#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 0.15 -0.92 4.61 0.00 -1.26 -5.06 120.51 118.02 2jmc n ALA 2 Ca 0.00 -0.30 -0.30 0.00 0.00 0.00 0.00 53.44 52.84 2jmc n ALA 2 Cb 0.00 0.10 0.02 0.00 0.00 0.00 0.00 19.45 19.57 2jmc n ALA 2 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2jmc n MET 3 N -0.92 0.00 -4.06 0.00 0.00 -1.26 -4.99 117.12 105.89 2jmc n MET 3 Ca 0.01 0.00 -0.13 0.00 0.00 0.00 0.00 57.70 57.58 2jmc n MET 3 Cb 0.09 -0.79 -0.04 0.00 0.00 0.00 0.00 33.22 32.47 2jmc n MET 3 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2jmc s GLY 4 N -0.79 1.24 0.00 3.03 0.00 -1.26 -5.01 107.32 104.53 2jmc s GLY 4 Ca 0.41 -1.36 0.11 0.00 0.00 0.00 0.00 44.72 43.87 2jmc s GLY 4 CO 0.57 -0.92 1.10 -1.55 0.00 0.00 0.00 173.10 172.30 2jmc n PRO 5 N -0.51 0.49 -0.98 2.90 -0.04 -1.26 -4.85 135.00 130.75 2jmc n PRO 5 Ca 0.00 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.08 2jmc n PRO 5 Cb 0.62 -1.35 -0.10 0.00 -0.04 0.00 0.00 33.50 32.63 2jmc n PRO 5 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 2jmc n ARG 6 N -0.85 0.00 -4.17 0.54 1.85 -1.26 -4.43 116.66 108.34 2jmc n ARG 6 Ca 0.08 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 56.71 2jmc n ARG 6 Cb 0.04 -1.09 -0.06 0.00 -1.05 0.00 0.00 32.46 30.30 2jmc n ARG 6 CO 0.00 0.00 0.00 -1.83 -0.01 0.00 0.00 177.63 175.79 2jmc s GLU 7 N 5.18 2.45 -0.24 2.89 -1.05 -1.26 -3.94 118.70 122.72 2jmc s GLU 7 Ca 0.92 -1.41 -0.09 0.00 -0.15 0.00 0.00 54.97 54.24 2jmc s GLU 7 Cb -1.03 -2.25 -0.04 0.00 -0.44 0.00 0.00 34.13 30.38 2jmc s GLU 7 CO 0.43 0.26 0.12 0.54 0.95 0.00 0.00 175.26 177.56 2jmc s VAL 8 N -2.33 4.95 -0.01 1.83 0.11 -1.26 -4.65 120.40 119.03 2jmc s VAL 8 Ca 0.35 0.04 0.05 0.00 -2.93 0.00 0.00 61.98 59.49 2jmc s VAL 8 Cb -0.05 -3.31 -0.01 0.00 -1.53 0.00 0.00 36.38 31.48 2jmc s VAL 8 CO 0.22 0.34 -0.17 0.42 -3.33 0.00 0.00 175.10 172.58 2jmc s THR 9 N 1.25 1.38 -0.29 5.04 -4.23 -1.26 -1.06 115.64 116.47 2jmc s THR 9 Ca 0.06 -0.76 -0.00 0.00 -1.18 0.00 0.00 61.69 59.81 2jmc s THR 9 Cb -0.14 -1.15 0.06 0.00 1.34 0.00 0.00 72.50 72.60 2jmc s THR 9 CO 0.05 0.38 -0.03 -0.04 -0.54 0.00 0.00 174.62 174.44 2jmc s MET 10 N -0.45 2.34 -0.02 3.99 -1.94 -1.12 -4.97 119.30 117.14 2jmc s MET 10 Ca 0.07 -1.32 -0.16 0.00 -1.71 0.00 0.00 55.69 52.56 2jmc s MET 10 Cb -0.07 -3.11 -0.05 0.00 2.01 0.00 0.00 34.83 33.61 2jmc s MET 10 CO -0.01 -0.62 0.45 0.21 -0.01 0.00 0.00 175.02 175.04 2jmc s LYS 11 N 1.20 4.09 -0.41 2.03 2.20 -1.26 -1.29 119.74 126.29 2jmc s LYS 11 Ca -0.06 0.48 -0.41 0.00 -0.36 0.00 0.00 55.97 55.63 2jmc s LYS 11 Cb -0.20 -3.28 -0.16 0.00 -1.51 0.00 0.00 37.83 32.68 2jmc s LYS 11 CO -0.02 0.54 2.05 1.17 -0.36 0.00 0.00 175.35 178.72 2jmc n LYS 12 N 2.31 0.57 -0.67 4.03 4.81 -1.22 -2.88 118.16 125.11 2jmc n LYS 12 Ca -0.11 0.17 0.00 0.00 -0.87 0.00 0.00 58.31 57.50 2jmc n LYS 12 Cb 0.52 -1.94 0.00 0.00 0.02 0.00 0.00 35.03 33.63 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 6.36 0.71 3.45 3.14 0.00 0.73 -5.01 105.19 114.58 2jmc n GLY 13 Ca 0.44 -0.55 -0.15 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.30 -0.55 -0.04 1.61 -1.08 -1.14 -4.92 116.67 108.25 2jmc s ASP 14 Ca 0.00 0.83 -0.15 0.00 -0.52 0.00 0.00 52.55 52.71 2jmc s ASP 14 Cb 0.00 0.82 -0.05 0.00 -1.46 0.00 0.00 42.92 42.23 2jmc s ASP 14 CO 0.00 -0.38 0.40 -0.63 0.52 0.00 0.00 175.17 175.08 2jmc s ILE 15 N -0.49 5.10 -0.04 4.11 1.01 -1.26 -0.66 121.20 128.97 2jmc s ILE 15 Ca -0.06 0.81 -0.02 0.00 0.00 0.00 0.00 60.65 61.38 2jmc s ILE 15 Cb -0.03 -3.71 0.03 0.00 0.01 0.00 0.00 42.46 38.76 2jmc s ILE 15 CO 0.05 0.51 0.05 -0.76 0.00 0.00 0.00 174.94 174.79 2jmc s LEU 16 N -0.58 0.29 -0.46 2.97 1.02 -0.79 -4.98 118.68 116.15 2jmc s LEU 16 Ca 0.23 0.07 -0.45 0.00 0.02 0.00 0.00 54.13 53.99 2jmc s LEU 16 Cb -0.16 -0.15 -0.19 0.00 0.02 0.00 0.00 46.19 45.71 2jmc s LEU 16 CO 0.11 -0.23 1.69 0.41 0.02 0.00 0.00 176.35 178.36 2jmc n THR 17 N 5.14 0.05 -1.15 5.49 -1.04 -1.25 -2.43 114.28 119.09 2jmc n THR 17 Ca -0.07 -0.01 -0.32 0.00 -2.04 0.00 0.00 64.05 61.61 2jmc n THR 17 Cb 0.50 -0.64 -0.10 0.00 -1.82 0.00 0.00 70.33 68.27 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 4.70 1.76 0.00 -4.42 0.00 0.14 -2.92 117.00 116.26 2jmc n LEU 18 Ca 0.33 -2.23 -0.21 0.00 0.00 0.00 0.00 56.01 53.90 2jmc n LEU 18 Cb -0.02 -1.16 0.20 0.00 0.00 0.00 0.00 43.42 42.43 2jmc n LEU 18 CO 0.88 -2.36 0.23 0.18 0.00 0.00 0.00 177.39 176.32 2jmc n LEU 19 N 13.35 0.00 -4.47 -1.96 4.32 0.10 -4.63 117.00 123.72 2jmc n LEU 19 Ca 0.45 -0.59 -0.44 0.00 -0.02 0.00 0.00 56.01 55.41 2jmc n LEU 19 Cb 0.44 -0.68 -0.13 0.00 -1.62 0.00 0.00 43.42 41.43 2jmc n LEU 19 CO 0.90 -2.43 2.11 0.59 -1.22 0.00 0.00 177.39 177.35 2jmc n ASN 20 N -4.78 0.70 -1.03 -1.43 4.13 -1.25 -4.41 115.26 107.18 2jmc n ASN 20 Ca 0.09 0.18 0.07 0.00 1.68 0.00 0.00 54.58 56.60 2jmc n ASN 20 Cb 0.41 -1.02 0.22 0.00 -1.54 0.00 0.00 39.78 37.85 2jmc n ASN 20 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2jmc n SER 21 N 10.71 2.99 -0.26 6.41 3.41 -1.26 -2.21 113.62 133.40 2jmc n SER 21 Ca 0.60 -2.19 0.02 0.00 -0.26 0.00 0.00 58.87 57.04 2jmc n SER 21 Cb 0.09 -0.41 0.07 0.00 -0.26 0.00 0.00 64.21 63.70 2jmc n SER 21 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 2jmc n THR 22 N 0.72 -0.32 -1.94 6.66 5.66 -1.26 -4.33 114.28 119.46 2jmc n THR 22 Ca 0.16 1.61 -0.37 0.00 -3.05 0.00 0.00 64.05 62.41 2jmc n THR 22 Cb 0.54 -2.19 0.04 0.00 -1.55 0.00 0.00 70.33 67.17 2jmc n THR 22 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 2jmc s ASN 23 N -5.21 5.19 -0.17 1.09 -0.87 -1.24 -4.98 114.94 108.75 2jmc s ASN 23 Ca -0.10 2.50 -0.14 0.00 -1.57 0.00 0.00 52.86 53.55 2jmc s ASN 23 Cb 0.17 -2.61 -0.10 0.00 -0.02 0.00 0.00 41.25 38.69 2jmc s ASN 23 CO 0.53 -1.60 -0.01 0.11 -2.57 0.00 0.00 177.10 173.55 2jmc h LYS 24 N 1.05 0.00 0.00 -0.60 1.57 -2.01 -3.37 116.57 113.21 2jmc h LYS 24 Ca -0.51 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.27 2jmc h LYS 24 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 2jmc h LYS 24 CO 0.56 0.41 0.00 -0.25 -0.57 0.00 0.00 179.45 179.60 2jmc n ASP 25 N -4.55 0.00 -3.69 0.86 8.00 -1.26 -4.63 116.55 111.29 2jmc n ASP 25 Ca -0.17 -0.34 -0.16 0.00 0.71 0.00 0.00 54.79 54.83 2jmc n ASP 25 Cb 0.43 -0.19 -0.15 0.00 -0.02 0.00 0.00 41.12 41.19 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 -2.37 -0.18 -0.31 1.24 0.52 -1.26 -3.21 118.94 113.37 2jmc s TRP 26 Ca 0.30 0.59 -0.04 0.00 0.02 0.00 0.00 56.10 56.97 2jmc s TRP 26 Cb 0.18 -0.21 0.04 0.00 -1.15 0.00 0.00 33.47 32.32 2jmc s TRP 26 CO 0.36 -0.25 0.03 -1.58 0.02 0.00 0.00 176.95 175.54 2jmc s TRP 27 N 2.03 3.22 0.23 -1.98 0.52 0.34 -3.63 118.94 119.68 2jmc s TRP 27 Ca 0.00 -1.60 -0.32 0.00 0.02 0.00 0.00 56.10 54.20 2jmc s TRP 27 Cb -0.12 -2.17 -0.12 0.00 -1.15 0.00 0.00 33.47 29.91 2jmc s TRP 27 CO -0.06 -0.75 1.68 1.17 0.02 0.00 0.00 176.95 179.01 2jmc n LYS 28 N 4.71 2.72 -3.80 4.98 4.81 -0.94 -3.46 118.16 127.17 2jmc n LYS 28 Ca -0.13 0.98 -0.13 0.00 -0.87 0.00 0.00 58.31 58.16 2jmc n LYS 28 Cb 0.45 -2.80 -0.12 0.00 0.02 0.00 0.00 35.03 32.58 2jmc n LYS 28 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 2jmc s VAL 29 N 0.82 -0.00 0.43 3.15 -7.23 -0.96 -0.73 120.40 115.88 2jmc s VAL 29 Ca 0.72 0.01 0.01 0.00 -1.81 0.00 0.00 61.98 60.91 2jmc s VAL 29 Cb -0.51 -0.28 -0.01 0.00 0.56 0.00 0.00 36.38 36.14 2jmc s VAL 29 CO 0.37 0.00 0.64 -0.70 -0.31 0.00 0.00 175.10 175.11 2jmc s GLU 30 N 0.18 3.11 -0.40 4.82 2.12 -1.15 -2.82 118.70 124.56 2jmc s GLU 30 Ca -0.01 -0.52 0.06 0.00 0.36 0.00 0.00 54.97 54.86 2jmc s GLU 30 Cb -0.02 -2.59 0.21 0.00 0.26 0.00 0.00 34.13 31.99 2jmc s GLU 30 CO -0.00 -0.20 0.44 0.28 -0.54 0.00 0.00 175.26 175.24 2jmc n VAL 31 N -2.01 -0.93 0.00 3.70 0.31 0.64 -3.87 118.33 116.16 2jmc n VAL 31 Ca 0.01 -3.62 0.00 0.00 -0.01 0.00 0.00 64.34 60.71 2jmc n VAL 31 Cb 0.58 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.81 2jmc n VAL 31 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2jmc n ASN 32 N 2.14 0.00 0.00 4.52 3.02 -1.26 -1.69 115.26 121.99 2jmc n ASN 32 Ca 0.25 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.80 2jmc n ASN 32 Cb 0.51 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.68 2jmc n ASN 32 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2jmc n ASP 33 N 2.22 2.27 -4.52 6.41 2.03 -1.26 -5.03 116.55 118.67 2jmc n ASP 33 Ca 0.00 -0.09 -0.35 0.00 0.52 0.00 0.00 54.79 54.87 2jmc n ASP 33 Cb 0.00 0.63 -0.11 0.00 -0.72 0.00 0.00 41.12 40.92 2jmc n ASP 33 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2jmc s ARG 34 N -1.09 3.77 0.15 -0.67 0.52 -0.68 -5.03 118.95 115.93 2jmc s ARG 34 Ca 0.00 -0.44 0.05 0.00 -0.52 0.00 0.00 55.73 54.82 2jmc s ARG 34 Cb 0.00 -3.20 -0.04 0.00 0.52 0.00 0.00 34.95 32.23 2jmc s ARG 34 CO 0.00 0.06 -0.11 1.14 0.02 0.00 0.00 175.30 176.42 2jmc s GLN 35 N 0.91 1.08 0.00 3.54 -2.07 -1.26 0.23 119.66 122.10 2jmc s GLN 35 Ca 0.03 -1.45 0.00 0.00 -1.82 0.00 0.00 55.36 52.12 2jmc s GLN 35 Cb -0.14 -0.69 0.00 0.00 -1.09 0.00 0.00 33.01 31.09 2jmc s GLN 35 CO 0.02 0.09 0.00 0.41 -1.32 0.00 0.00 175.29 174.50 2jmc n GLY 36 N -0.17 -0.24 3.74 2.60 0.00 -1.13 -4.10 105.19 105.90 2jmc n GLY 36 Ca -0.10 -1.06 -0.40 0.00 0.00 0.00 0.00 46.02 44.45 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 3.83 0.04 1.61 0.08 -1.26 -2.25 117.98 118.03 2jmc s PHE 37 Ca 0.00 1.73 -0.01 0.00 0.12 0.00 0.00 56.93 58.77 2jmc s PHE 37 Cb 0.00 -2.97 -0.03 0.00 -0.57 0.00 0.00 43.02 39.46 2jmc s PHE 37 CO 0.00 0.29 -0.01 0.14 -0.10 0.00 0.00 175.22 175.53 2jmc s VAL 38 N -0.29 0.17 -0.19 -0.44 -7.23 -1.22 -4.90 120.40 106.29 2jmc s VAL 38 Ca 0.43 -1.37 -0.29 0.00 -1.81 0.00 0.00 61.98 58.94 2jmc s VAL 38 Cb -0.23 -0.95 -0.03 0.00 0.56 0.00 0.00 36.38 35.73 2jmc s VAL 38 CO 0.28 -0.76 1.59 -2.16 -0.31 0.00 0.00 175.10 173.74 2jmc s PRO 39 N -2.81 3.91 0.54 4.82 0.04 -1.26 0.13 135.00 140.36 2jmc s PRO 39 Ca -0.03 1.75 0.24 0.00 0.04 0.00 0.00 61.00 63.00 2jmc s PRO 39 Cb -0.00 -4.00 1.28 0.00 0.04 0.00 0.00 34.50 31.82 2jmc s PRO 39 CO -0.06 -1.15 1.69 0.00 0.04 0.00 0.00 177.00 177.51 2jmc h ALA 40 N 10.25 1.28 0.00 8.56 0.00 -1.81 0.27 119.26 137.81 2jmc h ALA 40 Ca -0.34 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 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 -0.28 -0.28 0.00 0.00 0.00 0.00 179.25 179.68 2jmc h ALA 41 N 1.30 1.32 -0.00 0.00 0.00 -1.89 -2.13 119.26 117.86 2jmc h ALA 41 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2jmc h ALA 41 Cb 0.63 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.38 2jmc h ALA 41 CO 0.00 0.35 -0.41 0.66 0.00 0.00 0.00 179.25 179.84 2jmc n TYR 42 N -3.89 0.00 -4.51 0.00 4.02 0.94 -4.74 117.16 108.97 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 0.36 -0.21 -0.08 0.00 -0.02 0.00 0.00 39.34 39.38 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 -2.84 0.65 -0.25 -0.72 -7.23 -0.80 0.85 120.40 110.06 2jmc s VAL 43 Ca 0.15 -2.00 -0.27 0.00 -1.81 0.00 0.00 61.98 58.05 2jmc s VAL 43 Cb 0.18 -2.37 0.15 0.00 0.56 0.00 0.00 36.38 34.89 2jmc s VAL 43 CO 0.64 0.00 1.15 -0.75 -0.31 0.00 0.00 175.10 175.83 2jmc s LYS 44 N -3.73 0.37 0.58 4.82 2.36 -0.59 -4.78 119.74 118.77 2jmc s LYS 44 Ca 0.24 0.26 -0.20 0.00 -2.55 0.00 0.00 55.97 53.73 2jmc s LYS 44 Cb 0.03 0.18 -0.04 0.00 -1.05 0.00 0.00 37.83 36.95 2jmc s LYS 44 CO 0.14 -0.08 1.27 0.15 1.55 0.00 0.00 175.35 178.38 2jmc s LYS 45 N -0.41 2.99 0.47 4.03 1.02 -1.26 -0.61 119.74 125.97 2jmc s LYS 45 Ca 0.03 2.01 0.04 0.00 0.02 0.00 0.00 55.97 58.07 2jmc s LYS 45 Cb -0.03 -2.05 0.04 0.00 -0.52 0.00 0.00 37.83 35.27 2jmc s LYS 45 CO -0.06 -1.24 0.35 1.28 -0.92 0.00 0.00 175.35 174.76 2jmc n LEU 46 N -1.39 0.00 -4.33 3.17 4.77 -1.21 -4.77 117.00 113.24 2jmc n LEU 46 Ca 0.13 -2.44 -0.37 0.00 -0.03 0.00 0.00 56.01 53.30 2jmc n LEU 46 Cb 0.48 -0.03 -0.13 0.00 -2.33 0.00 0.00 43.42 41.41 2jmc n LEU 46 CO 0.48 -0.54 -0.28 -1.81 -1.33 0.00 0.00 177.39 173.91 2jmc s ASP 47 N -3.74 5.10 -0.09 -1.43 1.11 -1.26 -4.93 116.67 111.43 2jmc s ASP 47 Ca 0.26 -0.74 -0.04 0.00 0.18 0.00 0.00 52.55 52.21 2jmc s ASP 47 Cb -0.02 -1.87 -0.04 0.00 1.07 0.00 0.00 42.92 42.06 2jmc s ASP 47 CO 0.17 -0.20 -0.11 -0.24 1.18 0.00 0.00 175.17 175.97 2jmc n SER 48 N 4.85 0.64 -0.05 0.27 2.88 -1.26 -5.03 113.62 115.93 2jmc n SER 48 Ca -0.14 0.11 -0.01 0.00 -1.33 0.00 0.00 58.87 57.50 2jmc n SER 48 Cb 0.48 -0.26 -0.00 0.00 -0.75 0.00 0.00 64.21 63.67 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 2.45 0.48 0.01 0.46 0.00 -1.26 -4.86 105.19 102.46 2jmc n GLY 49 Ca -0.17 -0.37 0.02 0.00 0.00 0.00 0.00 46.02 45.49 2jmc n GLY 49 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2jmc n THR 50 N -2.93 0.08 0.00 2.61 5.66 -1.26 -5.03 114.28 113.42 2jmc n THR 50 Ca -0.01 -0.15 0.00 0.00 -3.05 0.00 0.00 64.05 60.84 2jmc n THR 50 Cb 0.05 0.08 0.00 0.00 -1.55 0.00 0.00 70.33 68.91 2jmc n THR 50 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2jmc n GLY 51 N 2.30 1.39 3.80 1.09 0.00 -1.26 -5.13 105.19 107.37 2jmc n GLY 51 Ca -0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.27 2.70 -0.63 1.61 -0.14 -1.26 -5.09 119.74 116.66 2jmc s LYS 52 Ca 0.00 -1.25 -0.02 0.00 -1.36 0.00 0.00 55.97 53.35 2jmc s LYS 52 Cb 0.00 -2.43 0.16 0.00 -1.68 0.00 0.00 37.83 33.88 2jmc s LYS 52 CO 0.00 0.26 0.44 -1.21 -0.76 0.00 0.00 175.35 174.07 2jmc s GLU 53 N -3.87 2.53 0.24 1.68 0.41 -1.26 -4.96 118.70 113.47 2jmc s GLU 53 Ca 0.36 -2.63 0.10 0.00 -0.41 0.00 0.00 54.97 52.39 2jmc s GLU 53 Cb -0.06 -3.68 -0.05 0.00 -1.78 0.00 0.00 34.13 28.56 2jmc s GLU 53 CO 0.24 -1.17 -0.17 -0.48 -0.49 0.00 0.00 175.26 173.19 2jmc s LEU 54 N -0.24 2.57 -0.15 1.80 0.05 -1.26 0.23 118.68 121.68 2jmc s LEU 54 Ca 0.18 -1.02 -0.06 0.00 0.05 0.00 0.00 54.13 53.28 2jmc s LEU 54 Cb -0.20 -0.90 0.07 0.00 -2.05 0.00 0.00 46.19 43.11 2jmc s LEU 54 CO -0.04 -0.06 0.32 0.68 -0.55 0.00 0.00 176.35 176.71 2jmc s VAL 55 N -2.70 -0.48 0.55 1.48 -7.23 -1.02 -3.28 120.40 107.73 2jmc s VAL 55 Ca 0.26 0.24 -0.15 0.00 -1.81 0.00 0.00 61.98 60.51 2jmc s VAL 55 Cb -0.03 -0.52 -0.06 0.00 0.56 0.00 0.00 36.38 36.33 2jmc s VAL 55 CO 0.11 0.10 1.01 -0.22 -0.31 0.00 0.00 175.10 175.79 2jmc s LEU 56 N 2.43 3.52 -0.33 1.32 0.20 0.22 -1.89 118.68 124.15 2jmc s LEU 56 Ca -0.00 1.60 -0.18 0.00 0.69 0.00 0.00 54.13 56.23 2jmc s LEU 56 Cb -0.12 -4.51 -0.01 0.00 -0.43 0.00 0.00 46.19 41.13 2jmc s LEU 56 CO -0.10 -0.78 0.51 0.00 -0.29 0.00 0.00 176.35 175.69 2jmc s ALA 57 N -2.69 3.50 -0.03 5.97 0.00 0.16 -1.55 121.76 127.11 2jmc s ALA 57 Ca 0.59 -0.93 -0.14 0.00 0.00 0.00 0.00 51.96 51.48 2jmc s ALA 57 Cb -0.11 -2.99 -0.32 0.00 0.00 0.00 0.00 23.12 19.69 2jmc s ALA 57 CO 0.37 -1.13 0.78 -0.07 0.00 0.00 0.00 175.76 175.71 2jmc h LEU 58 N 9.04 0.65 0.00 0.00 3.38 0.15 0.21 115.31 128.74 2jmc h LEU 58 Ca -0.28 -0.92 -0.49 0.00 0.09 0.00 0.00 57.88 56.27 2jmc h LEU 58 Cb 1.13 -0.21 -0.09 0.00 0.09 0.00 0.00 40.66 41.57 2jmc h LEU 58 CO 0.76 1.71 -0.36 -1.22 0.09 0.00 0.00 178.44 179.42 2jmc n TYR 59 N -3.72 0.80 -3.68 1.13 4.01 -0.75 -4.71 117.16 110.25 2jmc n TYR 59 Ca -0.21 -1.91 -0.37 0.00 -0.16 0.00 0.00 57.90 55.24 2jmc n TYR 59 Cb 1.04 -0.23 -0.11 0.00 -0.31 0.00 0.00 39.34 39.74 2jmc n TYR 59 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2jmc s ASP 60 N -3.10 5.77 0.29 7.72 2.15 -1.25 -3.39 116.67 124.86 2jmc s ASP 60 Ca 0.02 -0.03 0.07 0.00 0.43 0.00 0.00 52.55 53.03 2jmc s ASP 60 Cb 0.00 -2.05 -0.06 0.00 -0.30 0.00 0.00 42.92 40.51 2jmc s ASP 60 CO 0.01 -0.01 -0.06 -0.47 -0.17 0.00 0.00 175.17 174.48 2jmc s TYR 61 N 1.50 2.00 -0.25 -5.34 6.14 -0.41 -4.99 117.35 115.99 2jmc s TYR 61 Ca 0.07 -0.69 -0.02 0.00 0.64 0.00 0.00 57.07 57.06 2jmc s TYR 61 Cb -0.15 -1.15 0.14 0.00 0.42 0.00 0.00 41.96 41.22 2jmc s TYR 61 CO 0.07 0.30 0.40 -1.14 0.64 0.00 0.00 175.55 175.82 2jmc s GLN 62 N -3.72 0.37 0.00 4.97 -0.44 -1.26 -2.78 119.66 116.80 2jmc s GLN 62 Ca 0.30 0.56 0.00 0.00 -2.50 0.00 0.00 55.36 53.72 2jmc s GLN 62 Cb 0.04 -0.37 0.00 0.00 -1.64 0.00 0.00 33.01 31.04 2jmc s GLN 62 CO 0.12 -0.66 0.00 -1.91 0.50 0.00 0.00 175.29 173.35 2jmc n GLU 63 N 5.37 1.47 -3.15 1.67 0.00 -0.22 -5.02 120.64 120.76 2jmc n GLU 63 Ca -0.03 0.00 0.05 0.00 0.00 0.00 0.00 57.16 57.18 2jmc n GLU 63 Cb 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 31.44 31.93 2jmc n GLU 63 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2jmc s SER 64 N -0.99 -0.88 0.20 4.31 0.15 -1.26 -4.38 113.70 110.84 2jmc s SER 64 Ca 0.00 0.37 0.00 0.00 0.70 0.00 0.00 55.95 57.02 2jmc s SER 64 Cb 0.00 1.66 0.00 0.00 -1.71 0.00 0.00 66.02 65.97 2jmc s SER 64 CO 0.00 -0.16 0.00 0.61 1.20 0.00 0.00 173.24 174.89 2jmc n GLY 65 N 5.38 -5.12 2.78 9.45 0.00 -1.25 -4.59 105.19 111.83 2jmc n GLY 65 Ca -0.00 -0.32 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 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 1.51 0.40 -4.22 1.61 5.75 -1.26 -4.88 116.55 115.46 2jmc n ASP 66 Ca 0.00 0.32 -0.28 0.00 -0.01 0.00 0.00 54.79 54.83 2jmc n ASP 66 Cb 0.00 -0.75 -0.16 0.00 -1.03 0.00 0.00 41.12 39.19 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 6.31 2.54 0.25 -1.12 0.02 -1.26 -4.98 114.94 116.69 2jmc s ASN 67 Ca 1.06 -0.40 -0.30 0.00 -1.02 0.00 0.00 52.86 52.20 2jmc s ASN 67 Cb -1.12 -0.42 -0.09 0.00 0.02 0.00 0.00 41.25 39.65 2jmc s ASN 67 CO 0.46 0.24 1.10 0.00 0.02 0.00 0.00 177.10 178.92 2jmc s ALA 68 N -0.36 3.40 -1.19 0.60 0.00 -1.26 -4.08 121.76 118.86 2jmc s ALA 68 Ca 0.05 0.87 -0.23 0.00 0.00 0.00 0.00 51.96 52.64 2jmc s ALA 68 Cb -0.10 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.61 2jmc s ALA 68 CO 0.00 -0.16 1.93 -1.25 0.00 0.00 0.00 175.76 176.29 2jmc s PRO 69 N -1.13 2.49 0.00 0.00 0.04 -1.26 -4.65 135.00 130.49 2jmc s PRO 69 Ca 0.46 -1.19 0.27 0.00 0.04 0.00 0.00 61.00 60.58 2jmc s PRO 69 Cb -0.31 -5.25 0.88 0.00 0.04 0.00 0.00 34.50 29.86 2jmc s PRO 69 CO 0.39 -4.01 1.64 -1.13 0.04 0.00 0.00 177.00 173.94 2jmc n SER 70 N 14.42 1.43 -4.25 6.66 3.41 -1.26 -4.91 113.62 129.12 2jmc n SER 70 Ca 0.45 -1.32 -0.19 0.00 -0.26 0.00 0.00 58.87 57.55 2jmc n SER 70 Cb 0.47 0.06 -0.10 0.00 -0.26 0.00 0.00 64.21 64.37 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 -2.18 1.67 0.60 7.33 -0.85 -1.26 -5.15 117.35 117.51 2jmc s TYR 71 Ca 0.32 -1.19 -0.16 0.00 -0.52 0.00 0.00 57.07 55.52 2jmc s TYR 71 Cb 0.20 -1.00 -0.03 0.00 0.38 0.00 0.00 41.96 41.51 2jmc s TYR 71 CO 0.40 -0.30 1.08 -1.12 -1.52 0.00 0.00 175.55 174.10 2jmc s SER 72 N -3.40 5.61 0.49 -0.18 0.01 -1.26 -5.01 113.70 109.96 2jmc s SER 72 Ca 0.35 1.94 -0.21 0.00 1.31 0.00 0.00 55.95 59.34 2jmc s SER 72 Cb 0.07 -2.55 -0.07 0.00 0.21 0.00 0.00 66.02 63.68 2jmc s SER 72 CO 0.15 -1.29 1.15 -2.16 0.41 0.00 0.00 173.24 171.50 2jmc s PRO 73 N -3.88 3.60 0.57 12.44 0.04 -1.26 -5.01 135.00 141.48 2jmc s PRO 73 Ca 0.66 1.71 -0.19 0.00 0.04 0.00 0.00 61.00 63.22 2jmc s PRO 73 Cb -0.19 -2.24 -0.05 0.00 0.04 0.00 0.00 34.50 32.07 2jmc s PRO 73 CO 0.35 -0.67 1.13 -1.25 0.04 0.00 0.00 177.00 176.60 2jmc s PRO 74 N -2.94 3.24 0.03 0.56 0.04 -1.26 -4.98 135.00 129.70 2jmc s PRO 74 Ca 0.67 1.56 -0.30 0.00 0.04 0.00 0.00 61.00 62.97 2jmc s PRO 74 Cb -0.27 -1.99 -0.06 0.00 0.04 0.00 0.00 34.50 32.22 2jmc s PRO 74 CO 0.31 -0.93 1.43 -1.25 0.04 0.00 0.00 177.00 176.60 2jmc s PRO 75 N -3.46 4.28 1.01 0.56 0.04 -1.26 -4.98 135.00 131.20 2jmc s PRO 75 Ca 0.72 2.03 -0.13 0.00 0.04 0.00 0.00 61.00 63.66 2jmc s PRO 75 Cb -0.23 -3.51 0.20 0.00 0.04 0.00 0.00 34.50 31.00 2jmc s PRO 75 CO 0.30 -0.56 1.09 -1.25 0.04 0.00 0.00 177.00 176.62 2jmc s PRO 76 N 2.15 0.30 0.00 0.56 0.04 -1.26 -5.15 135.00 131.65 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 -0.34 -1.73 0.94 0.00 0.04 0.00 0.00 34.50 33.42 2jmc s PRO 76 CO 0.28 -2.81 1.35 -0.35 0.04 0.00 0.00 177.00 175.51