#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jmp h GLU 2 N 0.00 0.00 0.02 3.17 5.08 -2.04 -3.37 114.58 117.44 2jmp h GLU 2 Ca 0.00 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 2jmp h GLU 2 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 2jmp h GLU 2 CO 0.00 0.00 -0.16 0.37 -1.00 0.00 0.00 179.01 178.22 2jmp h GLN 3 N 0.00 -0.21 -0.53 2.33 -0.00 -2.02 2.04 115.11 116.71 2jmp h GLN 3 Ca 0.00 0.01 0.07 0.00 -0.00 0.00 0.00 58.65 58.74 2jmp h GLN 3 Cb 0.91 0.05 -0.10 0.00 0.00 0.00 0.00 27.48 28.35 2jmp h GLN 3 CO 0.00 -0.14 -0.50 0.35 0.00 0.00 0.00 178.83 178.54 2jmp h PHE 4 N -0.22 -1.50 -0.04 3.99 3.04 -2.00 0.94 116.94 121.15 2jmp h PHE 4 Ca 0.00 0.09 0.01 0.00 3.98 0.00 0.00 57.97 62.05 2jmp h PHE 4 Cb 0.23 0.73 -0.00 0.00 2.56 0.00 0.00 35.95 39.47 2jmp h PHE 4 CO -0.38 -0.45 0.07 -0.97 -2.02 0.00 0.00 178.31 174.56 2jmp h ASN 5 N -0.29 0.00 0.00 0.41 -1.24 -1.61 0.14 115.58 113.00 2jmp h ASN 5 Ca 0.13 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.14 2jmp h ASN 5 Cb 0.57 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.62 2jmp h ASN 5 CO -0.66 0.00 -0.10 0.00 -1.29 0.00 0.00 177.43 175.38 2jmp h ALA 6 N 1.91 0.00 -0.23 1.57 0.00 1.04 -2.29 119.26 121.25 2jmp h ALA 6 Ca 0.02 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 54.87 2jmp h ALA 6 Cb 0.15 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2jmp h ALA 6 CO -0.00 0.10 0.01 0.35 0.00 0.00 0.00 179.25 179.70 2jmp h PHE 7 N -0.97 0.01 0.27 0.00 3.57 -0.12 -2.05 116.94 117.65 2jmp h PHE 7 Ca 0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 2jmp h PHE 7 Cb 0.10 0.03 0.00 0.00 2.79 0.00 0.00 35.95 38.87 2jmp h PHE 7 CO -0.04 -0.02 -0.14 -0.22 -2.23 0.00 0.00 178.31 175.65 2jmp h LYS 8 N 0.09 -0.37 -0.27 1.11 3.64 -0.89 -1.77 116.57 118.11 2jmp h LYS 8 Ca 0.11 0.03 0.08 0.00 -1.27 0.00 0.00 60.65 59.59 2jmp h LYS 8 Cb 0.13 0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.03 2jmp h LYS 8 CO -0.18 -0.25 0.37 0.77 -2.27 0.00 0.00 179.45 177.89 2jmp h SER 9 N -0.39 0.00 -0.42 4.20 0.02 -1.18 0.68 113.55 116.47 2jmp h SER 9 Ca -0.03 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.84 2jmp h SER 9 Cb 0.31 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.82 2jmp h SER 9 CO 0.05 0.00 0.00 0.25 -1.14 0.00 0.00 176.83 175.99 2jmp h LEU 10 N 0.00 0.79 -0.13 5.07 6.46 -0.59 -2.84 115.31 124.06 2jmp h LEU 10 Ca 0.13 -0.19 -0.02 0.00 -0.12 0.00 0.00 57.88 57.68 2jmp h LEU 10 Cb 0.86 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 40.57 2jmp h LEU 10 CO -0.00 0.85 0.01 -0.07 -0.62 0.00 0.00 178.44 178.61 2jmp h LEU 11 N 0.76 0.22 -0.88 2.25 3.38 0.42 -2.72 115.31 118.74 2jmp h LEU 11 Ca 0.15 -0.28 0.13 0.00 0.09 0.00 0.00 57.88 57.96 2jmp h LEU 11 Cb 0.46 -0.06 -0.14 0.00 0.09 0.00 0.00 40.66 41.01 2jmp h LEU 11 CO 0.02 0.45 -0.37 0.29 0.09 0.00 0.00 178.44 178.92 2jmp n LYS 12 N -4.80 -0.23 -0.32 1.13 5.02 -1.06 0.30 118.16 118.20 2jmp n LYS 12 Ca -0.05 1.35 0.03 0.00 -2.02 0.00 0.00 58.31 57.62 2jmp n LYS 12 Cb 0.19 -2.00 0.17 0.00 -0.02 0.00 0.00 35.03 33.37 2jmp n LYS 12 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2jmp h LYS 13 N 0.00 0.91 0.18 1.97 1.79 -1.49 0.54 116.57 120.47 2jmp h LYS 13 Ca 0.28 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.69 2jmp h LYS 13 Cb 0.50 -0.21 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 2jmp h LYS 13 CO -0.87 0.60 -0.09 1.25 -1.08 0.00 0.00 179.45 179.27 2jmp h HIS 14 N 0.94 -0.22 0.00 -1.35 2.76 0.49 -3.20 115.15 114.57 2jmp h HIS 14 Ca 0.42 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.58 2jmp h HIS 14 Cb 0.30 0.07 0.00 0.00 1.55 0.00 0.00 27.41 29.34 2jmp h HIS 14 CO -0.03 -0.14 0.00 0.66 -1.30 0.00 0.00 177.93 177.12 2jmp n TYR 15 N -3.04 0.00 -0.24 5.26 4.02 0.42 -4.13 117.16 119.45 2jmp n TYR 15 Ca -0.03 0.00 0.05 0.00 -0.01 0.00 0.00 57.90 57.91 2jmp n TYR 15 Cb 0.09 -0.07 0.17 0.00 -0.02 0.00 0.00 39.34 39.51 2jmp n TYR 15 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 176.86 177.34 2jmp h GLU 16 N 0.25 0.24 -0.57 -0.72 4.22 0.10 0.99 114.58 119.09 2jmp h GLU 16 Ca 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.43 2jmp h GLU 16 Cb 0.37 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2jmp h GLU 16 CO 0.00 0.16 0.00 1.63 -2.18 0.00 0.00 179.01 178.62 2jmp n LYS 17 N -5.17 2.37 -2.91 1.92 5.02 -1.26 -4.11 118.16 114.02 2jmp n LYS 17 Ca 0.14 -1.43 -0.14 0.00 -2.02 0.00 0.00 58.31 54.86 2jmp n LYS 17 Cb 0.45 -1.57 0.00 0.00 -0.02 0.00 0.00 35.03 33.89 2jmp n LYS 17 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2jmp n THR 18 N 0.44 0.49 0.10 -0.18 -1.04 0.34 -4.96 114.28 109.47 2jmp n THR 18 Ca 0.13 -3.84 -0.05 0.00 -2.04 0.00 0.00 64.05 58.25 2jmp n THR 18 Cb 0.51 0.17 -0.02 0.00 -1.82 0.00 0.00 70.33 69.17 2jmp n THR 18 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 2jmp h ILE 19 N 2.05 0.00 -0.23 12.58 2.10 -1.66 -3.36 117.51 128.99 2jmp h ILE 19 Ca 0.00 -0.44 0.02 0.00 1.08 0.00 0.00 64.86 65.53 2jmp h ILE 19 Cb 1.07 0.00 -0.03 0.00 -1.09 0.00 0.00 36.82 36.77 2jmp h ILE 19 CO 0.51 0.00 -0.13 0.61 -1.08 0.00 0.00 178.15 178.05 2jmp n GLY 20 N 0.76 -0.83 0.28 8.18 0.00 -1.26 0.34 105.19 112.66 2jmp n GLY 20 Ca -0.04 0.32 0.05 0.00 0.00 0.00 0.00 46.02 46.35 2jmp n GLY 20 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2jmp n PHE 21 N -3.86 0.30 0.39 1.61 -0.00 -1.26 0.84 117.46 115.49 2jmp n PHE 21 Ca 0.00 0.97 -0.15 0.00 -0.00 0.00 0.00 57.45 58.27 2jmp n PHE 21 Cb 0.06 -0.97 -0.07 0.00 -0.00 0.00 0.00 39.48 38.50 2jmp n PHE 21 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 2jmp h HIS 22 N 0.00 -0.92 0.00 -5.13 2.76 0.54 -1.16 115.15 111.24 2jmp h HIS 22 Ca 0.39 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.54 2jmp h HIS 22 Cb 0.61 0.30 0.00 0.00 1.55 0.00 0.00 27.41 29.87 2jmp h HIS 22 CO -0.60 -0.57 0.07 -3.47 -1.30 0.00 0.00 177.93 172.06 2jmp n ASP 23 N -4.71 0.00 0.00 3.26 4.64 0.14 0.89 116.55 120.77 2jmp n ASP 23 Ca -0.12 0.27 0.00 0.00 -1.38 0.00 0.00 54.79 53.56 2jmp n ASP 23 Cb 0.39 -0.27 0.00 0.00 -1.04 0.00 0.00 41.12 40.20 2jmp n ASP 23 CO 0.00 0.00 0.00 1.17 -0.82 0.00 0.00 177.20 177.55 2jmp n LYS 24 N -1.24 0.00 0.00 -0.67 0.00 0.25 -4.76 118.16 111.74 2jmp n LYS 24 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 58.31 58.39 2jmp n LYS 24 Cb 0.07 -0.42 0.00 0.00 0.00 0.00 0.00 35.03 34.68 2jmp n LYS 24 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 2jmp n TYR 25 N -1.30 0.00 -0.53 5.64 4.02 -0.63 -4.53 117.16 119.82 2jmp n TYR 25 Ca 0.00 0.00 0.42 0.00 -0.01 0.00 0.00 57.90 58.31 2jmp n TYR 25 Cb 0.00 0.00 0.64 0.00 -0.02 0.00 0.00 39.34 39.96 2jmp n TYR 25 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 2jmp n ILE 26 N -1.91 0.00 0.00 -0.72 -0.00 -1.24 -4.52 119.36 110.97 2jmp n ILE 26 Ca 0.00 1.22 0.00 0.00 -0.00 0.00 0.00 62.75 63.97 2jmp n ILE 26 Cb 0.00 -2.06 0.00 0.00 -0.00 0.00 0.00 39.64 37.58 2jmp n ILE 26 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.55 177.72 2jmp n LYS 27 N -3.50 0.00 -3.84 0.38 4.81 0.26 -3.20 118.16 113.07 2jmp n LYS 27 Ca 0.35 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.51 2jmp n LYS 27 Cb 1.64 0.00 -0.12 0.00 0.02 0.00 0.00 35.03 36.57 2jmp n LYS 27 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 2jmp s ASP 28 N 0.00 4.36 0.05 3.14 3.84 -1.26 -4.87 116.67 121.92 2jmp s ASP 28 Ca 0.00 -3.70 0.00 0.00 -0.00 0.00 0.00 52.55 48.85 2jmp s ASP 28 Cb 0.00 -1.48 0.00 0.00 -1.38 0.00 0.00 42.92 40.06 2jmp s ASP 28 CO 0.00 -0.10 0.00 -0.38 -0.00 0.00 0.00 175.17 174.69 2jmp n ILE 29 N 2.16 0.00 -2.59 2.11 5.41 -1.19 -5.08 119.36 120.18 2jmp n ILE 29 Ca 0.20 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.94 2jmp n ILE 29 Cb 0.36 -1.39 0.06 0.00 -0.71 0.00 0.00 39.64 37.97 2jmp n ILE 29 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 2jmp n ASN 30 N -0.37 -0.78 -3.71 4.38 6.94 -1.26 -5.10 115.26 115.36 2jmp n ASN 30 Ca 0.00 -1.64 -0.30 0.00 -0.02 0.00 0.00 54.58 52.63 2jmp n ASN 30 Cb 0.00 0.38 -0.15 0.00 -2.36 0.00 0.00 39.78 37.65 2jmp n ASN 30 CO 0.00 0.00 0.00 -0.60 -1.03 0.00 0.00 177.26 175.63 2jmp s ARG 31 N 0.07 0.64 0.02 -3.83 6.06 -1.26 -5.11 118.95 115.54 2jmp s ARG 31 Ca 0.05 -0.97 -0.10 0.00 -2.50 0.00 0.00 55.73 52.22 2jmp s ARG 31 Cb 0.23 -1.88 0.01 0.00 0.06 0.00 0.00 34.95 33.36 2jmp s ARG 31 CO -0.07 -0.97 0.19 -0.59 -2.50 0.00 0.00 175.30 171.36 2jmp s PHE 32 N 1.69 0.01 -0.09 5.12 -0.71 -1.26 -2.62 117.98 120.12 2jmp s PHE 32 Ca 0.09 -0.12 -0.01 0.00 -1.04 0.00 0.00 56.93 55.84 2jmp s PHE 32 Cb -0.17 -0.02 0.03 0.00 -1.21 0.00 0.00 43.02 41.65 2jmp s PHE 32 CO -0.26 -0.37 -0.01 0.14 -1.34 0.00 0.00 175.22 173.38 2jmp s VAL 33 N -1.87 0.53 -0.12 -2.49 -7.23 -0.81 -5.01 120.40 103.40 2jmp s VAL 33 Ca -0.11 -0.03 0.03 0.00 -1.81 0.00 0.00 61.98 60.06 2jmp s VAL 33 Cb -0.04 -0.69 0.01 0.00 0.56 0.00 0.00 36.38 36.22 2jmp s VAL 33 CO -0.00 0.24 -0.20 0.12 -0.31 0.00 0.00 175.10 174.94 2jmp s PHE 34 N 1.91 2.43 0.08 2.82 2.19 -1.26 -2.62 117.98 123.52 2jmp s PHE 34 Ca 0.04 -1.16 0.00 0.00 0.33 0.00 0.00 56.93 56.14 2jmp s PHE 34 Cb -0.13 -1.67 0.00 0.00 -1.31 0.00 0.00 43.02 39.91 2jmp s PHE 34 CO -0.06 -0.53 0.00 1.17 1.83 0.00 0.00 175.22 177.63 2jmp n LYS 35 N 3.99 0.00 0.00 10.12 3.00 -1.25 -5.06 118.16 128.96 2jmp n LYS 35 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.11 2jmp n LYS 35 Cb 0.52 -0.50 0.00 0.00 0.00 0.00 0.00 35.03 35.05 2jmp n LYS 35 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 2jmp n ASN 36 N -3.40 0.00 -0.08 3.14 4.05 -1.26 -5.00 115.26 112.71 2jmp n ASN 36 Ca 0.00 0.00 -0.22 0.00 0.45 0.00 0.00 54.58 54.81 2jmp n ASN 36 Cb 0.10 0.00 -0.12 0.00 1.23 0.00 0.00 39.78 40.98 2jmp n ASN 36 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 2jmp n ASN 37 N 0.00 2.00 -3.85 1.20 4.05 -1.26 -4.74 115.26 112.66 2jmp n ASN 37 Ca 0.00 0.18 -0.10 0.00 0.45 0.00 0.00 54.58 55.11 2jmp n ASN 37 Cb 0.00 -0.75 -0.05 0.00 1.23 0.00 0.00 39.78 40.21 2jmp n ASN 37 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 2jmp s VAL 38 N -2.50 0.05 -0.10 3.44 1.01 -1.26 -4.00 120.40 117.05 2jmp s VAL 38 Ca -0.30 -1.09 0.02 0.00 0.00 0.00 0.00 61.98 60.60 2jmp s VAL 38 Cb 0.09 -1.69 0.02 0.00 0.00 0.00 0.00 36.38 34.79 2jmp s VAL 38 CO 0.64 -0.23 -0.13 -0.76 0.00 0.00 0.00 175.10 174.61 2jmp s LEU 39 N -2.92 1.60 0.10 3.92 1.02 -1.23 -3.83 118.68 117.34 2jmp s LEU 39 Ca 0.13 -0.36 0.10 0.00 0.02 0.00 0.00 54.13 54.02 2jmp s LEU 39 Cb 0.01 -0.96 -0.04 0.00 0.02 0.00 0.00 46.19 45.23 2jmp s LEU 39 CO -0.02 -0.00 -0.26 -0.22 0.02 0.00 0.00 176.35 175.87 2jmp s LEU 40 N 1.01 2.30 -0.01 1.79 0.20 -1.08 -2.10 118.68 120.78 2jmp s LEU 40 Ca -0.07 -0.68 -0.01 0.00 0.69 0.00 0.00 54.13 54.06 2jmp s LEU 40 Cb -0.15 -1.26 0.01 0.00 -0.43 0.00 0.00 46.19 44.36 2jmp s LEU 40 CO -0.01 0.21 0.03 -0.63 -0.29 0.00 0.00 176.35 175.66 2jmp s ILE 41 N -0.98 -0.02 0.38 6.68 1.01 -0.88 -1.92 121.20 125.47 2jmp s ILE 41 Ca 0.13 0.07 -0.28 0.00 0.00 0.00 0.00 60.65 60.57 2jmp s ILE 41 Cb -0.10 -0.06 -0.11 0.00 0.01 0.00 0.00 42.46 42.20 2jmp s ILE 41 CO 0.05 0.03 1.49 -0.76 0.00 0.00 0.00 174.94 175.75 2jmp s LEU 42 N 0.35 4.32 -0.30 2.97 2.01 -1.08 -2.61 118.68 124.34 2jmp s LEU 42 Ca -0.03 3.06 -0.07 0.00 0.01 0.00 0.00 54.13 57.10 2jmp s LEU 42 Cb -0.04 -3.67 0.16 0.00 0.01 0.00 0.00 46.19 42.65 2jmp s LEU 42 CO -0.01 -0.88 0.64 -0.22 1.01 0.00 0.00 176.35 176.90 2jmp s LEU 43 N -2.09 -1.22 0.00 1.79 2.96 0.72 -4.77 118.68 116.07 2jmp s LEU 43 Ca 0.53 1.27 0.00 0.00 -0.22 0.00 0.00 54.13 55.70 2jmp s LEU 43 Cb -0.47 2.22 0.00 0.00 0.50 0.00 0.00 46.19 48.45 2jmp s LEU 43 CO 0.63 -0.23 0.00 -1.84 -1.32 0.00 0.00 176.35 173.59 2jmp n GLU 44 N 5.43 0.00 -0.94 1.98 0.00 -1.26 -2.77 120.64 123.08 2jmp n GLU 44 Ca -0.08 0.30 -0.18 0.00 0.00 0.00 0.00 57.16 57.20 2jmp n GLU 44 Cb 0.50 -0.79 -0.13 0.00 0.00 0.00 0.00 31.44 31.02 2jmp n GLU 44 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2jmp n ASN 45 N -2.13 -0.54 -0.54 -1.84 3.02 -1.26 -4.65 115.26 107.33 2jmp n ASN 45 Ca 0.00 -0.18 0.44 0.00 -0.03 0.00 0.00 54.58 54.81 2jmp n ASN 45 Cb 0.00 -0.42 0.75 0.00 -0.61 0.00 0.00 39.78 39.50 2jmp n ASN 45 CO 0.00 0.00 0.00 1.05 -2.62 0.00 0.00 177.26 175.69 2jmp h GLU 46 N 7.15 0.03 0.29 3.52 4.11 -2.00 -0.07 114.58 127.61 2jmp h GLU 46 Ca 0.01 -0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 2jmp h GLU 46 Cb 0.75 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.00 2jmp h GLU 46 CO 0.97 0.02 -0.14 0.74 0.07 0.00 0.00 179.01 180.68 2jmp h PHE 47 N 0.04 -0.36 -1.85 2.06 -1.00 -2.00 -2.15 116.94 111.68 2jmp h PHE 47 Ca 0.81 -0.01 0.55 0.00 2.81 0.00 0.00 57.97 62.14 2jmp h PHE 47 Cb 3.03 0.12 -0.09 0.00 3.61 0.00 0.00 35.95 42.62 2jmp h PHE 47 CO -0.00 -0.22 1.31 0.00 -1.61 0.00 0.00 178.31 177.78 2jmp n ALA 48 N -2.31 1.79 0.08 2.45 0.00 -0.08 0.31 120.51 122.75 2jmp n ALA 48 Ca -0.05 0.71 -0.10 0.00 0.00 0.00 0.00 53.44 54.00 2jmp n ALA 48 Cb 0.15 -1.13 -0.10 0.00 0.00 0.00 0.00 19.45 18.37 2jmp n ALA 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jmp h ARG 49 N 0.00 0.12 0.43 0.00 3.08 -1.36 -1.99 114.38 114.66 2jmp h ARG 49 Ca 0.93 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.78 2jmp h ARG 49 Cb 3.58 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 33.70 2jmp h ARG 49 CO -0.12 1.06 -0.27 -0.97 -1.07 0.00 0.00 179.97 178.60 2jmp h ASN 50 N 0.04 -0.69 0.23 7.04 -0.00 0.54 -0.92 115.58 121.82 2jmp h ASN 50 Ca -0.06 0.04 -0.01 0.00 -0.00 0.00 0.00 56.30 56.27 2jmp h ASN 50 Cb 1.79 0.21 0.00 0.00 -0.00 0.00 0.00 38.32 40.31 2jmp h ASN 50 CO 0.15 -0.43 -0.11 -1.28 -0.00 0.00 0.00 177.43 175.77 2jmp h SER 51 N -0.67 -0.26 -0.50 1.15 0.87 -1.57 -1.66 113.55 110.90 2jmp h SER 51 Ca -0.05 -0.20 0.10 0.00 -1.23 0.00 0.00 61.79 60.42 2jmp h SER 51 Cb 0.56 0.07 -0.10 0.00 -0.44 0.00 0.00 62.40 62.48 2jmp h SER 51 CO 0.04 0.07 -0.20 -0.07 -0.53 0.00 0.00 176.83 176.14 2jmp h LEU 52 N -0.61 -0.70 -0.32 2.23 3.38 -1.37 0.75 115.31 118.68 2jmp h LEU 52 Ca -0.03 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2jmp h LEU 52 Cb 0.44 0.40 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2jmp h LEU 52 CO 0.05 -0.23 0.00 -3.20 0.09 0.00 0.00 178.44 175.15 2jmp n ASN 53 N -5.40 0.42 0.14 -0.43 5.15 -0.35 0.47 115.26 115.25 2jmp n ASN 53 Ca 0.04 0.59 -0.01 0.00 -0.60 0.00 0.00 54.58 54.60 2jmp n ASN 53 Cb 0.31 -0.68 0.18 0.00 -0.53 0.00 0.00 39.78 39.06 2jmp n ASN 53 CO 0.00 0.00 0.00 -0.78 1.40 0.00 0.00 177.26 177.88 2jmp h ASP 54 N 0.00 0.01 -0.71 1.20 3.58 0.15 -3.35 116.42 117.29 2jmp h ASP 54 Ca 0.00 -0.01 -0.32 0.00 0.42 0.00 0.00 57.03 57.12 2jmp h ASP 54 Cb 0.40 -0.00 -0.26 0.00 1.72 0.00 0.00 39.33 41.19 2jmp h ASP 54 CO 0.00 0.61 -0.75 -3.20 -2.88 0.00 0.00 179.24 173.02 2jmp n ASN 55 N -3.83 -0.78 -2.00 2.28 4.05 -0.84 -4.99 115.26 109.14 2jmp n ASN 55 Ca -0.01 -3.10 -0.05 0.00 0.45 0.00 0.00 54.58 51.86 2jmp n ASN 55 Cb 0.60 0.65 -0.07 0.00 1.23 0.00 0.00 39.78 42.19 2jmp n ASN 55 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 2jmp n SER 56 N 0.07 3.48 -0.42 1.20 3.41 0.18 -4.45 113.62 117.09 2jmp n SER 56 Ca 0.10 -2.08 0.00 0.00 -0.26 0.00 0.00 58.87 56.63 2jmp n SER 56 Cb 0.74 -0.87 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 2jmp n SER 56 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2jmp n GLU 57 N 2.34 0.52 0.00 4.33 4.07 -1.26 -4.10 120.64 126.54 2jmp n GLU 57 Ca 0.19 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.29 2jmp n GLU 57 Cb 0.52 -1.22 0.00 0.00 -0.06 0.00 0.00 31.44 30.67 2jmp n GLU 57 CO 0.00 0.00 0.00 -0.89 -0.06 0.00 0.00 177.13 176.18 2jmp n ILE 58 N 0.13 0.43 0.03 6.31 2.08 -1.26 0.15 119.36 127.23 2jmp n ILE 58 Ca 0.00 0.22 -0.02 0.00 0.56 0.00 0.00 62.75 63.52 2jmp n ILE 58 Cb 0.11 -1.22 -0.09 0.00 -0.75 0.00 0.00 39.64 37.69 2jmp n ILE 58 CO 0.00 0.00 0.00 -0.29 0.56 0.00 0.00 176.55 176.82 2jmp h ILE 59 N 0.00 0.65 0.00 1.39 2.10 -1.93 -2.66 117.51 117.07 2jmp h ILE 59 Ca 0.00 -2.21 0.00 0.00 1.08 0.00 0.00 64.86 63.73 2jmp h ILE 59 Cb 0.23 2.18 0.00 0.00 -1.09 0.00 0.00 36.82 38.14 2jmp h ILE 59 CO 0.00 0.37 0.02 0.00 -1.08 0.00 0.00 178.15 177.46 2jmp n HIS 60 N -2.97 0.09 0.00 2.19 1.44 0.41 -1.24 115.22 115.13 2jmp n HIS 60 Ca -0.10 0.05 0.00 0.00 -2.01 0.00 0.00 57.72 55.66 2jmp n HIS 60 Cb 0.88 -0.56 0.00 0.00 0.12 0.00 0.00 29.99 30.43 2jmp n HIS 60 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2jmp n LEU 61 N -1.58 0.49 0.00 2.39 4.32 -1.25 -4.65 117.00 116.72 2jmp n LEU 61 Ca -0.00 0.00 0.01 0.00 -0.02 0.00 0.00 56.01 56.00 2jmp n LEU 61 Cb 0.02 0.00 0.08 0.00 -1.62 0.00 0.00 43.42 41.91 2jmp n LEU 61 CO 0.01 0.05 0.25 0.00 -1.22 0.00 0.00 177.39 176.48 2jmp n ALA 62 N -2.86 1.80 1.39 -1.18 0.00 -1.00 -1.99 120.51 116.67 2jmp n ALA 62 Ca 0.00 -0.02 0.14 0.00 0.00 0.00 0.00 53.44 53.56 2jmp n ALA 62 Cb 0.46 -1.04 0.59 0.00 0.00 0.00 0.00 19.45 19.45 2jmp n ALA 62 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2jmp n GLU 63 N -0.65 0.70 -0.02 0.00 0.28 -0.38 -3.52 120.64 117.05 2jmp n GLU 63 Ca 0.02 -0.26 -0.02 0.00 -0.16 0.00 0.00 57.16 56.74 2jmp n GLU 63 Cb 0.01 -1.49 -0.01 0.00 1.43 0.00 0.00 31.44 31.38 2jmp n GLU 63 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 2jmp n SER 64 N -0.92 0.58 0.09 -1.84 7.64 -0.84 -4.24 113.62 114.09 2jmp n SER 64 Ca 0.14 0.34 0.20 0.00 1.01 0.00 0.00 58.87 60.56 2jmp n SER 64 Cb 0.28 -0.61 0.68 0.00 -1.01 0.00 0.00 64.21 63.55 2jmp n SER 64 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2jmp h LEU 65 N -0.32 0.00 -9.01 -3.43 5.85 -1.78 -3.39 115.31 103.23 2jmp h LEU 65 Ca 0.00 0.00 -0.68 0.00 0.84 0.00 0.00 57.88 58.04 2jmp h LEU 65 Cb 0.18 0.00 -0.20 0.00 0.37 0.00 0.00 40.66 41.01 2jmp h LEU 65 CO 0.00 0.00 -0.83 -0.31 -0.34 0.00 0.00 178.44 176.96 2jmp s TYR 66 N -4.48 2.46 0.10 1.25 2.02 -1.23 -5.05 117.35 112.42 2jmp s TYR 66 Ca -0.04 -0.30 -0.25 0.00 -0.37 0.00 0.00 57.07 56.11 2jmp s TYR 66 Cb 0.14 -1.33 -0.08 0.00 -0.40 0.00 0.00 41.96 40.28 2jmp s TYR 66 CO 0.47 0.34 1.41 0.93 -1.57 0.00 0.00 175.55 177.13 2jmp h GLU 67 N 3.92 -0.27 -0.54 -0.62 5.08 -1.80 -3.42 114.58 116.94 2jmp h GLU 67 Ca -0.50 0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 57.85 2jmp h GLU 67 Cb 1.17 0.06 -0.16 0.00 0.50 0.00 0.00 28.75 30.31 2jmp h GLU 67 CO 0.44 -0.18 -0.27 0.20 -1.00 0.00 0.00 179.01 178.20 2jmp s GLY 68 N -2.02 -1.59 0.71 -3.84 0.00 -1.26 -4.84 107.32 94.48 2jmp s GLY 68 Ca -0.11 0.34 -0.16 0.00 0.00 0.00 0.00 44.72 44.79 2jmp s GLY 68 CO 0.46 4.04 0.57 1.39 0.00 0.00 0.00 173.10 179.56 2jmp n ILE 69 N 3.06 1.94 0.02 0.90 2.08 -1.26 -4.93 119.36 121.17 2jmp n ILE 69 Ca 0.13 -0.41 -0.17 0.00 0.56 0.00 0.00 62.75 62.86 2jmp n ILE 69 Cb 0.61 -0.77 -0.14 0.00 -0.75 0.00 0.00 39.64 38.59 2jmp n ILE 69 CO 0.00 0.00 0.00 0.50 0.56 0.00 0.00 176.55 177.61 2jmp h LYS 70 N -0.29 0.21 0.00 0.38 1.63 -1.85 -3.50 116.57 113.14 2jmp h LYS 70 Ca -0.46 -0.35 0.00 0.00 -0.85 0.00 0.00 60.65 58.99 2jmp h LYS 70 Cb 1.35 0.13 0.00 0.00 -0.60 0.00 0.00 32.23 33.11 2jmp h LYS 70 CO 0.43 1.02 0.00 0.43 -3.45 0.00 0.00 179.45 177.88 2jmp n SER 71 N -3.38 0.00 -3.80 4.20 7.64 -1.26 -5.08 113.62 111.94 2jmp n SER 71 Ca -0.22 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.53 2jmp n SER 71 Cb 1.05 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 64.15 2jmp n SER 71 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2jmp s VAL 72 N -2.56 0.03 0.07 0.44 1.01 -1.26 -3.55 120.40 114.57 2jmp s VAL 72 Ca 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 61.98 61.65 2jmp s VAL 72 Cb 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 36.38 35.91 2jmp s VAL 72 CO 0.00 -0.16 0.05 0.21 0.00 0.00 0.00 175.10 175.20 2jmp s ASN 73 N -0.60 0.35 -0.01 3.32 3.04 -0.89 -4.89 114.94 115.25 2jmp s ASN 73 Ca -0.07 -0.88 0.00 0.00 0.04 0.00 0.00 52.86 51.95 2jmp s ASN 73 Cb -0.04 0.25 0.01 0.00 -1.54 0.00 0.00 41.25 39.94 2jmp s ASN 73 CO 0.02 -0.65 0.00 -0.36 -3.04 0.00 0.00 177.10 173.07 2jmp s PHE 74 N -3.90 0.16 0.00 0.43 0.40 -1.26 -2.08 117.98 111.73 2jmp s PHE 74 Ca 0.07 0.02 0.00 0.00 -0.60 0.00 0.00 56.93 56.42 2jmp s PHE 74 Cb 0.07 -0.22 0.00 0.00 0.51 0.00 0.00 43.02 43.38 2jmp s PHE 74 CO -0.10 -0.06 0.00 1.33 0.70 0.00 0.00 175.22 177.09 2jmp n VAL 75 N 3.64 0.00 -3.30 -0.44 0.24 -1.07 -4.90 118.33 112.50 2jmp n VAL 75 Ca -0.20 0.00 -0.19 0.00 -2.04 0.00 0.00 64.34 61.91 2jmp n VAL 75 Cb 0.54 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.91 2jmp n VAL 75 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2jmp s ASN 76 N 0.31 5.44 0.00 -1.34 4.22 -1.12 0.26 114.94 122.72 2jmp s ASN 76 Ca 0.00 -0.52 0.00 0.00 -2.14 0.00 0.00 52.86 50.20 2jmp s ASN 76 Cb 0.00 -0.70 0.00 0.00 1.28 0.00 0.00 41.25 41.83 2jmp s ASN 76 CO 0.00 -0.67 0.77 -0.62 -2.04 0.00 0.00 177.10 174.55 2jmp n GLU 77 N -1.69 0.00 -0.18 3.55 -0.58 -1.26 0.21 120.64 120.69 2jmp n GLU 77 Ca 0.05 0.77 -0.05 0.00 -0.42 0.00 0.00 57.16 57.52 2jmp n GLU 77 Cb 0.60 -1.23 0.02 0.00 -0.57 0.00 0.00 31.44 30.26 2jmp n GLU 77 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 2jmp h GLN 78 N 0.00 -0.14 -0.00 3.49 -0.00 -1.99 -1.38 115.11 115.09 2jmp h GLN 78 Ca 0.00 0.01 0.02 0.00 -0.00 0.00 0.00 58.65 58.68 2jmp h GLN 78 Cb 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 27.48 27.47 2jmp h GLN 78 CO 0.00 -0.09 -0.41 -0.44 0.00 0.00 0.00 178.83 177.89 2jmp h ASP 79 N -0.14 -1.28 -0.97 -0.69 3.45 -1.64 0.43 116.42 115.58 2jmp h ASP 79 Ca 0.23 0.14 0.33 0.00 0.43 0.00 0.00 57.03 58.16 2jmp h ASP 79 Cb 0.52 0.48 -0.17 0.00 -0.56 0.00 0.00 39.33 39.60 2jmp h ASP 79 CO -0.62 -0.40 0.35 0.15 -1.57 0.00 0.00 179.24 177.15 2jmp h PHE 80 N -0.52 0.53 0.31 4.55 -0.00 0.51 0.15 116.94 122.47 2jmp h PHE 80 Ca 0.01 0.05 -0.01 0.00 -0.00 0.00 0.00 57.97 58.02 2jmp h PHE 80 Cb 0.55 -0.07 -0.00 0.00 -0.00 0.00 0.00 35.95 36.43 2jmp h PHE 80 CO -0.48 -0.36 -0.20 0.35 -0.00 0.00 0.00 178.31 177.61 2jmp h PHE 81 N 0.10 -0.54 -1.31 0.41 3.04 0.10 -2.07 116.94 116.68 2jmp h PHE 81 Ca 0.71 -0.00 0.41 0.00 3.98 0.00 0.00 57.97 63.07 2jmp h PHE 81 Cb 1.66 0.20 -0.09 0.00 2.56 0.00 0.00 35.95 40.28 2jmp h PHE 81 CO -0.19 -0.30 0.89 0.34 -2.02 0.00 0.00 178.31 177.04 2jmp n PHE 82 N -3.54 0.31 -0.02 0.41 7.35 0.01 0.26 117.46 122.24 2jmp n PHE 82 Ca -0.06 0.32 -0.13 0.00 -0.76 0.00 0.00 57.45 56.82 2jmp n PHE 82 Cb 0.20 -0.72 -0.11 0.00 0.35 0.00 0.00 39.48 39.21 2jmp n PHE 82 CO 0.00 0.00 0.00 -0.97 -0.76 0.00 0.00 176.76 175.03 2jmp h ASN 83 N 0.00 -0.02 1.44 -2.13 -0.73 -0.98 -2.79 115.58 110.36 2jmp h ASN 83 Ca 0.72 -0.62 0.00 0.00 1.87 0.00 0.00 56.30 58.27 2jmp h ASN 83 Cb 2.59 0.01 0.00 0.00 0.27 0.00 0.00 38.32 41.18 2jmp h ASN 83 CO -0.21 0.63 -0.11 0.17 -0.37 0.00 0.00 177.43 177.53 2jmp h LEU 84 N -0.70 0.00 -0.19 0.34 8.10 0.21 -3.19 115.31 119.88 2jmp h LEU 84 Ca -0.00 -0.03 -0.08 0.00 0.11 0.00 0.00 57.88 57.88 2jmp h LEU 84 Cb 0.65 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.85 2jmp h LEU 84 CO 0.00 0.02 -0.38 0.00 -4.11 0.00 0.00 178.44 173.98 2jmp h ALA 85 N 2.45 0.79 -1.31 0.17 0.00 0.35 -3.38 119.26 118.33 2jmp h ALA 85 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2jmp h ALA 85 Cb 0.77 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2jmp h ALA 85 CO 0.00 0.47 0.00 1.17 0.00 0.00 0.00 179.25 180.89 2jmp n LYS 86 N -3.24 0.00 -2.37 0.00 3.00 -1.05 -4.83 118.16 109.66 2jmp n LYS 86 Ca 0.02 0.28 -0.33 0.00 -0.00 0.00 0.00 58.31 58.28 2jmp n LYS 86 Cb 0.65 -1.02 -0.02 0.00 0.00 0.00 0.00 35.03 34.63 2jmp n LYS 86 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2jmp s LEU 87 N -2.69 3.70 0.07 3.14 1.02 -1.26 -5.07 118.68 117.60 2jmp s LEU 87 Ca 0.00 1.82 -0.07 0.00 0.02 0.00 0.00 54.13 55.90 2jmp s LEU 87 Cb 0.00 -4.54 -0.01 0.00 0.02 0.00 0.00 46.19 41.66 2jmp s LEU 87 CO 0.00 -0.85 0.14 -1.61 0.02 0.00 0.00 176.35 174.05 2jmp s GLU 88 N -3.63 0.77 0.45 1.70 2.02 -1.26 -4.85 118.70 113.90 2jmp s GLU 88 Ca 0.64 -0.97 0.17 0.00 0.02 0.00 0.00 54.97 54.83 2jmp s GLU 88 Cb -0.15 0.31 1.11 0.00 0.10 0.00 0.00 34.13 35.49 2jmp s GLU 88 CO 0.27 -0.23 1.96 0.93 0.02 0.00 0.00 175.26 178.21 2jmp h GLU 89 N 2.93 0.33 0.00 1.61 3.07 -1.97 -3.46 114.58 117.09 2jmp h GLU 89 Ca -0.34 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.50 2jmp h GLU 89 Cb 1.19 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 2jmp h GLU 89 CO 0.57 0.22 0.00 0.27 -1.40 0.00 0.00 179.01 178.67 2jmp n ASN 90 N -4.46 0.00 -1.62 1.42 6.94 -1.26 -5.06 115.26 111.22 2jmp n ASN 90 Ca 0.12 -0.80 0.02 0.00 -0.02 0.00 0.00 54.58 53.89 2jmp n ASN 90 Cb 0.48 0.00 0.01 0.00 -2.36 0.00 0.00 39.78 37.91 2jmp n ASN 90 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2jmp n SER 91 N -0.49 0.76 -4.35 0.53 7.64 -1.26 -5.01 113.62 111.45 2jmp n SER 91 Ca 0.00 -2.01 -0.45 0.00 1.01 0.00 0.00 58.87 57.42 2jmp n SER 91 Cb 0.00 -0.23 -0.01 0.00 -1.01 0.00 0.00 64.21 62.97 2jmp n SER 91 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2jmp s ARG 92 N -0.46 4.03 0.56 1.43 0.52 -1.26 -4.94 118.95 118.83 2jmp s ARG 92 Ca 0.28 -2.92 0.00 0.00 -0.52 0.00 0.00 55.73 52.58 2jmp s ARG 92 Cb 0.33 -4.59 0.00 0.00 0.52 0.00 0.00 34.95 31.21 2jmp s ARG 92 CO -0.13 -1.33 0.00 -3.47 0.02 0.00 0.00 175.30 170.39 2jmp n ASP 93 N 3.45 -8.58 -1.34 0.23 -0.08 -1.26 -4.74 116.55 104.24 2jmp n ASP 93 Ca 0.23 1.52 0.11 0.00 -1.51 0.00 0.00 54.79 55.14 2jmp n ASP 93 Cb 0.42 -4.95 0.32 0.00 2.34 0.00 0.00 41.12 39.25 2jmp n ASP 93 CO 0.00 0.00 0.00 1.07 0.12 0.00 0.00 177.20 178.39 2jmp n THR 94 N -1.62 1.06 -1.91 5.18 5.66 -1.26 -5.04 114.28 116.34 2jmp n THR 94 Ca 0.00 -0.97 0.00 0.00 -3.05 0.00 0.00 64.05 60.03 2jmp n THR 94 Cb 0.20 0.42 0.00 0.00 -1.55 0.00 0.00 70.33 69.41 2jmp n THR 94 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 175.07 172.20 2jmp n LEU 95 N 1.51 0.00 -2.69 1.09 4.32 -1.26 -4.56 117.00 115.41 2jmp n LEU 95 Ca 0.24 0.00 -0.05 0.00 -0.02 0.00 0.00 56.01 56.18 2jmp n LEU 95 Cb 0.63 0.00 0.06 0.00 -1.62 0.00 0.00 43.42 42.49 2jmp n LEU 95 CO 0.17 0.00 0.46 0.00 -1.22 0.00 0.00 177.39 176.81 2jmp n TYR 96 N 14.00 -1.38 -3.66 -1.77 4.19 -1.26 -5.15 117.16 122.13 2jmp n TYR 96 Ca 0.00 -0.97 -0.14 0.00 3.31 0.00 0.00 57.90 60.10 2jmp n TYR 96 Cb 0.00 1.22 -0.08 0.00 0.49 0.00 0.00 39.34 40.97 2jmp n TYR 96 CO 0.00 0.00 0.00 -1.14 0.91 0.00 0.00 176.86 176.63 2jmp s GLN 97 N 0.41 0.73 -0.16 2.98 0.74 -1.26 -5.03 119.66 118.07 2jmp s GLN 97 Ca 0.27 0.79 -0.04 0.00 0.05 0.00 0.00 55.36 56.43 2jmp s GLN 97 Cb 0.19 0.36 -0.12 0.00 1.10 0.00 0.00 33.01 34.53 2jmp s GLN 97 CO -0.12 -0.10 2.11 0.27 -0.55 0.00 0.00 175.29 176.90 2jmp n ASN 98 N 2.60 3.08 0.00 6.67 2.04 -1.26 -3.86 115.26 124.53 2jmp n ASN 98 Ca -0.14 -2.06 0.00 0.00 -0.44 0.00 0.00 54.58 51.93 2jmp n ASN 98 Cb 0.56 -0.80 0.00 0.00 -2.53 0.00 0.00 39.78 37.01 2jmp n ASN 98 CO 0.00 0.00 0.00 -0.24 -0.44 0.00 0.00 177.26 176.58 2jmp n SER 99 N 3.02 0.00 0.00 0.53 2.88 -1.26 -5.34 113.62 113.45 2jmp n SER 99 Ca 0.26 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.80 2jmp n SER 99 Cb 0.41 0.01 0.00 0.00 -0.75 0.00 0.00 64.21 63.88 2jmp n SER 99 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42