb 0.00 -3.00 -0.03 0.00 -0.57 0.00 0.00 43.02 39.43 2jmc s PHE 37 CO 0.00 0.18 -0.01 0.14 -0.10 0.00 0.00 175.22 175.43 2jmc s VAL 38 N 0.19 0.16 -0.13 -0.44 -7.23 -1.14 -4.86 120.40 106.95 2jmc s VAL 38 Ca 0.45 -1.33 -0.29 0.00 -1.81 0.00 0.00 61.98 59.00 2jmc s VAL 38 Cb -0.22 -0.90 -0.04 0.00 0.56 0.00 0.00 36.38 35.78 2jmc s VAL 38 CO 0.27 -0.73 1.55 -2.16 -0.31 0.00 0.00 175.10 173.72 2jmc s PRO 39 N -2.71 4.07 0.62 4.82 0.04 -1.26 0.17 135.00 140.75 2jmc s PRO 39 Ca -0.04 1.90 0.26 0.00 0.04 0.00 0.00 61.00 63.16 2jmc s PRO 39 Cb -0.01 -3.95 1.44 0.00 0.04 0.00 0.00 34.50 32.02 2jmc s PRO 39 CO -0.05 -0.96 1.80 0.00 0.04 0.00 0.00 177.00 177.82 2jmc h ALA 40 N 9.62 1.35 0.00 8.56 0.00 -1.60 0.26 119.26 137.45 2jmc h ALA 40 Ca -0.34 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 2jmc h ALA 40 Cb 1.15 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 2jmc h ALA 40 CO 0.97 -0.35 -0.19 0.00 0.00 0.00 0.00 179.25 179.68 2jmc h ALA 41 N 1.26 1.45 -0.00 0.00 0.00 -1.89 -1.54 119.26 118.53 2jmc h ALA 41 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.73 2jmc h ALA 41 Cb 0.72 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.48 2jmc h ALA 41 CO 0.00 0.24 -0.34 0.66 0.00 0.00 0.00 179.25 179.81 2jmc n TYR 42 N -3.98 0.00 -4.50 0.00 4.02 0.91 -4.71 117.16 108.90 2jmc n TYR 42 Ca -0.02 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.62 2jmc n TYR 42 Cb 0.28 -0.17 -0.08 0.00 -0.02 0.00 0.00 39.34 39.34 2jmc n TYR 42 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 176.86 175.99 2jmc s VAL 43 N -2.69 0.53 -0.13 -0.72 -7.23 -0.58 0.20 120.40 109.78 2jmc s VAL 43 Ca 0.19 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.06 2jmc s VAL 43 Cb 0.19 -2.35 0.11 0.00 0.56 0.00 0.00 36.38 34.89 2jmc s VAL 43 CO 0.59 0.00 0.90 -0.75 -0.31 0.00 0.00 175.10 175.52 2jmc s LYS 44 N -3.68 0.74 0.50 4.82 2.20 -0.13 -4.72 119.74 119.47 2jmc s LYS 44 Ca 0.25 0.18 -0.20 0.00 -0.36 0.00 0.00 55.97 55.84 2jmc s LYS 44 Cb 0.02 0.35 -0.07 0.00 -1.51 0.00 0.00 37.83 36.62 2jmc s LYS 44 CO 0.16 -0.23 1.09 0.15 -0.36 0.00 0.00 175.35 176.16 2jmc s LYS 45 N -1.13 3.62 0.37 4.03 1.02 -1.26 -0.12 119.74 126.26 2jmc s LYS 45 Ca -0.05 1.53 0.00 0.00 0.02 0.00 0.00 55.97 57.48 2jmc s LYS 45 Cb -0.00 -2.12 -0.00 0.00 -0.52 0.00 0.00 37.83 35.18 2jmc s LYS 45 CO 0.04 -0.61 0.00 1.28 -0.92 0.00 0.00 175.35 175.14 2jmc n LEU 46 N -0.99 0.00 -4.48 3.17 4.77 -1.22 -4.79 117.00 113.45 2jmc n LEU 46 Ca 0.10 -2.30 -0.37 0.00 -0.03 0.00 0.00 56.01 53.41 2jmc n LEU 46 Cb 0.51 0.26 -0.12 0.00 -2.33 0.00 0.00 43.42 41.74 2jmc n LEU 46 CO 0.42 -0.33 -0.25 -1.81 -1.33 0.00 0.00 177.39 174.09 2jmc s ASP 47 N -3.01 5.36 -0.11 -1.43 1.11 -1.26 -4.89 116.67 112.44 2jmc s ASP 47 Ca 0.00 -0.19 0.00 0.00 0.18 0.00 0.00 52.55 52.54 2jmc s ASP 47 Cb 0.00 -1.97 -0.07 0.00 1.07 0.00 0.00 42.92 41.95 2jmc s ASP 47 CO 0.00 -0.05 -0.10 -1.54 1.18 0.00 0.00 175.17 174.66 2jmc n SER 48 N 4.96 2.98 0.00 0.27 3.41 -1.26 -5.05 113.62 118.92 2jmc n SER 48 Ca -0.15 -0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 2jmc n SER 48 Cb 0.51 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 64.28 2jmc n SER 48 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jmc n GLY 49 N 2.93 1.96 0.34 5.00 0.00 -1.26 -4.69 105.19 109.47 2jmc n GLY 49 Ca -0.19 -0.45 0.17 0.00 0.00 0.00 0.00 46.02 45.55 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 0.48 0.00 2.61 1.03 -2.04 -3.44 112.91 111.55 2jmc h THR 50 Ca 0.00 -0.17 0.00 0.00 -0.01 0.00 0.00 66.41 66.23 2jmc h THR 50 Cb 0.00 -0.05 0.00 0.00 -1.07 0.00 0.00 68.15 67.03 2jmc h THR 50 CO 0.00 0.09 0.00 0.61 -0.01 0.00 0.00 175.52 176.21 2jmc n GLY 51 N -1.31 0.91 2.88 2.99 0.00 -1.26 -5.15 105.19 104.25 2jmc n GLY 51 Ca 0.26 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.03 2jmc n GLY 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jmc n LYS 52 N 0.00 -3.18 -3.63 1.61 4.76 -1.26 -5.04 118.16 111.41 2jmc n LYS 52 Ca 0.00 -1.42 -0.29 0.00 -2.87 0.00 0.00 58.31 53.73 2jmc n LYS 52 Cb 0.00 -1.43 -0.14 0.00 -1.84 0.00 0.00 35.03 31.63 2jmc n LYS 52 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 2jmc s GLU 53 N -5.01 0.79 0.30 1.97 2.02 -1.26 -4.91 118.70 112.60 2jmc s GLU 53 Ca 0.59 -1.39 0.08 0.00 0.02 0.00 0.00 54.97 54.28 2jmc s GLU 53 Cb -0.07 -1.82 -0.06 0.00 0.10 0.00 0.00 34.13 32.29 2jmc s GLU 53 CO 0.46 -1.11 -0.09 -0.48 0.02 0.00 0.00 175.26 174.06 2jmc s LEU 54 N 1.11 2.59 -0.22 1.80 2.34 -1.26 0.27 118.68 125.31 2jmc s LEU 54 Ca 0.15 -1.17 -0.06 0.00 0.06 0.00 0.00 54.13 53.11 2jmc s LEU 54 Cb -0.21 -0.81 0.11 0.00 -0.56 0.00 0.00 46.19 44.71 2jmc s LEU 54 CO -0.11 -0.25 0.44 0.68 -1.06 0.00 0.00 176.35 176.05 2jmc s VAL 55 N -2.82 -0.68 0.56 1.48 -7.23 -0.98 -3.43 120.40 107.29 2jmc s VAL 55 Ca 0.30 0.10 -0.18 0.00 -1.81 0.00 0.00 61.98 60.40 2jmc s VAL 55 Cb 0.02 -0.73 -0.05 0.00 0.56 0.00 0.00 36.38 36.18 2jmc s VAL 55 CO 0.14 0.02 1.06 -0.22 -0.31 0.00 0.00 175.10 175.79 2jmc s LEU 56 N 2.63 3.63 -0.48 1.32 1.98 0.82 -1.98 118.68 126.60 2jmc s LEU 56 Ca 0.02 1.91 -0.20 0.00 -2.89 0.00 0.00 54.13 52.97 2jmc s LEU 56 Cb -0.13 -4.55 0.04 0.00 0.66 0.00 0.00 46.19 42.22 2jmc s LEU 56 CO -0.14 -1.09 0.63 0.00 -1.89 0.00 0.00 176.35 173.86 2jmc s ALA 57 N -2.21 3.36 0.09 5.97 0.00 -0.17 -0.95 121.76 127.85 2jmc s ALA 57 Ca 0.66 -1.54 -0.14 0.00 0.00 0.00 0.00 51.96 50.94 2jmc s ALA 57 Cb -0.17 -3.33 -0.16 0.00 0.00 0.00 0.00 23.12 19.46 2jmc s ALA 57 CO 0.31 -1.93 1.30 -0.07 0.00 0.00 0.00 175.76 175.37 2jmc h LEU 58 N 9.71 0.89 -9.61 0.00 3.38 0.19 0.27 115.31 120.15 2jmc h LEU 58 Ca -0.27 -0.62 -0.59 0.00 0.09 0.00 0.00 57.88 56.49 2jmc h LEU 58 Cb 1.10 -0.26 -0.13 0.00 0.09 0.00 0.00 40.66 41.45 2jmc h LEU 58 CO 0.93 1.36 -0.52 -0.31 0.09 0.00 0.00 178.44 180.00 2jmc s TYR 59 N -3.77 1.83 -0.11 1.13 2.02 -0.47 -4.76 117.35 113.22 2jmc s TYR 59 Ca -0.11 -1.17 -0.15 0.00 -0.37 0.00 0.00 57.07 55.27 2jmc s TYR 59 Cb 0.08 -1.30 -0.05 0.00 -0.40 0.00 0.00 41.96 40.29 2jmc s TYR 59 CO 0.89 -0.12 0.38 0.16 -1.57 0.00 0.00 175.55 175.28 2jmc s ASP 60 N -3.68 6.60 0.22 2.29 -4.77 -1.26 -4.02 116.67 112.05 2jmc s ASP 60 Ca 0.19 0.71 0.02 0.00 -3.30 0.00 0.00 52.55 50.17 2jmc s ASP 60 Cb 0.03 -2.23 -0.05 0.00 -1.09 0.00 0.00 42.92 39.58 2jmc s ASP 60 CO 0.11 0.13 0.04 -0.47 0.70 0.00 0.00 175.17 175.68 2jmc s TYR 61 N 0.12 1.44 -0.25 2.11 6.14 -0.69 -4.97 117.35 121.26 2jmc s TYR 61 Ca 0.21 -1.07 -0.03 0.00 0.64 0.00 0.00 57.07 56.83 2jmc s TYR 61 Cb -0.14 -0.83 0.14 0.00 0.42 0.00 0.00 41.96 41.54 2jmc s TYR 61 CO 0.08 -0.23 0.39 -1.14 0.64 0.00 0.00 175.55 175.29 2jmc s GLN 62 N -3.96 0.36 -0.17 4.97 -0.44 -1.26 -2.57 119.66 116.59 2jmc s GLN 62 Ca 0.31 0.55 -0.07 0.00 -2.50 0.00 0.00 55.36 53.65 2jmc s GLN 62 Cb 0.07 -0.43 -0.04 0.00 -1.64 0.00 0.00 33.01 30.97 2jmc s GLN 62 CO 0.09 -0.65 0.06 -2.00 0.50 0.00 0.00 175.29 173.29 2jmc s GLU 63 N 2.56 3.89 -0.97 1.67 -6.30 0.13 -5.00 118.70 114.68 2jmc s GLU 63 Ca 0.13 -0.34 -0.04 0.00 -2.50 0.00 0.00 54.97 52.21 2jmc s GLU 63 Cb -0.15 -3.18 0.24 0.00 0.00 0.00 0.00 34.13 31.04 2jmc s GLU 63 CO -0.16 0.32 0.89 -1.54 0.02 0.00 0.00 175.26 174.79 2jmc s SER 64 N 0.23 6.46 0.00 -1.70 1.04 -1.26 -1.95 113.70 116.52 2jmc s SER 64 Ca 0.04 -3.67 0.00 0.00 0.48 0.00 0.00 55.95 52.80 2jmc s SER 64 Cb -0.12 -2.01 0.00 0.00 0.10 0.00 0.00 66.02 63.98 2jmc s SER 64 CO 0.00 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.61 2jmc n GLY 65 N 2.48 -0.84 2.77 7.32 0.00 -0.57 -3.68 105.19 112.68 2jmc n GLY 65 Ca 0.22 -0.72 -0.40 0.00 0.00 0.00 0.00 46.02 45.12 2jmc n GLY 65 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2jmc n ASP 66 N 0.00 0.40 -4.38 1.61 2.03 -1.13 -4.88 116.55 110.20 2jmc n ASP 66 Ca 0.00 0.32 -0.23 0.00 0.52 0.00 0.00 54.79 55.40 2jmc n ASP 66 Cb 0.00 -0.75 -0.11 0.00 -0.72 0.00 0.00 41.12 39.55 2jmc n ASP 66 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2jmc s ASN 67 N 6.32 2.98 0.21 1.67 3.04 -1.26 -4.91 114.94 122.98 2jmc s ASN 67 Ca 1.06 -0.91 -0.30 0.00 0.04 0.00 0.00 52.86 52.75 2jmc s ASN 67 Cb -1.11 -0.20 -0.08 0.00 -1.54 0.00 0.00 41.25 38.32 2jmc s ASN 67 CO 0.46 -0.01 1.06 0.00 -3.04 0.00 0.00 177.10 175.57 2jmc s ALA 68 N -2.16 3.36 -0.90 1.71 0.00 -1.26 -4.15 121.76 118.37 2jmc s ALA 68 Ca 0.20 0.78 -0.25 0.00 0.00 0.00 0.00 51.96 52.70 2jmc s ALA 68 Cb -0.05 -3.31 -0.05 0.00 0.00 0.00 0.00 23.12 19.70 2jmc s ALA 68 CO 0.09 -0.11 1.95 -1.25 0.00 0.00 0.00 175.76 176.44 2jmc s PRO 69 N -0.76 2.55 0.00 0.00 0.04 -1.26 -4.71 135.00 130.86 2jmc s PRO 69 Ca 0.46 -0.28 0.24 0.00 0.04 0.00 0.00 61.00 61.46 2jmc s PRO 69 Cb -0.29 -5.06 0.18 0.00 0.04 0.00 0.00 34.50 29.37 2jmc s PRO 69 CO 0.36 -3.38 1.23 -1.13 0.04 0.00 0.00 177.00 174.12 2jmc n SER 70 N 13.98 2.37 -4.25 6.66 3.41 -1.26 -4.96 113.62 129.57 2jmc n SER 70 Ca 0.40 -1.69 -0.19 0.00 -0.26 0.00 0.00 58.87 57.12 2jmc n SER 70 Cb 0.47 0.22 -0.10 0.00 -0.26 0.00 0.00 64.21 64.54 2jmc n SER 70 CO 0.00 0.00 0.00 -0.72 -0.16 0.00 0.00 175.04 174.16 2jmc s TYR 71 N -2.24 1.68 0.67 7.33 -0.85 -1.26 -5.15 117.35 117.52 2jmc s TYR 71 Ca 0.24 -1.19 -0.14 0.00 -0.52 0.00 0.00 57.07 55.46 2jmc s TYR 71 Cb 0.19 -1.01 0.00 0.00 0.38 0.00 0.00 41.96 41.53 2jmc s TYR 71 CO 0.44 -0.30 1.10 -1.12 -1.52 0.00 0.00 175.55 174.15 2jmc s SER 72 N -3.40 5.08 0.51 -0.18 0.01 -1.26 -5.00 113.70 109.45 2jmc s SER 72 Ca 0.35 1.97 -0.21 0.00 1.31 0.00 0.00 55.95 59.37 2jmc s SER 72 Cb 0.07 -2.55 -0.07 0.00 0.21 0.00 0.00 66.02 63.69 2jmc s SER 72 CO 0.15 -1.65 1.14 -2.16 0.41 0.00 0.00 173.24 171.14 2jmc s PRO 73 N -4.20 3.54 0.59 12.44 0.04 -1.26 -5.01 135.00 141.14 2jmc s PRO 73 Ca 0.66 1.68 -0.18 0.00 0.04 0.00 0.00 61.00 63.20 2jmc s PRO 73 Cb -0.20 -2.18 -0.04 0.00 0.04 0.00 0.00 34.50 32.12 2jmc s PRO 73 CO 0.43 -0.71 1.12 -1.25 0.04 0.00 0.00 177.00 176.63 2jmc s PRO 74 N -3.02 3.13 0.02 0.56 0.04 -1.26 -4.98 135.00 129.50 2jmc s PRO 74 Ca 0.69 1.52 -0.30 0.00 0.04 0.00 0.00 61.00 62.94 2jmc s PRO 74 Cb -0.26 -1.98 -0.06 0.00 0.04 0.00 0.00 34.50 32.24 2jmc s PRO 74 CO 0.30 -1.01 1.44 -1.25 0.04 0.00 0.00 177.00 176.52 2jmc s PRO 75 N -3.61 4.27 1.02 0.56 0.04 -1.26 -4.98 135.00 131.03 2jmc s PRO 75 Ca 0.70 2.03 -0.13 0.00 0.04 0.00 0.00 61.00 63.65 2jmc s PRO 75 Cb -0.22 -3.54 0.20 0.00 0.04 0.00 0.00 34.50 30.97 2jmc s PRO 75 CO 0.33 -0.58 1.09 -1.25 0.04 0.00 0.00 177.00 176.63 2jmc s PRO 76 N 2.30 0.28 0.00 0.56 0.04 -1.26 -5.15 135.00 131.78 2jmc s PRO 76 Ca 0.65 0.47 0.16 0.00 0.04 0.00 0.00 61.00 62.32 2jmc s PRO 76 Cb -0.33 -1.72 0.95 0.00 0.04 0.00 0.00 34.50 33.44 2jmc s PRO 76 CO 0.28 -2.82 1.36 -0.35 0.04 0.00 0.00 177.00 175.51