#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 0.29 -0.77 0.03 5.08 -2.05 -3.20 114.58 113.96 2jmp h GLU 2 Ca 0.00 -0.50 0.06 0.00 -1.00 0.00 0.00 59.36 57.92 2jmp h GLU 2 Cb 0.00 0.18 -0.05 0.00 0.50 0.00 0.00 28.75 29.39 2jmp h GLU 2 CO 0.00 1.24 0.50 -0.56 -1.00 0.00 0.00 179.01 179.19 2jmp h GLN 3 N -0.09 0.83 -0.19 2.33 3.07 -2.00 0.13 115.11 119.18 2jmp h GLN 3 Ca -0.35 -0.05 -0.01 0.00 0.09 0.00 0.00 58.65 58.32 2jmp h GLN 3 Cb 1.93 -0.19 -0.01 0.00 0.08 0.00 0.00 27.48 29.30 2jmp h GLN 3 CO 0.09 0.55 0.06 0.35 0.09 0.00 0.00 178.83 179.97 2jmp h PHE 4 N 0.85 0.30 -0.75 0.06 3.57 -1.99 -2.34 116.94 116.64 2jmp h PHE 4 Ca 0.33 -0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.84 2jmp h PHE 4 Cb 0.20 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.81 2jmp h PHE 4 CO -0.00 0.39 0.49 -0.97 -2.23 0.00 0.00 178.31 175.99 2jmp h ASN 5 N 0.13 0.77 -1.00 0.41 -1.24 -1.20 -0.13 115.58 113.32 2jmp h ASN 5 Ca 0.06 -0.01 0.06 0.00 0.71 0.00 0.00 56.30 57.12 2jmp h ASN 5 Cb 0.23 -0.17 -0.06 0.00 0.73 0.00 0.00 38.32 39.04 2jmp h ASN 5 CO -0.00 0.52 0.65 0.00 -1.29 0.00 0.00 177.43 177.31 2jmp h ALA 6 N 1.57 1.39 -0.32 1.57 0.00 -0.30 0.24 119.26 123.41 2jmp h ALA 6 Ca 0.31 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.13 2jmp h ALA 6 Cb 0.10 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 2jmp h ALA 6 CO -0.09 0.47 -0.05 0.35 0.00 0.00 0.00 179.25 179.93 2jmp h PHE 7 N 1.20 0.54 -0.07 0.00 3.57 -0.57 -2.05 116.94 119.56 2jmp h PHE 7 Ca 0.42 -0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.85 2jmp h PHE 7 Cb 0.12 -0.15 -0.00 0.00 2.79 0.00 0.00 35.95 38.71 2jmp h PHE 7 CO -0.00 0.57 0.02 -0.22 -2.23 0.00 0.00 178.31 176.45 2jmp h LYS 8 N 0.49 0.11 -0.01 1.11 3.64 0.09 -1.83 116.57 120.17 2jmp h LYS 8 Ca 0.10 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 2jmp h LYS 8 Cb 0.40 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 2jmp h LYS 8 CO 0.02 0.28 0.01 1.03 -2.27 0.00 0.00 179.45 178.52 2jmp h SER 9 N -0.07 0.00 -0.61 4.20 0.87 -0.53 0.17 113.55 117.58 2jmp h SER 9 Ca 0.02 0.00 -0.09 0.00 -1.23 0.00 0.00 61.79 60.50 2jmp h SER 9 Cb 0.21 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.15 2jmp h SER 9 CO -0.00 0.00 0.05 0.25 -0.53 0.00 0.00 176.83 176.60 2jmp h LEU 10 N 0.00 1.02 -0.81 2.23 6.46 -0.63 -2.47 115.31 121.11 2jmp h LEU 10 Ca 0.00 -0.26 0.02 0.00 -0.12 0.00 0.00 57.88 57.53 2jmp h LEU 10 Cb 0.03 -0.27 -0.05 0.00 -0.73 0.00 0.00 40.66 39.64 2jmp h LEU 10 CO -0.00 1.04 0.53 -0.07 -0.62 0.00 0.00 178.44 179.32 2jmp h LEU 11 N 0.98 0.89 -0.86 2.25 3.38 -0.32 -2.57 115.31 119.05 2jmp h LEU 11 Ca 0.19 -0.01 0.11 0.00 0.09 0.00 0.00 57.88 58.25 2jmp h LEU 11 Cb 0.49 -0.21 -0.12 0.00 0.09 0.00 0.00 40.66 40.91 2jmp h LEU 11 CO 0.02 0.62 -0.41 1.17 0.09 0.00 0.00 178.44 179.94 2jmp n LYS 12 N -4.56 -0.28 -0.32 1.13 4.81 -0.93 0.32 118.16 118.33 2jmp n LYS 12 Ca 0.09 1.31 0.12 0.00 -0.87 0.00 0.00 58.31 58.96 2jmp n LYS 12 Cb 0.06 -1.94 0.29 0.00 0.02 0.00 0.00 35.03 33.46 2jmp n LYS 12 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 2jmp h LYS 13 N 0.00 0.59 0.44 1.64 1.63 -1.54 2.23 116.57 121.56 2jmp h LYS 13 Ca 0.23 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.97 2jmp h LYS 13 Cb 0.45 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 31.95 2jmp h LYS 13 CO -0.83 0.39 -0.21 1.25 -3.45 0.00 0.00 179.45 176.59 2jmp h HIS 14 N 0.60 -0.55 -0.27 1.91 2.76 0.50 -3.20 115.15 116.91 2jmp h HIS 14 Ca 0.55 -0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.59 2jmp h HIS 14 Cb 0.90 0.18 -0.07 0.00 1.55 0.00 0.00 27.41 29.98 2jmp h HIS 14 CO -0.07 -0.34 0.14 0.66 -1.30 0.00 0.00 177.93 177.03 2jmp n TYR 15 N -4.28 0.88 -0.02 5.26 0.53 0.20 -4.46 117.16 115.28 2jmp n TYR 15 Ca -0.07 -0.70 -0.11 0.00 -1.02 0.00 0.00 57.90 56.00 2jmp n TYR 15 Cb 0.23 -0.40 -0.04 0.00 -1.03 0.00 0.00 39.34 38.10 2jmp n TYR 15 CO 0.00 0.00 0.00 1.49 -1.02 0.00 0.00 176.86 177.33 2jmp h GLU 16 N 0.63 -0.39 0.00 -0.72 4.22 0.37 0.49 114.58 119.17 2jmp h GLU 16 Ca 0.14 0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.60 2jmp h GLU 16 Cb 1.40 0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.74 2jmp h GLU 16 CO 0.29 -0.26 0.00 1.63 -2.18 0.00 0.00 179.01 178.49 2jmp n LYS 17 N -5.42 0.95 -2.77 1.92 5.02 -1.26 -3.67 118.16 112.92 2jmp n LYS 17 Ca -0.03 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 56.01 2jmp n LYS 17 Cb 0.34 -1.40 -0.02 0.00 -0.02 0.00 0.00 35.03 33.94 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 -0.90 2.37 -0.04 -0.18 -1.04 0.17 -4.87 114.28 109.80 2jmp n THR 18 Ca 0.18 -5.07 -0.00 0.00 -2.04 0.00 0.00 64.05 57.12 2jmp n THR 18 Cb 0.08 -1.10 -0.00 0.00 -1.82 0.00 0.00 70.33 67.49 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 2.65 0.00 -0.35 12.58 2.10 -1.56 -3.31 117.51 129.62 2jmp h ILE 19 Ca 0.17 -0.74 0.03 0.00 1.08 0.00 0.00 64.86 65.41 2jmp h ILE 19 Cb 0.75 0.00 -0.04 0.00 -1.09 0.00 0.00 36.82 36.44 2jmp h ILE 19 CO 0.78 0.00 -0.21 0.61 -1.08 0.00 0.00 178.15 178.25 2jmp n GLY 20 N 1.84 -1.23 0.32 8.18 0.00 -1.26 0.31 105.19 113.34 2jmp n GLY 20 Ca -0.00 0.48 0.02 0.00 0.00 0.00 0.00 46.02 46.52 2jmp n GLY 20 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2jmp h PHE 21 N 0.00 -0.51 -0.09 1.61 3.04 -1.97 0.37 116.94 119.39 2jmp h PHE 21 Ca 0.06 0.08 -0.00 0.00 3.98 0.00 0.00 57.97 62.08 2jmp h PHE 21 Cb 0.14 0.36 -0.00 0.00 2.56 0.00 0.00 35.95 39.00 2jmp h PHE 21 CO -0.46 -0.37 0.06 1.25 -2.02 0.00 0.00 178.31 176.77 2jmp h HIS 22 N -0.01 0.12 0.00 0.41 2.76 0.48 0.98 115.15 119.88 2jmp h HIS 22 Ca 0.39 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.56 2jmp h HIS 22 Cb 0.61 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.53 2jmp h HIS 22 CO -0.67 0.11 0.00 -3.47 -1.30 0.00 0.00 177.93 172.60 2jmp n ASP 23 N -5.00 0.00 0.00 3.26 2.03 0.11 0.76 116.55 117.70 2jmp n ASP 23 Ca -0.05 0.07 0.00 0.00 0.52 0.00 0.00 54.79 55.32 2jmp n ASP 23 Cb 0.05 -0.13 0.00 0.00 -0.72 0.00 0.00 41.12 40.31 2jmp n ASP 23 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 2jmp n LYS 24 N -1.13 0.00 0.00 -0.67 3.00 0.27 -4.80 118.16 114.83 2jmp n LYS 24 Ca 0.02 0.05 0.00 0.00 -0.00 0.00 0.00 58.31 58.38 2jmp n LYS 24 Cb 0.02 -0.37 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 -1.90 0.00 -0.16 5.64 4.02 -0.79 -4.51 117.16 119.47 2jmp n TYR 25 Ca 0.00 0.00 0.23 0.00 -0.01 0.00 0.00 57.90 58.12 2jmp n TYR 25 Cb 0.00 0.00 0.36 0.00 -0.02 0.00 0.00 39.34 39.68 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 -1.89 0.00 0.00 -0.72 5.41 -1.25 -4.36 119.36 116.55 2jmp n ILE 26 Ca 0.00 1.12 0.00 0.00 1.00 0.00 0.00 62.75 64.87 2jmp n ILE 26 Cb 0.00 -2.02 0.00 0.00 -0.71 0.00 0.00 39.64 36.91 2jmp n ILE 26 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 2jmp n LYS 27 N -2.99 0.00 -2.93 0.38 5.02 0.23 -3.79 118.16 114.07 2jmp n LYS 27 Ca 0.20 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.34 2jmp n LYS 27 Cb 1.35 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 36.37 2jmp n LYS 27 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2jmp n ASP 28 N 0.00 -1.40 0.00 4.39 -0.08 -1.26 -4.91 116.55 113.29 2jmp n ASP 28 Ca 0.00 -3.16 0.00 0.00 -1.51 0.00 0.00 54.79 50.12 2jmp n ASP 28 Cb 0.00 0.80 0.00 0.00 2.34 0.00 0.00 41.12 44.26 2jmp n ASP 28 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 2jmp n ILE 29 N 1.15 0.00 -1.97 5.18 5.41 -1.25 -5.03 119.36 122.86 2jmp n ILE 29 Ca 0.14 0.00 -0.01 0.00 1.00 0.00 0.00 62.75 63.88 2jmp n ILE 29 Cb 0.62 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.55 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 0.00 -0.29 -3.48 4.38 0.23 -1.26 -5.09 115.26 109.74 2jmp n ASN 30 Ca 0.00 -0.80 -0.28 0.00 -0.53 0.00 0.00 54.58 52.96 2jmp n ASN 30 Cb 0.00 0.11 -0.13 0.00 -2.08 0.00 0.00 39.78 37.68 2jmp n ASN 30 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 2jmp s ARG 31 N 0.01 0.41 -0.13 -3.83 6.06 -1.26 -5.10 118.95 115.12 2jmp s ARG 31 Ca 0.01 -1.00 -0.09 0.00 -2.50 0.00 0.00 55.73 52.15 2jmp s ARG 31 Cb 0.04 -1.21 0.04 0.00 0.06 0.00 0.00 34.95 33.88 2jmp s ARG 31 CO -0.01 -1.14 0.32 -0.59 -2.50 0.00 0.00 175.30 171.38 2jmp s PHE 32 N 1.48 -0.40 -0.08 5.12 -0.12 -1.26 -2.56 117.98 120.16 2jmp s PHE 32 Ca 0.15 0.94 0.02 0.00 -0.05 0.00 0.00 56.93 57.98 2jmp s PHE 32 Cb -0.20 0.13 0.01 0.00 -0.63 0.00 0.00 43.02 42.34 2jmp s PHE 32 CO -0.13 -0.23 -0.13 0.14 -0.05 0.00 0.00 175.22 174.81 2jmp s VAL 33 N 0.77 1.27 -0.41 -2.49 -7.23 -1.00 -5.01 120.40 106.30 2jmp s VAL 33 Ca -0.05 -0.54 0.10 0.00 -1.81 0.00 0.00 61.98 59.69 2jmp s VAL 33 Cb -0.06 -1.16 0.41 0.00 0.56 0.00 0.00 36.38 36.13 2jmp s VAL 33 CO -0.05 0.39 0.97 2.22 -0.31 0.00 0.00 175.10 178.32 2jmp n PHE 34 N 3.94 2.25 -2.23 2.82 1.16 -1.26 -2.42 117.46 121.72 2jmp n PHE 34 Ca -0.21 -3.26 -0.26 0.00 -1.87 0.00 0.00 57.45 51.85 2jmp n PHE 34 Cb 0.52 -0.30 0.01 0.00 -1.61 0.00 0.00 39.48 38.10 2jmp n PHE 34 CO 0.00 0.00 0.00 1.17 -1.87 0.00 0.00 176.76 176.06 2jmp n LYS 35 N -0.18 3.48 -0.72 3.97 4.81 -1.26 -4.56 118.16 123.70 2jmp n LYS 35 Ca 0.25 -4.30 -0.03 0.00 -0.87 0.00 0.00 58.31 53.37 2jmp n LYS 35 Cb 0.67 -2.27 -0.03 0.00 0.02 0.00 0.00 35.03 33.42 2jmp n LYS 35 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2jmp n ASN 36 N -0.60 -0.43 0.00 3.14 3.02 -1.26 -4.96 115.26 114.17 2jmp n ASN 36 Ca 0.42 -1.45 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 2jmp n ASN 36 Cb 0.79 0.13 0.00 0.00 -0.61 0.00 0.00 39.78 40.09 2jmp n ASN 36 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2jmp n ASN 37 N 0.00 0.00 -4.61 6.41 2.85 -1.26 -4.94 115.26 113.71 2jmp n ASN 37 Ca -0.12 0.00 -0.27 0.00 -0.11 0.00 0.00 54.58 54.08 2jmp n ASN 37 Cb 0.59 -0.27 -0.11 0.00 1.24 0.00 0.00 39.78 41.24 2jmp n ASN 37 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2jmp s VAL 38 N -2.14 2.08 -0.09 3.44 1.01 -1.26 -2.11 120.40 121.33 2jmp s VAL 38 Ca 0.00 -2.03 0.01 0.00 0.00 0.00 0.00 61.98 59.96 2jmp s VAL 38 Cb 0.00 -2.92 0.02 0.00 0.00 0.00 0.00 36.38 33.48 2jmp s VAL 38 CO 0.00 -0.05 -0.09 -0.76 0.00 0.00 0.00 175.10 174.20 2jmp s LEU 39 N -3.70 1.36 0.10 3.92 1.02 -1.24 -4.19 118.68 115.96 2jmp s LEU 39 Ca 0.35 -0.29 0.10 0.00 0.02 0.00 0.00 54.13 54.31 2jmp s LEU 39 Cb 0.08 -0.81 -0.04 0.00 0.02 0.00 0.00 46.19 45.44 2jmp s LEU 39 CO 0.18 -0.06 -0.25 -0.22 0.02 0.00 0.00 176.35 176.02 2jmp s LEU 40 N 1.28 2.35 -0.04 1.79 0.20 -1.02 -2.14 118.68 121.11 2jmp s LEU 40 Ca -0.03 -0.66 -0.03 0.00 0.69 0.00 0.00 54.13 54.10 2jmp s LEU 40 Cb -0.14 -1.30 0.01 0.00 -0.43 0.00 0.00 46.19 44.33 2jmp s LEU 40 CO -0.03 0.21 0.09 -0.63 -0.29 0.00 0.00 176.35 175.70 2jmp s ILE 41 N -0.99 -0.01 0.24 6.68 1.01 -0.81 -2.37 121.20 124.95 2jmp s ILE 41 Ca 0.14 0.03 -0.31 0.00 0.00 0.00 0.00 60.65 60.52 2jmp s ILE 41 Cb -0.10 -0.14 -0.11 0.00 0.01 0.00 0.00 42.46 42.12 2jmp s ILE 41 CO 0.05 0.01 1.55 -0.76 0.00 0.00 0.00 174.94 175.79 2jmp s LEU 42 N 0.24 4.37 -0.26 2.97 2.01 -1.06 -2.35 118.68 124.61 2jmp s LEU 42 Ca -0.02 2.76 -0.02 0.00 0.01 0.00 0.00 54.13 56.86 2jmp s LEU 42 Cb -0.03 -3.62 0.15 0.00 0.01 0.00 0.00 46.19 42.71 2jmp s LEU 42 CO -0.01 -0.82 0.43 -0.22 1.01 0.00 0.00 176.35 176.74 2jmp s LEU 43 N 0.14 -0.83 -0.16 1.79 2.96 0.53 -4.81 118.68 118.29 2jmp s LEU 43 Ca 0.65 0.36 -0.12 0.00 -0.22 0.00 0.00 54.13 54.80 2jmp s LEU 43 Cb -0.45 1.38 -0.07 0.00 0.50 0.00 0.00 46.19 47.55 2jmp s LEU 43 CO 0.40 -0.29 -0.10 -0.62 -1.32 0.00 0.00 176.35 174.42 2jmp n GLU 44 N 5.38 0.48 -1.28 1.98 1.02 -1.26 -2.81 120.64 124.16 2jmp n GLU 44 Ca -0.03 0.53 -0.19 0.00 -0.02 0.00 0.00 57.16 57.45 2jmp n GLU 44 Cb 0.50 -1.70 -0.19 0.00 -0.02 0.00 0.00 31.44 30.03 2jmp n GLU 44 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2jmp n ASN 45 N -4.57 -1.21 -0.37 1.62 3.02 -1.26 -4.62 115.26 107.88 2jmp n ASN 45 Ca -0.14 -0.45 0.37 0.00 -0.03 0.00 0.00 54.58 54.33 2jmp n ASN 45 Cb 0.37 -0.47 0.59 0.00 -0.61 0.00 0.00 39.78 39.67 2jmp n ASN 45 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 2jmp h GLU 46 N 9.43 0.00 0.00 3.52 4.81 -2.00 -0.76 114.58 129.58 2jmp h GLU 46 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2jmp h GLU 46 Cb 0.97 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.35 2jmp h GLU 46 CO 1.38 0.00 0.00 0.34 -0.73 0.00 0.00 179.01 180.00 2jmp n PHE 47 N -3.52 0.00 -0.65 0.92 7.35 -1.26 -1.59 117.46 118.70 2jmp n PHE 47 Ca 0.30 0.00 0.49 0.00 -0.76 0.00 0.00 57.45 57.48 2jmp n PHE 47 Cb 1.66 -0.43 0.77 0.00 0.35 0.00 0.00 39.48 41.82 2jmp n PHE 47 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2jmp n ALA 48 N -1.79 1.74 0.06 3.13 0.00 -0.32 0.34 120.51 123.67 2jmp n ALA 48 Ca 0.00 0.65 -0.10 0.00 0.00 0.00 0.00 53.44 53.99 2jmp n ALA 48 Cb 0.00 -1.08 -0.13 0.00 0.00 0.00 0.00 19.45 18.24 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 0.09 -0.61 0.00 3.08 -1.49 -1.48 114.38 113.97 2jmp h ARG 49 Ca 0.89 -0.16 0.06 0.00 0.07 0.00 0.00 59.98 60.85 2jmp h ARG 49 Cb 3.49 0.06 -0.06 0.00 0.08 0.00 0.00 29.97 33.54 2jmp h ARG 49 CO -0.07 1.00 0.31 -0.97 -1.07 0.00 0.00 179.97 179.17 2jmp h ASN 50 N 0.02 0.43 0.00 7.04 -1.24 0.68 -2.45 115.58 120.06 2jmp h ASN 50 Ca -0.10 0.04 -0.19 0.00 0.71 0.00 0.00 56.30 56.76 2jmp h ASN 50 Cb 1.87 -0.04 -0.03 0.00 0.73 0.00 0.00 38.32 40.86 2jmp h ASN 50 CO 0.14 0.28 -1.05 -1.28 -1.29 0.00 0.00 177.43 174.23 2jmp h SER 51 N 0.57 0.00 -0.47 1.15 0.87 -1.57 -3.27 113.55 110.82 2jmp h SER 51 Ca 0.28 -0.59 0.09 0.00 -1.23 0.00 0.00 61.79 60.34 2jmp h SER 51 Cb 0.22 0.00 -0.10 0.00 -0.44 0.00 0.00 62.40 62.08 2jmp h SER 51 CO -0.20 1.41 -0.30 -0.07 -0.53 0.00 0.00 176.83 177.14 2jmp h LEU 52 N -1.00 -1.01 -0.09 2.23 3.38 -1.31 0.70 115.31 118.21 2jmp h LEU 52 Ca -0.29 0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2jmp h LEU 52 Cb 1.25 0.50 0.00 0.00 0.09 0.00 0.00 40.66 42.50 2jmp h LEU 52 CO -0.18 -0.30 0.00 -3.20 0.09 0.00 0.00 178.44 174.86 2jmp n ASN 53 N -5.42 0.11 0.11 -0.43 5.15 -0.92 -1.82 115.26 112.04 2jmp n ASN 53 Ca 0.03 0.52 -0.03 0.00 -0.60 0.00 0.00 54.58 54.50 2jmp n ASN 53 Cb 0.34 -0.55 0.10 0.00 -0.53 0.00 0.00 39.78 39.14 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 0.05 -1.07 1.20 -0.00 0.34 -3.40 116.42 113.53 2jmp h ASP 54 Ca 0.00 -0.03 -0.17 0.00 -0.00 0.00 0.00 57.03 56.83 2jmp h ASP 54 Cb 0.32 -0.01 -0.17 0.00 -0.00 0.00 0.00 39.33 39.47 2jmp h ASP 54 CO 0.00 0.73 -0.52 0.21 -0.00 0.00 0.00 179.24 179.67 2jmp s ASN 55 N -6.84 -1.30 -0.83 2.28 2.47 -0.86 -5.04 114.94 104.83 2jmp s ASN 55 Ca -0.01 -1.80 0.01 0.00 0.42 0.00 0.00 52.86 51.48 2jmp s ASN 55 Cb 0.12 1.78 0.34 0.00 -1.45 0.00 0.00 41.25 42.03 2jmp s ASN 55 CO 0.78 -0.06 1.53 -0.24 -3.72 0.00 0.00 177.10 175.39 2jmp n SER 56 N 2.96 6.30 -1.09 -4.21 2.88 -0.76 -4.82 113.62 114.88 2jmp n SER 56 Ca 0.19 -3.71 0.00 0.00 -1.33 0.00 0.00 58.87 54.02 2jmp n SER 56 Cb 0.56 -0.92 0.00 0.00 -0.75 0.00 0.00 64.21 63.10 2jmp n SER 56 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2jmp n GLU 57 N -0.20 0.65 0.32 -1.46 4.71 -1.26 -4.15 120.64 119.25 2jmp n GLU 57 Ca 0.42 0.00 0.18 0.00 -0.01 0.00 0.00 57.16 57.76 2jmp n GLU 57 Cb 0.33 -1.18 0.98 0.00 -1.01 0.00 0.00 31.44 30.56 2jmp n GLU 57 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 2jmp h ILE 58 N 0.48 0.00 0.00 -3.67 2.04 -1.94 0.28 117.51 114.70 2jmp h ILE 58 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2jmp h ILE 58 Cb 0.65 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 37.53 2jmp h ILE 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.15 2jmp n ILE 59 N -2.91 0.03 0.17 -0.67 3.06 -1.26 -1.74 119.36 116.04 2jmp n ILE 59 Ca -0.02 0.01 0.05 0.00 -2.50 0.00 0.00 62.75 60.28 2jmp n ILE 59 Cb 0.22 -0.83 0.20 0.00 0.54 0.00 0.00 39.64 39.77 2jmp n ILE 59 CO 0.00 0.00 0.00 0.45 -2.50 0.00 0.00 176.55 174.50 2jmp h HIS 60 N 0.00 0.00 0.00 9.51 3.86 -0.79 -3.33 115.15 124.40 2jmp h HIS 60 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2jmp h HIS 60 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 2jmp h HIS 60 CO 0.00 0.41 -0.87 1.28 0.86 0.00 0.00 177.93 179.61 2jmp n LEU 61 N -3.34 2.58 -0.29 2.43 4.32 -0.71 -4.70 117.00 117.29 2jmp n LEU 61 Ca 0.01 0.00 0.33 0.00 -0.02 0.00 0.00 56.01 56.33 2jmp n LEU 61 Cb 0.61 0.00 0.72 0.00 -1.62 0.00 0.00 43.42 43.13 2jmp n LEU 61 CO 0.38 0.43 1.30 0.00 -1.22 0.00 0.00 177.39 178.28 2jmp h ALA 62 N 0.00 2.98 0.00 -1.18 0.00 -1.59 -1.16 119.26 118.32 2jmp h ALA 62 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2jmp h ALA 62 Cb 0.87 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2jmp h ALA 62 CO 0.00 -1.31 0.00 -0.85 0.00 0.00 0.00 179.25 177.09 2jmp n GLU 63 N -4.24 0.56 0.00 0.00 0.28 -1.25 -2.85 120.64 113.14 2jmp n GLU 63 Ca 0.24 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.24 2jmp n GLU 63 Cb 1.15 -1.22 0.00 0.00 1.43 0.00 0.00 31.44 32.80 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 1.03 0.80 0.31 -1.84 7.64 -0.44 -4.58 113.62 116.53 2jmp n SER 64 Ca 0.00 0.00 0.17 0.00 1.01 0.00 0.00 58.87 60.05 2jmp n SER 64 Cb 0.28 0.00 0.99 0.00 -1.01 0.00 0.00 64.21 64.47 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 0.00 0.00 0.00 -3.43 7.12 -1.70 -3.41 115.31 113.89 2jmp h LEU 65 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 2jmp h LEU 65 Cb 0.49 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.62 2jmp h LEU 65 CO 0.00 0.01 0.00 0.00 -0.13 0.00 0.00 178.44 178.32 2jmp n TYR 66 N -3.63 0.00 -0.64 1.25 0.18 -1.25 -5.07 117.16 108.00 2jmp n TYR 66 Ca -0.03 0.00 -0.31 0.00 1.88 0.00 0.00 57.90 59.44 2jmp n TYR 66 Cb 0.09 0.00 0.19 0.00 -0.38 0.00 0.00 39.34 39.23 2jmp n TYR 66 CO 0.00 0.00 0.00 -1.91 -2.08 0.00 0.00 176.86 172.87 2jmp n GLU 67 N 0.00 -1.31 0.00 -3.48 2.13 -1.26 -4.27 120.64 112.44 2jmp n GLU 67 Ca 0.00 -0.34 0.00 0.00 0.66 0.00 0.00 57.16 57.48 2jmp n GLU 67 Cb 0.00 -2.06 0.00 0.00 0.27 0.00 0.00 31.44 29.65 2jmp n GLU 67 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2jmp n GLY 68 N 1.14 0.77 3.70 8.31 0.00 -1.26 -5.06 105.19 112.79 2jmp n GLY 68 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2jmp n GLY 68 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jmp s ILE 69 N -2.00 3.00 -0.20 -0.61 -1.09 -1.26 -4.75 121.20 114.28 2jmp s ILE 69 Ca 0.00 0.61 0.17 0.00 -2.23 0.00 0.00 60.65 59.19 2jmp s ILE 69 Cb 0.00 -3.39 -0.24 0.00 -1.58 0.00 0.00 42.46 37.25 2jmp s ILE 69 CO 0.00 0.02 0.05 1.17 -1.23 0.00 0.00 174.94 174.96 2jmp n LYS 70 N 4.72 0.69 -3.32 2.79 0.00 -0.90 -5.02 118.16 117.12 2jmp n LYS 70 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.46 2jmp n LYS 70 Cb 0.40 -1.52 0.00 0.00 0.00 0.00 0.00 35.03 33.91 2jmp n LYS 70 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2jmp n SER 71 N -2.79 0.00 -3.80 3.14 2.88 -1.26 -5.08 113.62 106.71 2jmp n SER 71 Ca -0.34 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.08 2jmp n SER 71 Cb 1.15 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 64.50 2jmp n SER 71 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2jmp s VAL 72 N -2.85 0.04 0.04 2.46 1.01 -1.26 -3.60 120.40 116.24 2jmp s VAL 72 Ca 0.00 -0.33 -0.27 0.00 0.00 0.00 0.00 61.98 61.38 2jmp s VAL 72 Cb 0.00 -0.46 0.09 0.00 0.00 0.00 0.00 36.38 36.01 2jmp s VAL 72 CO 0.00 -0.18 0.76 0.21 0.00 0.00 0.00 175.10 175.89 2jmp s ASN 73 N -0.71 -0.48 0.00 3.32 2.47 -0.91 -4.93 114.94 113.70 2jmp s ASN 73 Ca -0.08 0.13 -0.01 0.00 0.42 0.00 0.00 52.86 53.33 2jmp s ASN 73 Cb -0.04 0.48 -0.01 0.00 -1.45 0.00 0.00 41.25 40.23 2jmp s ASN 73 CO 0.02 -0.73 0.00 -0.36 -3.72 0.00 0.00 177.10 172.31 2jmp s PHE 74 N -2.93 0.08 0.00 0.43 2.99 -1.26 -1.92 117.98 115.37 2jmp s PHE 74 Ca 0.01 -0.16 0.00 0.00 0.00 0.00 0.00 56.93 56.77 2jmp s PHE 74 Cb -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 43.02 42.95 2jmp s PHE 74 CO -0.07 -0.08 0.00 1.33 -0.00 0.00 0.00 175.22 176.40 2jmp n VAL 75 N 2.50 0.00 -3.28 -0.44 0.24 -0.99 -4.88 118.33 111.48 2jmp n VAL 75 Ca -0.17 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 61.90 2jmp n VAL 75 Cb 0.58 0.00 -0.00 0.00 -1.47 0.00 0.00 33.84 32.95 2jmp n VAL 75 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2jmp s ASN 76 N 1.09 6.12 0.00 -1.34 -0.87 -1.12 0.20 114.94 119.01 2jmp s ASN 76 Ca 0.00 0.33 0.00 0.00 -1.57 0.00 0.00 52.86 51.62 2jmp s ASN 76 Cb 0.00 -1.79 0.00 0.00 -0.02 0.00 0.00 41.25 39.44 2jmp s ASN 76 CO 0.00 -0.43 0.80 -0.62 -2.57 0.00 0.00 177.10 174.28 2jmp n GLU 77 N -1.85 0.00 -0.12 -0.60 1.02 -1.26 0.63 120.64 118.45 2jmp n GLU 77 Ca -0.03 0.80 -0.06 0.00 -0.02 0.00 0.00 57.16 57.86 2jmp n GLU 77 Cb 0.57 -1.22 0.00 0.00 -0.02 0.00 0.00 31.44 30.77 2jmp n GLU 77 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 2jmp h GLN 78 N 0.00 -0.18 0.01 3.49 4.20 -1.99 -0.21 115.11 120.44 2jmp h GLN 78 Ca 0.00 0.01 0.01 0.00 0.06 0.00 0.00 58.65 58.73 2jmp h GLN 78 Cb 0.00 0.04 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 2jmp h GLN 78 CO 0.00 -0.12 -0.27 -0.44 -0.67 0.00 0.00 178.83 177.34 2jmp h ASP 79 N -0.18 -0.81 -0.91 1.46 3.45 -1.43 0.18 116.42 118.17 2jmp h ASP 79 Ca 0.19 0.09 0.22 0.00 0.43 0.00 0.00 57.03 57.96 2jmp h ASP 79 Cb 0.49 0.31 -0.17 0.00 -0.56 0.00 0.00 39.33 39.40 2jmp h ASP 79 CO -0.52 -0.26 -0.06 0.15 -1.57 0.00 0.00 179.24 176.97 2jmp h PHE 80 N -0.34 -0.20 0.23 4.55 3.57 0.65 -0.96 116.94 124.44 2jmp h PHE 80 Ca 0.00 0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 2jmp h PHE 80 Cb 0.36 0.23 -0.00 0.00 2.79 0.00 0.00 35.95 39.33 2jmp h PHE 80 CO -0.42 -0.37 -0.17 0.35 -2.23 0.00 0.00 178.31 175.46 2jmp h PHE 81 N 0.03 -0.48 -0.46 0.41 3.57 0.07 -1.69 116.94 118.39 2jmp h PHE 81 Ca 0.50 -0.00 0.19 0.00 3.53 0.00 0.00 57.97 62.19 2jmp h PHE 81 Cb 0.92 0.18 -0.08 0.00 2.79 0.00 0.00 35.95 39.76 2jmp h PHE 81 CO -0.55 -0.25 0.22 0.34 -2.23 0.00 0.00 178.31 175.84 2jmp n PHE 82 N -3.36 0.51 -0.04 0.41 -0.00 0.54 0.33 117.46 115.87 2jmp n PHE 82 Ca -0.05 0.55 -0.14 0.00 -0.00 0.00 0.00 57.45 57.82 2jmp n PHE 82 Cb 0.17 -0.98 -0.11 0.00 -0.00 0.00 0.00 39.48 38.55 2jmp n PHE 82 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 176.76 175.85 2jmp h ASN 83 N 0.00 0.03 1.36 -2.13 2.35 -1.11 -3.09 115.58 112.99 2jmp h ASN 83 Ca 0.38 -0.70 0.00 0.00 -0.55 0.00 0.00 56.30 55.43 2jmp h ASN 83 Cb 0.99 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.35 2jmp h ASN 83 CO -0.37 0.73 0.00 0.25 -1.65 0.00 0.00 177.43 176.39 2jmp h LEU 84 N -0.66 0.00 -0.75 1.61 5.85 0.58 -2.81 115.31 119.14 2jmp h LEU 84 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2jmp h LEU 84 Cb 0.73 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.76 2jmp h LEU 84 CO 0.01 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.11 2jmp h ALA 85 N 2.12 1.00 0.51 1.25 0.00 0.56 -3.31 119.26 121.39 2jmp h ALA 85 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 2jmp h ALA 85 Cb 0.68 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.47 2jmp h ALA 85 CO 0.00 0.00 -0.25 -0.22 0.00 0.00 0.00 179.25 178.78 2jmp h LYS 86 N 0.00 -0.66 0.00 0.00 3.11 -1.41 -3.39 116.57 114.22 2jmp h LYS 86 Ca 0.00 0.05 0.00 0.00 -2.81 0.00 0.00 60.65 57.89 2jmp h LYS 86 Cb 0.70 0.15 0.00 0.00 -1.00 0.00 0.00 32.23 32.08 2jmp h LYS 86 CO 0.00 -0.44 0.00 1.28 -2.81 0.00 0.00 179.45 177.48 2jmp n LEU 87 N -4.17 0.00 0.00 5.20 4.77 -1.25 -4.76 117.00 116.79 2jmp n LEU 87 Ca -0.09 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.82 2jmp n LEU 87 Cb 0.27 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.41 2jmp n LEU 87 CO 0.21 0.00 0.20 -0.62 -1.33 0.00 0.00 177.39 175.85 2jmp n GLU 88 N 0.00 0.17 -2.58 3.23 1.02 -1.26 -4.86 120.64 116.36 2jmp n GLU 88 Ca 0.00 -0.78 -0.01 0.00 -0.02 0.00 0.00 57.16 56.34 2jmp n GLU 88 Cb 0.00 -0.27 0.00 0.00 -0.02 0.00 0.00 31.44 31.16 2jmp n GLU 88 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2jmp n GLU 89 N -1.65 -2.89 0.00 3.49 1.02 -1.26 -4.66 120.64 114.68 2jmp n GLU 89 Ca 0.05 2.41 0.00 0.00 -0.02 0.00 0.00 57.16 59.60 2jmp n GLU 89 Cb 0.18 -4.88 0.00 0.00 -0.02 0.00 0.00 31.44 26.72 2jmp n GLU 89 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 2jmp n ASN 90 N 0.45 -5.86 -2.80 1.62 4.05 -1.26 -4.78 115.26 106.67 2jmp n ASN 90 Ca 0.02 0.00 -0.10 0.00 0.45 0.00 0.00 54.58 54.94 2jmp n ASN 90 Cb 0.07 0.00 0.06 0.00 1.23 0.00 0.00 39.78 41.14 2jmp n ASN 90 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 2jmp n SER 91 N -3.01 -1.97 -3.79 1.20 3.41 -1.26 -4.90 113.62 103.30 2jmp n SER 91 Ca 0.00 -3.53 -0.31 0.00 -0.26 0.00 0.00 58.87 54.77 2jmp n SER 91 Cb 0.00 1.53 0.02 0.00 -0.26 0.00 0.00 64.21 65.50 2jmp n SER 91 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2jmp n ARG 92 N 0.58 -1.79 -3.16 4.33 1.74 -1.26 -4.97 116.66 112.13 2jmp n ARG 92 Ca 0.09 0.42 0.03 0.00 -0.77 0.00 0.00 57.85 57.62 2jmp n ARG 92 Cb 0.68 -4.13 -0.01 0.00 -1.02 0.00 0.00 32.46 27.98 2jmp n ARG 92 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2jmp s ASP 93 N -3.74 -1.33 -0.92 0.55 1.01 -1.26 -5.10 116.67 105.88 2jmp s ASP 93 Ca 0.34 0.70 -0.21 0.00 0.71 0.00 0.00 52.55 54.09 2jmp s ASP 93 Cb -0.13 2.08 0.09 0.00 1.01 0.00 0.00 42.92 45.97 2jmp s ASP 93 CO 0.88 -0.27 1.22 0.28 0.21 0.00 0.00 175.17 177.48 2jmp s THR 94 N 2.83 4.38 0.02 -1.27 -1.32 -1.26 -4.90 115.64 114.13 2jmp s THR 94 Ca 0.18 -1.10 -0.08 0.00 -1.21 0.00 0.00 61.69 59.48 2jmp s THR 94 Cb -0.14 -4.87 -0.04 0.00 -1.51 0.00 0.00 72.50 65.94 2jmp s THR 94 CO -0.22 -1.66 1.13 -0.07 -2.21 0.00 0.00 174.62 171.59 2jmp h LEU 95 N 11.39 -0.30 -6.22 9.08 4.07 -2.02 -3.45 115.31 127.86 2jmp h LEU 95 Ca 0.10 0.02 0.06 0.00 0.08 0.00 0.00 57.88 58.14 2jmp h LEU 95 Cb 1.03 0.10 -0.22 0.00 1.08 0.00 0.00 40.66 42.64 2jmp h LEU 95 CO 1.23 -0.16 -0.28 -0.47 -1.08 0.00 0.00 178.44 177.68 2jmp s TYR 96 N -3.64 -1.46 0.00 1.13 5.04 -1.26 -4.98 117.35 112.17 2jmp s TYR 96 Ca -0.04 1.69 0.00 0.00 -2.44 0.00 0.00 57.07 56.28 2jmp s TYR 96 Cb 0.01 0.53 0.00 0.00 0.35 0.00 0.00 41.96 42.85 2jmp s TYR 96 CO 0.13 -0.82 0.00 0.94 -1.34 0.00 0.00 175.55 174.46 2jmp n GLN 97 N 5.42 0.00 0.00 4.97 0.00 -1.26 -5.09 117.38 121.42 2jmp n GLN 97 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.97 2jmp n GLN 97 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.75 2jmp n GLN 97 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 2jmp n ASN 98 N 0.00 0.00 0.00 1.69 5.15 -1.26 -5.07 115.26 115.77 2jmp n ASN 98 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2jmp n ASN 98 Cb 0.06 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.31 2jmp n ASN 98 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 2jmp n SER 99 N 0.00 2.24 0.00 1.20 2.88 -1.26 -5.29 113.62 113.40 2jmp n SER 99 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2jmp n SER 99 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2jmp n SER 99 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42