#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 0.50 0.00 3.17 5.08 -2.04 -3.27 114.58 118.01 2jmp h GLU 2 Ca 0.00 -0.84 0.00 0.00 -1.00 0.00 0.00 59.36 57.52 2jmp h GLU 2 Cb 0.00 0.31 0.00 0.00 0.50 0.00 0.00 28.75 29.56 2jmp h GLU 2 CO 0.00 1.40 0.00 0.94 -1.00 0.00 0.00 179.01 180.35 2jmp n GLN 3 N -3.69 0.00 -0.30 2.33 7.27 -1.26 0.23 117.38 121.97 2jmp n GLN 3 Ca -0.15 0.51 0.11 0.00 0.07 0.00 0.00 57.00 57.55 2jmp n GLN 3 Cb 1.09 -1.07 0.25 0.00 2.41 0.00 0.00 30.24 32.92 2jmp n GLN 3 CO 0.00 0.00 0.00 0.35 0.07 0.00 0.00 177.06 177.48 2jmp h PHE 4 N 0.00 0.15 -0.00 3.69 3.04 -1.99 2.63 116.94 124.46 2jmp h PHE 4 Ca 0.00 0.06 0.00 0.00 3.98 0.00 0.00 57.97 62.01 2jmp h PHE 4 Cb 0.00 0.07 -0.00 0.00 2.56 0.00 0.00 35.95 38.58 2jmp h PHE 4 CO -0.12 -0.27 0.00 -0.97 -2.02 0.00 0.00 178.31 174.93 2jmp h ASN 5 N 0.13 0.00 0.06 0.41 -0.73 -1.21 0.65 115.58 114.89 2jmp h ASN 5 Ca 0.52 0.00 -0.00 0.00 1.87 0.00 0.00 56.30 58.69 2jmp h ASN 5 Cb 1.03 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.62 2jmp h ASN 5 CO -0.72 0.00 -0.03 0.00 -0.37 0.00 0.00 177.43 176.31 2jmp h ALA 6 N 2.00 -0.08 -0.48 1.57 0.00 1.84 -1.72 119.26 122.38 2jmp h ALA 6 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2jmp h ALA 6 Cb 0.01 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 2jmp h ALA 6 CO -0.00 -0.08 0.27 0.35 0.00 0.00 0.00 179.25 179.79 2jmp h PHE 7 N -0.93 0.66 0.01 0.00 3.04 -0.81 -1.69 116.94 117.22 2jmp h PHE 7 Ca -0.01 -0.02 -0.00 0.00 3.98 0.00 0.00 57.97 61.93 2jmp h PHE 7 Cb 0.06 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 38.36 2jmp h PHE 7 CO 0.00 0.49 -0.00 -0.22 -2.02 0.00 0.00 178.31 176.56 2jmp h LYS 8 N 0.64 -0.01 -0.04 1.11 3.64 0.16 -0.38 116.57 121.70 2jmp h LYS 8 Ca 0.17 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.56 2jmp h LYS 8 Cb 0.05 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2jmp h LYS 8 CO -0.03 0.02 0.13 0.77 -2.27 0.00 0.00 179.45 178.07 2jmp h SER 9 N -0.04 0.00 -0.41 4.20 0.02 -1.06 0.55 113.55 116.81 2jmp h SER 9 Ca -0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.85 2jmp h SER 9 Cb 0.04 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 2jmp h SER 9 CO 0.00 0.00 -0.08 0.25 -1.14 0.00 0.00 176.83 175.86 2jmp h LEU 10 N 0.00 0.84 -0.42 5.07 6.46 -0.11 -2.74 115.31 124.40 2jmp h LEU 10 Ca 0.02 -0.25 -0.01 0.00 -0.12 0.00 0.00 57.88 57.52 2jmp h LEU 10 Cb 0.28 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 39.96 2jmp h LEU 10 CO -0.00 0.95 0.22 -0.07 -0.62 0.00 0.00 178.44 178.92 2jmp h LEU 11 N 0.77 0.54 -0.95 2.25 3.38 0.32 -2.74 115.31 118.88 2jmp h LEU 11 Ca 0.13 -0.11 0.16 0.00 0.09 0.00 0.00 57.88 58.15 2jmp h LEU 11 Cb 0.58 -0.14 -0.16 0.00 0.09 0.00 0.00 40.66 41.03 2jmp h LEU 11 CO 0.04 0.49 -0.34 0.29 0.09 0.00 0.00 178.44 179.01 2jmp n LYS 12 N -4.70 -0.19 -0.31 1.13 5.02 -1.04 0.31 118.16 118.39 2jmp n LYS 12 Ca 0.01 1.47 0.07 0.00 -2.02 0.00 0.00 58.31 57.84 2jmp n LYS 12 Cb 0.09 -2.19 0.23 0.00 -0.02 0.00 0.00 35.03 33.14 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 0.70 0.49 1.97 1.79 -1.52 2.41 116.57 122.41 2jmp h LYS 13 Ca 0.36 -0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.77 2jmp h LYS 13 Cb 0.60 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 31.10 2jmp h LYS 13 CO -0.96 0.46 -0.24 1.25 -1.08 0.00 0.00 179.45 178.89 2jmp h HIS 14 N 0.72 -0.61 -0.39 -1.35 2.76 0.49 -3.19 115.15 113.58 2jmp h HIS 14 Ca 0.47 -0.01 -0.19 0.00 -2.20 0.00 0.00 60.37 58.44 2jmp h HIS 14 Cb 0.62 0.20 -0.11 0.00 1.55 0.00 0.00 27.41 29.67 2jmp h HIS 14 CO -0.06 -0.38 0.24 0.66 -1.30 0.00 0.00 177.93 177.08 2jmp n TYR 15 N -4.46 1.23 -0.01 5.26 4.02 0.24 -4.54 117.16 118.89 2jmp n TYR 15 Ca -0.08 -0.97 -0.15 0.00 -0.01 0.00 0.00 57.90 56.69 2jmp n TYR 15 Cb 0.26 -0.51 -0.09 0.00 -0.02 0.00 0.00 39.34 38.98 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 0.57 -0.55 -0.02 -0.72 4.81 0.41 0.46 114.58 119.54 2jmp h GLU 16 Ca 0.23 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 2jmp h GLU 16 Cb 1.70 0.13 0.00 0.00 0.63 0.00 0.00 28.75 31.20 2jmp h GLU 16 CO 0.43 -0.37 0.00 1.63 -0.73 0.00 0.00 179.01 179.97 2jmp n LYS 17 N -5.44 1.06 -2.72 1.92 5.02 -1.26 -3.70 118.16 113.04 2jmp n LYS 17 Ca -0.06 -0.10 -0.22 0.00 -2.02 0.00 0.00 58.31 55.91 2jmp n LYS 17 Cb 0.38 -1.11 -0.01 0.00 -0.02 0.00 0.00 35.03 34.27 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 -0.51 1.97 -0.05 -0.18 -1.04 0.16 -4.88 114.28 109.74 2jmp n THR 18 Ca 0.05 -4.68 -0.02 0.00 -2.04 0.00 0.00 64.05 57.36 2jmp n THR 18 Cb 0.04 -0.79 -0.01 0.00 -1.82 0.00 0.00 70.33 67.76 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 2.58 0.00 -0.29 12.58 2.10 -1.56 -3.36 117.51 129.56 2jmp h ILE 19 Ca 0.15 -0.93 0.03 0.00 1.08 0.00 0.00 64.86 65.19 2jmp h ILE 19 Cb 0.87 0.00 -0.03 0.00 -1.09 0.00 0.00 36.82 36.57 2jmp h ILE 19 CO 0.73 0.00 -0.17 0.61 -1.08 0.00 0.00 178.15 178.24 2jmp n GLY 20 N 1.73 -1.31 0.35 8.18 0.00 -1.26 0.29 105.19 113.17 2jmp n GLY 20 Ca -0.03 0.45 0.06 0.00 0.00 0.00 0.00 46.02 46.50 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 -0.47 0.71 1.61 3.04 -1.97 0.56 116.94 120.42 2jmp h PHE 21 Ca 0.05 0.09 -0.03 0.00 3.98 0.00 0.00 57.97 62.05 2jmp h PHE 21 Cb 0.12 0.36 0.01 0.00 2.56 0.00 0.00 35.95 38.99 2jmp h PHE 21 CO -0.46 -0.42 -0.34 1.25 -2.02 0.00 0.00 178.31 176.32 2jmp h HIS 22 N 0.00 -0.88 0.00 0.41 2.76 0.42 1.06 115.15 118.91 2jmp h HIS 22 Ca 0.48 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.63 2jmp h HIS 22 Cb 0.76 0.29 0.00 0.00 1.55 0.00 0.00 27.41 30.01 2jmp h HIS 22 CO -0.73 -0.55 0.26 -3.47 -1.30 0.00 0.00 177.93 172.15 2jmp n ASP 23 N -4.90 0.26 -0.07 3.26 -0.08 0.16 0.18 116.55 115.36 2jmp n ASP 23 Ca -0.12 0.50 -0.08 0.00 -1.51 0.00 0.00 54.79 53.59 2jmp n ASP 23 Cb 0.37 -0.46 -0.03 0.00 2.34 0.00 0.00 41.12 43.35 2jmp n ASP 23 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 2jmp n LYS 24 N -1.87 0.45 0.00 -0.67 3.00 0.18 -4.50 118.16 114.75 2jmp n LYS 24 Ca -0.01 0.18 0.00 0.00 -0.00 0.00 0.00 58.31 58.48 2jmp n LYS 24 Cb 0.28 -1.28 0.00 0.00 0.00 0.00 0.00 35.03 34.03 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 -4.23 0.00 0.18 5.64 4.02 0.36 -4.59 117.16 118.54 2jmp n TYR 25 Ca -0.12 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.70 2jmp n TYR 25 Cb 0.44 -0.42 -0.04 0.00 -0.02 0.00 0.00 39.34 39.30 2jmp n TYR 25 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 2jmp h ILE 26 N 0.00 0.00 0.00 -0.72 5.03 -1.51 -3.45 117.51 116.86 2jmp h ILE 26 Ca 0.00 -0.12 0.00 0.00 -0.12 0.00 0.00 64.86 64.62 2jmp h ILE 26 Cb 0.00 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 33.79 2jmp h ILE 26 CO 0.00 0.00 0.00 1.17 -0.68 0.00 0.00 178.15 178.64 2jmp n LYS 27 N -3.61 0.00 -3.15 2.37 4.81 0.48 -4.15 118.16 114.90 2jmp n LYS 27 Ca -0.06 0.00 0.05 0.00 -0.87 0.00 0.00 58.31 57.43 2jmp n LYS 27 Cb 0.19 0.00 -0.00 0.00 0.02 0.00 0.00 35.03 35.24 2jmp n LYS 27 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2jmp s ASP 28 N -0.65 -0.59 0.00 3.14 3.68 -1.26 -4.85 116.67 116.15 2jmp s ASP 28 Ca 0.00 0.10 0.00 0.00 2.13 0.00 0.00 52.55 54.78 2jmp s ASP 28 Cb 0.00 1.38 0.00 0.00 -1.45 0.00 0.00 42.92 42.85 2jmp s ASP 28 CO 0.00 -0.11 0.00 -0.38 0.13 0.00 0.00 175.17 174.81 2jmp n ILE 29 N 5.19 0.00 -1.50 4.11 2.08 -1.26 -5.06 119.36 122.92 2jmp n ILE 29 Ca 0.07 0.00 -0.00 0.00 0.56 0.00 0.00 62.75 63.38 2jmp n ILE 29 Cb 0.57 -0.11 -0.00 0.00 -0.75 0.00 0.00 39.64 39.34 2jmp n ILE 29 CO 0.00 0.00 0.00 -3.20 0.56 0.00 0.00 176.55 173.91 2jmp n ASN 30 N 0.00 -0.01 -3.48 4.38 4.05 -1.26 -5.09 115.26 113.85 2jmp n ASN 30 Ca 0.00 -0.51 -0.24 0.00 0.45 0.00 0.00 54.58 54.28 2jmp n ASN 30 Cb 0.00 0.00 -0.13 0.00 1.23 0.00 0.00 39.78 40.89 2jmp n ASN 30 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 2jmp s ARG 31 N 0.00 0.26 -0.17 1.20 1.81 -1.26 -5.09 118.95 115.70 2jmp s ARG 31 Ca 0.00 -0.41 -0.05 0.00 -1.72 0.00 0.00 55.73 53.55 2jmp s ARG 31 Cb 0.00 -0.96 0.08 0.00 -0.45 0.00 0.00 34.95 33.63 2jmp s ARG 31 CO 0.00 -1.03 0.31 -0.59 -0.68 0.00 0.00 175.30 173.31 2jmp s PHE 32 N 2.15 -0.55 0.05 -0.53 -0.71 -1.26 -2.15 117.98 114.98 2jmp s PHE 32 Ca 0.10 1.01 0.06 0.00 -1.04 0.00 0.00 56.93 57.06 2jmp s PHE 32 Cb -0.15 0.02 -0.02 0.00 -1.21 0.00 0.00 43.02 41.65 2jmp s PHE 32 CO -0.33 -0.46 -0.18 0.14 -1.34 0.00 0.00 175.22 173.05 2jmp s VAL 33 N 2.47 1.45 -0.45 -2.49 -7.23 -1.02 -5.01 120.40 108.12 2jmp s VAL 33 Ca 0.03 -1.14 0.09 0.00 -1.81 0.00 0.00 61.98 59.14 2jmp s VAL 33 Cb -0.13 -1.28 0.34 0.00 0.56 0.00 0.00 36.38 35.87 2jmp s VAL 33 CO -0.11 0.11 0.79 2.22 -0.31 0.00 0.00 175.10 177.79 2jmp n PHE 34 N 1.81 1.54 -2.34 2.82 -1.74 -1.26 -2.64 117.46 115.65 2jmp n PHE 34 Ca -0.18 -3.87 -0.16 0.00 -0.56 0.00 0.00 57.45 52.68 2jmp n PHE 34 Cb 0.54 -0.44 0.03 0.00 1.52 0.00 0.00 39.48 41.12 2jmp n PHE 34 CO 0.00 0.00 0.00 1.17 -0.56 0.00 0.00 176.76 177.37 2jmp n LYS 35 N 0.22 2.91 -1.99 3.97 4.81 -1.26 -4.72 118.16 122.09 2jmp n LYS 35 Ca 0.27 -3.95 -0.04 0.00 -0.87 0.00 0.00 58.31 53.72 2jmp n LYS 35 Cb 0.55 -2.02 0.05 0.00 0.02 0.00 0.00 35.03 33.62 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 -0.63 -1.06 -1.13 3.14 3.02 -1.26 -4.96 115.26 112.38 2jmp n ASN 36 Ca 0.31 -2.12 -0.14 0.00 -0.03 0.00 0.00 54.58 52.60 2jmp n ASN 36 Cb 0.89 0.45 -0.06 0.00 -0.61 0.00 0.00 39.78 40.45 2jmp n ASN 36 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2jmp n ASN 37 N -0.84 -4.95 -3.84 6.41 4.13 -1.26 -4.89 115.26 110.01 2jmp n ASN 37 Ca -0.20 0.34 -0.10 0.00 1.68 0.00 0.00 54.58 56.30 2jmp n ASN 37 Cb 0.82 -4.02 -0.06 0.00 -1.54 0.00 0.00 39.78 34.97 2jmp n ASN 37 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2jmp s VAL 38 N -2.12 0.07 -0.21 2.41 1.01 -1.26 -4.28 120.40 116.03 2jmp s VAL 38 Ca 0.00 -1.09 0.02 0.00 0.00 0.00 0.00 61.98 60.91 2jmp s VAL 38 Cb 0.00 -1.59 0.03 0.00 0.00 0.00 0.00 36.38 34.82 2jmp s VAL 38 CO 0.00 -0.32 -0.17 -0.76 0.00 0.00 0.00 175.10 173.85 2jmp s LEU 39 N -2.90 2.55 0.05 3.92 1.02 -1.18 -4.18 118.68 117.96 2jmp s LEU 39 Ca 0.11 -0.87 0.08 0.00 0.02 0.00 0.00 54.13 53.47 2jmp s LEU 39 Cb 0.02 -1.51 -0.03 0.00 0.02 0.00 0.00 46.19 44.70 2jmp s LEU 39 CO -0.04 -0.06 -0.22 -0.22 0.02 0.00 0.00 176.35 175.83 2jmp s LEU 40 N 1.24 2.40 -0.05 1.79 0.20 -1.08 -2.40 118.68 120.78 2jmp s LEU 40 Ca 0.01 -0.51 -0.04 0.00 0.69 0.00 0.00 54.13 54.28 2jmp s LEU 40 Cb -0.15 -1.40 0.02 0.00 -0.43 0.00 0.00 46.19 44.22 2jmp s LEU 40 CO -0.10 0.25 0.12 -0.63 -0.29 0.00 0.00 176.35 175.70 2jmp s ILE 41 N -0.88 -0.01 0.34 6.68 1.01 -0.94 -2.43 121.20 124.97 2jmp s ILE 41 Ca 0.13 0.03 -0.29 0.00 0.00 0.00 0.00 60.65 60.52 2jmp s ILE 41 Cb -0.10 -0.18 -0.11 0.00 0.01 0.00 0.00 42.46 42.09 2jmp s ILE 41 CO 0.04 0.01 1.39 -0.76 0.00 0.00 0.00 174.94 175.62 2jmp s LEU 42 N 0.23 4.38 -0.29 2.97 2.01 -0.91 -2.23 118.68 124.84 2jmp s LEU 42 Ca -0.01 2.82 0.02 0.00 0.01 0.00 0.00 54.13 56.97 2jmp s LEU 42 Cb -0.02 -3.65 0.18 0.00 0.01 0.00 0.00 46.19 42.70 2jmp s LEU 42 CO -0.01 -0.69 0.52 -0.22 1.01 0.00 0.00 176.35 176.96 2jmp s LEU 43 N -1.69 -1.23 -0.03 1.79 2.96 0.42 -4.78 118.68 116.13 2jmp s LEU 43 Ca 0.52 0.20 0.03 0.00 -0.22 0.00 0.00 54.13 54.66 2jmp s LEU 43 Cb -0.43 1.70 -0.25 0.00 0.50 0.00 0.00 46.19 47.72 2jmp s LEU 43 CO 0.55 -0.30 0.73 1.05 -1.32 0.00 0.00 176.35 177.05 2jmp h GLU 44 N 8.07 0.14 -6.03 1.98 4.11 -1.96 -3.30 114.58 117.59 2jmp h GLU 44 Ca -0.10 -0.24 -0.74 0.00 0.07 0.00 0.00 59.36 58.34 2jmp h GLU 44 Cb 1.16 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.49 2jmp h GLU 44 CO 0.22 0.90 1.17 0.09 0.07 0.00 0.00 179.01 181.47 2jmp n ASN 45 N -3.30 1.68 0.02 3.06 3.02 -1.26 -4.83 115.26 113.64 2jmp n ASN 45 Ca -0.18 0.75 -0.13 0.00 -0.03 0.00 0.00 54.58 55.00 2jmp n ASN 45 Cb 1.04 -1.08 -0.09 0.00 -0.61 0.00 0.00 39.78 39.04 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 9.18 -0.03 0.51 3.52 4.81 -1.99 -2.44 114.58 128.13 2jmp h GLU 46 Ca -0.29 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.92 2jmp h GLU 46 Cb 1.36 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 30.74 2jmp h GLU 46 CO 1.02 0.27 -0.32 0.74 -0.73 0.00 0.00 179.01 179.99 2jmp h PHE 47 N -0.32 -0.85 0.00 0.92 -1.00 -2.00 -2.04 116.94 111.64 2jmp h PHE 47 Ca -0.00 -0.01 0.00 0.00 2.81 0.00 0.00 57.97 60.77 2jmp h PHE 47 Cb 0.31 0.31 0.00 0.00 3.61 0.00 0.00 35.95 40.17 2jmp h PHE 47 CO 0.03 -0.47 0.00 0.00 -1.61 0.00 0.00 178.31 176.25 2jmp n ALA 48 N -2.51 -0.00 -0.34 2.45 0.00 -1.25 0.36 120.51 119.22 2jmp n ALA 48 Ca -0.09 0.00 0.30 0.00 0.00 0.00 0.00 53.44 53.65 2jmp n ALA 48 Cb 0.32 0.39 0.53 0.00 0.00 0.00 0.00 19.45 20.69 2jmp n ALA 48 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2jmp n ARG 49 N -2.11 -0.04 0.19 0.00 0.63 -0.92 0.68 116.66 115.10 2jmp n ARG 49 Ca 0.00 1.07 -0.15 0.00 -0.92 0.00 0.00 57.85 57.85 2jmp n ARG 49 Cb 0.00 -2.03 -0.08 0.00 0.45 0.00 0.00 32.46 30.80 2jmp n ARG 49 CO 0.00 0.00 0.00 -0.97 -2.51 0.00 0.00 177.63 174.15 2jmp h ASN 50 N 0.00 -1.13 -0.01 6.15 -0.73 0.68 -1.92 115.58 118.63 2jmp h ASN 50 Ca 0.71 0.11 -0.03 0.00 1.87 0.00 0.00 56.30 58.96 2jmp h ASN 50 Cb 2.13 0.40 0.00 0.00 0.27 0.00 0.00 38.32 41.12 2jmp h ASN 50 CO -0.49 -0.52 -0.12 -1.28 -0.37 0.00 0.00 177.43 174.65 2jmp h SER 51 N -0.75 0.12 -0.45 1.15 0.87 0.62 -3.02 113.55 112.09 2jmp h SER 51 Ca -0.01 -0.75 0.07 0.00 -1.23 0.00 0.00 61.79 59.87 2jmp h SER 51 Cb 0.70 -0.04 -0.09 0.00 -0.44 0.00 0.00 62.40 62.53 2jmp h SER 51 CO -0.13 0.85 -0.45 -0.07 -0.53 0.00 0.00 176.83 176.50 2jmp h LEU 52 N -0.61 -1.51 -0.08 2.23 3.38 -0.62 0.75 115.31 118.85 2jmp h LEU 52 Ca -0.01 0.23 0.00 0.00 0.09 0.00 0.00 57.88 58.19 2jmp h LEU 52 Cb 0.87 0.66 0.00 0.00 0.09 0.00 0.00 40.66 42.28 2jmp h LEU 52 CO 0.02 -0.36 0.00 0.59 0.09 0.00 0.00 178.44 178.78 2jmp n ASN 53 N -5.41 0.09 0.15 -0.43 3.02 -0.72 -1.59 115.26 110.37 2jmp n ASN 53 Ca -0.00 0.52 0.02 0.00 -0.03 0.00 0.00 54.58 55.08 2jmp n ASN 53 Cb 0.35 -0.54 0.20 0.00 -0.61 0.00 0.00 39.78 39.18 2jmp n ASN 53 CO 0.00 0.00 0.00 -0.78 -2.62 0.00 0.00 177.26 173.86 2jmp h ASP 54 N 0.00 0.00 -0.48 6.41 1.82 0.65 -3.38 116.42 121.43 2jmp h ASP 54 Ca 0.00 0.00 -0.27 0.00 -0.39 0.00 0.00 57.03 56.37 2jmp h ASP 54 Cb 0.28 0.00 -0.18 0.00 0.68 0.00 0.00 39.33 40.10 2jmp h ASP 54 CO 0.00 0.53 -0.59 -3.20 -1.61 0.00 0.00 179.24 174.37 2jmp n ASN 55 N -3.58 -2.48 -3.17 2.28 4.05 -0.79 -5.03 115.26 106.55 2jmp n ASN 55 Ca -0.00 -3.15 -0.39 0.00 0.45 0.00 0.00 54.58 51.49 2jmp n ASN 55 Cb 0.61 1.41 0.02 0.00 1.23 0.00 0.00 39.78 43.05 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 1.81 7.10 -1.81 1.20 3.41 -0.62 -4.82 113.62 119.90 2jmp n SER 56 Ca 0.12 -3.76 -0.01 0.00 -0.26 0.00 0.00 58.87 54.96 2jmp n SER 56 Cb 0.60 -1.04 -0.01 0.00 -0.26 0.00 0.00 64.21 63.50 2jmp n SER 56 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 2jmp n GLU 57 N -0.33 0.60 0.11 4.33 0.28 -1.26 -4.21 120.64 120.15 2jmp n GLU 57 Ca 0.49 -0.07 0.10 0.00 -0.16 0.00 0.00 57.16 57.51 2jmp n GLU 57 Cb 0.28 -1.31 0.45 0.00 1.43 0.00 0.00 31.44 32.29 2jmp n GLU 57 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 177.13 176.08 2jmp n ILE 58 N 1.88 1.01 0.82 3.84 2.08 -1.26 -1.46 119.36 126.27 2jmp n ILE 58 Ca 0.03 0.40 0.09 0.00 0.56 0.00 0.00 62.75 63.83 2jmp n ILE 58 Cb 0.29 -1.33 0.44 0.00 -0.75 0.00 0.00 39.64 38.30 2jmp n ILE 58 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2jmp n ILE 59 N -2.08 0.50 0.07 1.39 3.06 -1.26 -0.62 119.36 120.42 2jmp n ILE 59 Ca 0.01 0.13 -0.11 0.00 -2.50 0.00 0.00 62.75 60.27 2jmp n ILE 59 Cb 0.15 -0.83 -0.02 0.00 0.54 0.00 0.00 39.64 39.48 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 0.51 0.00 9.51 3.86 -1.62 -3.34 115.15 124.07 2jmp h HIS 60 Ca 0.00 -0.27 -0.16 0.00 -1.16 0.00 0.00 60.37 58.78 2jmp h HIS 60 Cb 0.18 -0.06 -0.03 0.00 1.06 0.00 0.00 27.41 28.57 2jmp h HIS 60 CO 0.00 1.07 -1.58 1.28 0.86 0.00 0.00 177.93 179.56 2jmp n LEU 61 N -3.74 2.32 -0.51 2.43 4.32 -0.99 -4.60 117.00 116.24 2jmp n LEU 61 Ca -0.05 0.00 0.42 0.00 -0.02 0.00 0.00 56.01 56.36 2jmp n LEU 61 Cb 0.80 -0.34 0.74 0.00 -1.62 0.00 0.00 43.42 43.01 2jmp n LEU 61 CO 0.50 0.54 1.37 0.00 -1.22 0.00 0.00 177.39 178.57 2jmp h ALA 62 N -0.12 3.28 0.00 -1.18 0.00 -1.07 -0.59 119.26 119.58 2jmp h ALA 62 Ca -0.24 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2jmp h ALA 62 Cb 1.31 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.24 2jmp h ALA 62 CO -0.07 -1.79 0.00 -0.85 0.00 0.00 0.00 179.25 176.54 2jmp n GLU 63 N -4.23 0.28 -3.61 0.00 0.28 -1.25 -4.24 120.64 107.86 2jmp n GLU 63 Ca 0.36 0.00 -0.29 0.00 -0.16 0.00 0.00 57.16 57.07 2jmp n GLU 63 Cb 1.58 -1.36 -0.14 0.00 1.43 0.00 0.00 31.44 32.95 2jmp n GLU 63 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2jmp s SER 64 N 1.15 3.58 0.00 -1.84 0.15 -0.23 -4.77 113.70 111.73 2jmp s SER 64 Ca 0.00 -1.81 0.00 0.00 0.70 0.00 0.00 55.95 54.84 2jmp s SER 64 Cb 0.00 -0.63 0.00 0.00 -1.71 0.00 0.00 66.02 63.68 2jmp s SER 64 CO 0.00 -0.38 0.00 0.18 1.20 0.00 0.00 173.24 174.24 2jmp n LEU 65 N 4.59 0.00 0.00 3.45 4.77 -1.26 -4.74 117.00 123.80 2jmp n LEU 65 Ca 0.02 0.00 -0.18 0.00 -0.03 0.00 0.00 56.01 55.82 2jmp n LEU 65 Cb 0.40 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 2jmp n LEU 65 CO 0.12 0.00 -0.11 -1.22 -1.33 0.00 0.00 177.39 174.85 2jmp n TYR 66 N 0.00 0.41 0.24 -1.77 4.01 -1.26 -5.02 117.16 113.77 2jmp n TYR 66 Ca 0.00 -1.39 0.10 0.00 -0.16 0.00 0.00 57.90 56.45 2jmp n TYR 66 Cb 0.00 -0.20 0.61 0.00 -0.31 0.00 0.00 39.34 39.44 2jmp n TYR 66 CO 0.00 0.00 0.00 1.49 -0.46 0.00 0.00 176.86 177.89 2jmp h GLU 67 N 0.00 0.00 0.00 -0.72 4.81 -1.98 -3.43 114.58 113.26 2jmp h GLU 67 Ca -0.23 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 2jmp h GLU 67 Cb 0.71 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.09 2jmp h GLU 67 CO 0.38 0.18 0.00 0.41 -0.73 0.00 0.00 179.01 179.25 2jmp n GLY 68 N -0.55 -1.18 3.32 1.92 0.00 -1.26 -5.11 105.19 102.33 2jmp n GLY 68 Ca -0.02 0.66 -0.35 0.00 0.00 0.00 0.00 46.02 46.31 2jmp n GLY 68 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2jmp n ILE 69 N 0.00 0.58 0.00 -0.61 2.08 -1.26 -5.01 119.36 115.14 2jmp n ILE 69 Ca 0.00 -0.35 0.00 0.00 0.56 0.00 0.00 62.75 62.96 2jmp n ILE 69 Cb 0.00 -0.47 0.00 0.00 -0.75 0.00 0.00 39.64 38.42 2jmp n ILE 69 CO 0.00 0.00 0.00 1.17 0.56 0.00 0.00 176.55 178.28 2jmp n LYS 70 N -0.16 0.00 -3.33 0.38 4.81 -1.26 -4.85 118.16 113.75 2jmp n LYS 70 Ca 0.06 0.00 -0.21 0.00 -0.87 0.00 0.00 58.31 57.28 2jmp n LYS 70 Cb 0.52 0.00 0.03 0.00 0.02 0.00 0.00 35.03 35.60 2jmp n LYS 70 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 2jmp s SER 71 N -0.92 5.00 -0.05 3.14 0.01 -1.26 -4.71 113.70 114.91 2jmp s SER 71 Ca 0.00 -0.92 -0.08 0.00 1.31 0.00 0.00 55.95 56.26 2jmp s SER 71 Cb 0.00 0.18 0.02 0.00 0.21 0.00 0.00 66.02 66.42 2jmp s SER 71 CO 0.00 -1.16 0.20 -0.69 0.41 0.00 0.00 173.24 172.00 2jmp s VAL 72 N -2.66 0.03 -0.11 3.43 1.01 -1.26 -3.08 120.40 117.76 2jmp s VAL 72 Ca 0.52 -0.25 -0.31 0.00 0.00 0.00 0.00 61.98 61.93 2jmp s VAL 72 Cb -0.05 -0.37 0.12 0.00 0.00 0.00 0.00 36.38 36.08 2jmp s VAL 72 CO 0.32 -0.14 1.04 0.21 0.00 0.00 0.00 175.10 176.53 2jmp s ASN 73 N -0.48 -0.27 0.07 3.32 2.47 -1.01 -4.93 114.94 114.11 2jmp s ASN 73 Ca -0.06 0.07 0.06 0.00 0.42 0.00 0.00 52.86 53.36 2jmp s ASN 73 Cb -0.04 0.27 -0.03 0.00 -1.45 0.00 0.00 41.25 40.00 2jmp s ASN 73 CO 0.01 -0.41 -0.17 -0.36 -3.72 0.00 0.00 177.10 172.45 2jmp s PHE 74 N -2.44 1.50 0.00 0.43 0.08 -1.26 -2.20 117.98 114.09 2jmp s PHE 74 Ca 0.06 -0.41 0.00 0.00 0.12 0.00 0.00 56.93 56.70 2jmp s PHE 74 Cb -0.01 -0.85 0.00 0.00 -0.57 0.00 0.00 43.02 41.59 2jmp s PHE 74 CO -0.06 0.11 0.00 1.33 -0.10 0.00 0.00 175.22 176.50 2jmp n VAL 75 N 1.43 0.00 -4.02 -0.44 0.24 -0.95 -4.87 118.33 109.73 2jmp n VAL 75 Ca -0.19 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 61.89 2jmp n VAL 75 Cb 0.54 0.00 -0.05 0.00 -1.47 0.00 0.00 33.84 32.86 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 1.27 5.25 0.00 -1.34 -0.87 -1.24 0.16 114.94 118.17 2jmp s ASN 76 Ca 0.00 -0.44 0.00 0.00 -1.57 0.00 0.00 52.86 50.85 2jmp s ASN 76 Cb 0.00 -1.12 0.00 0.00 -0.02 0.00 0.00 41.25 40.11 2jmp s ASN 76 CO 0.00 -0.18 0.76 1.21 -2.57 0.00 0.00 177.10 176.32 2jmp n GLU 77 N -1.22 0.00 -0.12 -0.60 4.07 -1.26 0.46 120.64 121.97 2jmp n GLU 77 Ca -0.05 0.76 -0.05 0.00 -0.06 0.00 0.00 57.16 57.75 2jmp n GLU 77 Cb 0.59 -1.15 0.01 0.00 -0.06 0.00 0.00 31.44 30.83 2jmp n GLU 77 CO 0.00 0.00 0.00 1.96 -0.06 0.00 0.00 177.13 179.03 2jmp h GLN 78 N 0.00 -0.12 0.09 5.31 4.20 -1.99 -1.21 115.11 121.39 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 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.78 2jmp h GLN 78 CO 0.00 -0.08 -0.36 -0.44 -0.67 0.00 0.00 178.83 177.28 2jmp h ASP 79 N -0.13 -1.07 -0.92 1.46 3.32 -1.33 0.30 116.42 118.05 2jmp h ASP 79 Ca 0.20 0.11 0.19 0.00 0.02 0.00 0.00 57.03 57.56 2jmp h ASP 79 Cb 0.43 0.39 -0.17 0.00 0.22 0.00 0.00 39.33 40.21 2jmp h ASP 79 CO -0.49 -0.38 -0.19 0.15 -1.72 0.00 0.00 179.24 176.61 2jmp h PHE 80 N -0.52 -0.42 0.20 4.55 3.57 0.45 -0.07 116.94 124.70 2jmp h PHE 80 Ca -0.01 0.08 -0.00 0.00 3.53 0.00 0.00 57.97 61.57 2jmp h PHE 80 Cb 0.52 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 2jmp h PHE 80 CO -0.39 -0.39 -0.28 0.35 -2.23 0.00 0.00 178.31 175.36 2jmp h PHE 81 N 0.01 -0.79 -0.65 0.41 3.04 -0.27 -0.81 116.94 117.88 2jmp h PHE 81 Ca 0.46 0.01 0.26 0.00 3.98 0.00 0.00 57.97 62.68 2jmp h PHE 81 Cb 0.74 0.32 -0.10 0.00 2.56 0.00 0.00 35.95 39.47 2jmp h PHE 81 CO -0.68 -0.35 0.37 0.34 -2.02 0.00 0.00 178.31 175.97 2jmp n PHE 82 N -4.06 0.65 -0.06 0.41 7.35 0.00 0.29 117.46 122.05 2jmp n PHE 82 Ca -0.06 0.65 -0.12 0.00 -0.76 0.00 0.00 57.45 57.17 2jmp n PHE 82 Cb 0.24 -1.08 -0.11 0.00 0.35 0.00 0.00 39.48 38.89 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 -0.01 0.73 -2.13 -0.73 -1.00 -3.12 115.58 109.31 2jmp h ASN 83 Ca 0.52 -0.78 0.00 0.00 1.87 0.00 0.00 56.30 57.90 2jmp h ASN 83 Cb 1.43 0.00 0.00 0.00 0.27 0.00 0.00 38.32 40.02 2jmp h ASN 83 CO -0.43 0.86 0.00 -0.11 -0.37 0.00 0.00 177.43 177.38 2jmp n LEU 84 N -4.67 0.24 0.13 0.34 7.94 0.34 -2.20 117.00 119.11 2jmp n LEU 84 Ca -0.08 0.55 0.05 0.00 -1.11 0.00 0.00 56.01 55.42 2jmp n LEU 84 Cb 0.38 -0.50 0.03 0.00 0.53 0.00 0.00 43.42 43.86 2jmp n LEU 84 CO 0.29 -0.28 0.33 0.00 -1.11 0.00 0.00 177.39 176.61 2jmp h ALA 85 N 2.53 0.71 -0.91 1.96 0.00 0.44 -3.26 119.26 120.73 2jmp h ALA 85 Ca 0.00 -0.38 -0.50 0.00 0.00 0.00 0.00 54.91 54.03 2jmp h ALA 85 Cb 0.36 0.02 -0.28 0.00 0.00 0.00 0.00 17.79 17.90 2jmp h ALA 85 CO 0.00 0.47 0.64 0.36 0.00 0.00 0.00 179.25 180.72 2jmp n LYS 86 N -3.06 2.21 0.00 0.00 2.85 -0.94 -4.85 118.16 114.38 2jmp n LYS 86 Ca -0.00 -2.77 0.00 0.00 -1.05 0.00 0.00 58.31 54.48 2jmp n LYS 86 Cb 0.69 -2.09 0.00 0.00 -0.65 0.00 0.00 35.03 32.98 2jmp n LYS 86 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 2jmp n LEU 87 N -0.93 0.00 0.13 -5.58 -0.00 -1.23 -4.52 117.00 104.86 2jmp n LEU 87 Ca 0.55 0.00 0.04 0.00 -0.00 0.00 0.00 56.01 56.60 2jmp n LEU 87 Cb 1.38 0.00 0.20 0.00 -0.00 0.00 0.00 43.42 45.00 2jmp n LEU 87 CO 0.59 -0.26 0.72 1.21 -0.00 0.00 0.00 177.39 179.65 2jmp n GLU 88 N 0.00 0.05 -1.61 1.47 2.13 -1.26 -4.77 120.64 116.65 2jmp n GLU 88 Ca 0.00 0.47 -0.01 0.00 0.66 0.00 0.00 57.16 58.28 2jmp n GLU 88 Cb 0.00 -2.07 0.00 0.00 0.27 0.00 0.00 31.44 29.64 2jmp n GLU 88 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 2jmp n GLU 89 N -1.79 -0.20 -3.63 5.31 4.07 -1.26 -5.11 120.64 118.02 2jmp n GLU 89 Ca -0.00 0.64 -0.09 0.00 -0.06 0.00 0.00 57.16 57.64 2jmp n GLU 89 Cb 0.41 -1.82 -0.07 0.00 -0.06 0.00 0.00 31.44 29.91 2jmp n GLU 89 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 2jmp s ASN 90 N -1.08 -0.40 -0.46 4.31 3.04 -1.26 -5.09 114.94 114.00 2jmp s ASN 90 Ca 0.02 0.72 0.06 0.00 0.04 0.00 0.00 52.86 53.69 2jmp s ASN 90 Cb -0.01 0.71 0.31 0.00 -1.54 0.00 0.00 41.25 40.73 2jmp s ASN 90 CO 0.06 -0.17 1.11 -0.24 -3.04 0.00 0.00 177.10 174.83 2jmp n SER 91 N 1.90 -2.35 -2.65 -4.21 2.88 -1.26 -5.07 113.62 102.87 2jmp n SER 91 Ca -0.12 -3.58 -0.04 0.00 -1.33 0.00 0.00 58.87 53.80 2jmp n SER 91 Cb 0.56 1.89 0.01 0.00 -0.75 0.00 0.00 64.21 65.93 2jmp n SER 91 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2jmp n ARG 92 N 0.49 0.94 -1.67 -1.46 3.00 -1.26 -4.99 116.66 111.71 2jmp n ARG 92 Ca 0.06 -0.69 -0.39 0.00 -0.01 0.00 0.00 57.85 56.82 2jmp n ARG 92 Cb 0.70 -0.04 -0.03 0.00 0.00 0.00 0.00 32.46 33.08 2jmp n ARG 92 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.63 177.79 2jmp s ASP 93 N -1.79 4.93 -0.41 0.55 -4.77 -1.26 -4.82 116.67 109.11 2jmp s ASP 93 Ca 0.13 1.22 0.05 0.00 -3.30 0.00 0.00 52.55 50.65 2jmp s ASP 93 Cb -0.01 -2.51 0.44 0.00 -1.09 0.00 0.00 42.92 39.75 2jmp s ASP 93 CO 0.08 -2.48 1.29 1.07 0.70 0.00 0.00 175.17 175.83 2jmp n THR 94 N 7.79 2.64 1.11 2.11 5.66 -1.26 -4.77 114.28 127.55 2jmp n THR 94 Ca 0.32 -4.36 0.00 0.00 -3.05 0.00 0.00 64.05 56.95 2jmp n THR 94 Cb 0.51 -1.19 0.00 0.00 -1.55 0.00 0.00 70.33 68.10 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 -0.64 0.30 -2.05 1.09 7.99 -1.26 -4.93 117.00 117.51 2jmp n LEU 95 Ca 0.45 -0.15 0.00 0.00 -0.01 0.00 0.00 56.01 56.29 2jmp n LEU 95 Cb 0.79 -0.15 0.00 0.00 -0.11 0.00 0.00 43.42 43.95 2jmp n LEU 95 CO 0.42 0.08 -0.38 0.00 -1.51 0.00 0.00 177.39 175.99 2jmp n TYR 96 N -0.22 -3.95 0.00 -1.77 9.36 -1.26 -5.02 117.16 114.30 2jmp n TYR 96 Ca 0.00 2.37 0.00 0.00 3.32 0.00 0.00 57.90 63.59 2jmp n TYR 96 Cb 0.08 -3.05 0.00 0.00 -0.63 0.00 0.00 39.34 35.73 2jmp n TYR 96 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 2jmp n GLN 97 N 1.88 0.00 -3.15 2.98 10.64 -1.26 -5.10 117.38 123.38 2jmp n GLN 97 Ca 0.00 0.00 0.04 0.00 -1.83 0.00 0.00 57.00 55.21 2jmp n GLN 97 Cb 0.00 0.00 -0.01 0.00 -0.86 0.00 0.00 30.24 29.37 2jmp n GLN 97 CO 0.00 0.00 0.00 -0.80 -1.83 0.00 0.00 177.06 174.43 2jmp s ASN 98 N -0.85 -1.42 0.00 2.61 -0.87 -1.26 -5.00 114.94 108.14 2jmp s ASN 98 Ca 0.00 0.62 0.00 0.00 -1.57 0.00 0.00 52.86 51.91 2jmp s ASN 98 Cb 0.00 2.08 0.00 0.00 -0.02 0.00 0.00 41.25 43.31 2jmp s ASN 98 CO 0.00 -0.26 0.00 -0.24 -2.57 0.00 0.00 177.10 174.03 2jmp n SER 99 N 5.42 0.00 0.00 -1.22 2.88 -1.26 -5.18 113.62 114.26 2jmp n SER 99 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2jmp n SER 99 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2jmp n SER 99 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42