#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gmp s VAL 2 N 0.00 5.17 0.28 2.53 1.01 -1.26 -4.61 120.40 123.52 1gmp s VAL 2 Ca 0.00 0.72 0.03 0.00 0.00 0.00 0.00 61.98 62.73 1gmp s VAL 2 Cb 0.00 -3.67 0.05 0.00 0.00 0.00 0.00 36.38 32.76 1gmp s VAL 2 CO 0.00 0.51 1.70 0.28 0.00 0.00 0.00 175.10 177.59 1gmp h SER 3 N 5.45 0.42 0.00 3.32 0.02 -0.18 -3.49 113.55 119.08 1gmp h SER 3 Ca -0.48 -0.16 0.00 0.00 -0.84 0.00 0.00 61.79 60.31 1gmp h SER 3 Cb 1.20 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.63 1gmp h SER 3 CO 0.66 0.72 0.00 0.61 -1.14 0.00 0.00 176.83 177.68 1gmp n GLY 4 N -0.28 -1.24 3.57 -3.77 0.00 -1.26 -5.05 105.19 97.16 1gmp n GLY 4 Ca -0.01 -1.16 -0.34 0.00 0.00 0.00 0.00 46.02 44.51 1gmp n GLY 4 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1gmp s THR 5 N -3.00 3.66 0.02 2.61 2.01 -1.26 -0.62 115.64 119.05 1gmp s THR 5 Ca 0.00 -0.49 0.05 0.00 0.31 0.00 0.00 61.69 61.56 1gmp s THR 5 Cb 0.00 -2.50 -0.02 0.00 0.01 0.00 0.00 72.50 70.00 1gmp s THR 5 CO 0.00 0.59 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.67 1gmp s VAL 6 N -0.74 1.28 0.41 3.82 1.01 0.53 -4.90 120.40 121.81 1gmp s VAL 6 Ca 0.11 -0.91 -0.25 0.00 0.00 0.00 0.00 61.98 60.94 1gmp s VAL 6 Cb -0.11 -1.11 -0.08 0.00 0.00 0.00 0.00 36.38 35.08 1gmp s VAL 6 CO 0.01 0.18 1.18 0.00 0.00 0.00 0.00 175.10 176.48 1gmp h LEU 8 N 2.50 0.62 -2.21 0.00 5.85 -0.37 -1.06 115.31 120.65 1gmp h LEU 8 Ca -0.49 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.22 1gmp h LEU 8 Cb 1.24 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 42.13 1gmp h LEU 8 CO 0.62 0.43 -0.01 0.77 -0.34 0.00 0.00 178.44 179.91 1gmp h SER 9 N 0.72 0.00 0.32 1.25 4.64 -1.68 -2.09 113.55 116.70 1gmp h SER 9 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 1gmp h SER 9 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1gmp h SER 9 CO -0.07 0.01 -0.28 0.00 -0.87 0.00 0.00 176.83 175.62 1gmp n ALA 10 N -2.10 3.12 -2.32 5.18 0.00 -0.41 -4.90 120.51 119.09 1gmp n ALA 10 Ca -0.01 -0.37 -0.21 0.00 0.00 0.00 0.00 53.44 52.85 1gmp n ALA 10 Cb 0.19 -1.16 0.01 0.00 0.00 0.00 0.00 19.45 18.49 1gmp n ALA 10 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1gmp s LEU 11 N -2.60 3.71 0.51 0.00 1.43 -0.79 -5.01 118.68 115.93 1gmp s LEU 11 Ca 0.22 0.06 -0.22 0.00 -1.03 0.00 0.00 54.13 53.16 1gmp s LEU 11 Cb 0.19 -2.97 -0.07 0.00 0.03 0.00 0.00 46.19 43.37 1gmp s LEU 11 CO 0.55 -0.67 1.16 -2.65 0.23 0.00 0.00 176.35 174.97 1gmp n PRO 12 N -1.95 1.46 0.08 1.29 -0.02 -1.26 -4.86 135.00 129.74 1gmp n PRO 12 Ca 0.02 0.53 0.16 0.00 -2.02 0.00 0.00 63.50 62.20 1gmp n PRO 12 Cb 0.58 -2.31 0.68 0.00 -0.02 0.00 0.00 33.50 32.43 1gmp n PRO 12 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1gmp h PRO 13 N 1.35 0.00 0.00 0.52 0.13 -1.94 0.40 132.00 132.47 1gmp h PRO 13 Ca -0.48 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1gmp h PRO 13 Cb 1.33 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.45 1gmp h PRO 13 CO 0.56 0.00 -0.06 0.93 -0.23 0.00 0.00 178.00 179.20 1gmp h GLU 14 N 0.00 0.00 -0.53 0.86 3.07 -1.89 -1.31 114.58 114.78 1gmp h GLU 14 Ca 0.17 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.95 1gmp h GLU 14 Cb 0.69 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.58 1gmp h GLU 14 CO -0.00 0.06 -0.01 0.00 -1.40 0.00 0.00 179.01 177.66 1gmp h ALA 15 N 1.94 0.98 -0.35 3.43 0.00 -1.25 -1.54 119.26 122.47 1gmp h ALA 15 Ca -0.00 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 1gmp h ALA 15 Cb 0.17 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1gmp h ALA 15 CO 0.01 0.62 0.18 1.15 0.00 0.00 0.00 179.25 181.21 1gmp h THR 16 N 0.84 1.15 -0.52 0.00 2.02 -1.34 -1.25 112.91 113.82 1gmp h THR 16 Ca 0.16 -0.43 0.05 0.00 0.77 0.00 0.00 66.41 66.96 1gmp h THR 16 Cb 0.51 0.80 -0.05 0.00 -1.74 0.00 0.00 68.15 67.67 1gmp h THR 16 CO 0.03 0.16 0.25 0.44 0.37 0.00 0.00 175.52 176.77 1gmp h ASP 17 N 0.43 0.35 -0.15 4.18 3.32 -1.13 -0.12 116.42 123.30 1gmp h ASP 17 Ca 0.12 0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.20 1gmp h ASP 17 Cb 0.10 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1gmp h ASP 17 CO -0.02 0.24 0.09 0.74 -1.72 0.00 0.00 179.24 178.57 1gmp h THR 18 N 0.49 1.08 -0.87 0.35 2.02 -1.07 -1.61 112.91 113.31 1gmp h THR 18 Ca 0.23 -0.20 0.02 0.00 0.77 0.00 0.00 66.41 67.22 1gmp h THR 18 Cb 0.16 0.95 -0.04 0.00 -1.74 0.00 0.00 68.15 67.47 1gmp h THR 18 CO -0.17 0.07 0.57 -0.07 0.37 0.00 0.00 175.52 176.29 1gmp h LEU 19 N 0.16 0.97 -0.81 2.58 3.38 -0.85 -0.39 115.31 120.35 1gmp h LEU 19 Ca 0.05 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1gmp h LEU 19 Cb 0.04 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 1gmp h LEU 19 CO -0.01 0.69 0.31 0.78 0.09 0.00 0.00 178.44 180.30 1gmp h ASN 20 N 1.14 1.09 -0.55 -0.43 2.35 -0.57 -1.46 115.58 117.16 1gmp h ASN 20 Ca 0.33 -0.17 -0.09 0.00 -0.55 0.00 0.00 56.30 55.81 1gmp h ASN 20 Cb -0.09 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 37.98 1gmp h ASN 20 CO -0.08 0.97 -0.00 -0.07 -1.65 0.00 0.00 177.43 176.60 1gmp h LEU 21 N 1.15 0.95 -0.84 1.61 3.38 -0.65 -2.61 115.31 118.30 1gmp h LEU 21 Ca 0.26 -0.31 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1gmp h LEU 21 Cb 0.23 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 1gmp h LEU 21 CO -0.02 1.02 0.20 0.40 0.09 0.00 0.00 178.44 180.13 1gmp h ILE 22 N 0.85 1.25 -0.23 1.22 2.04 -0.69 0.15 117.51 122.10 1gmp h ILE 22 Ca 0.15 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 65.10 1gmp h ILE 22 Cb 0.54 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1gmp h ILE 22 CO 0.03 0.35 0.02 0.00 0.00 0.00 0.00 178.15 178.55 1gmp h ALA 23 N 1.19 1.62 -0.52 1.87 0.00 -0.92 -2.47 119.26 120.04 1gmp h ALA 23 Ca 0.22 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1gmp h ALA 23 Cb 0.31 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1gmp h ALA 23 CO -0.00 0.29 0.00 -1.13 0.00 0.00 0.00 179.25 178.40 1gmp n SER 24 N -4.37 3.62 -3.37 0.00 3.41 -1.00 -4.94 113.62 106.96 1gmp n SER 24 Ca 0.00 -1.99 -0.20 0.00 -0.26 0.00 0.00 58.87 56.42 1gmp n SER 24 Cb 0.18 -0.34 0.08 0.00 -0.26 0.00 0.00 64.21 63.87 1gmp n SER 24 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1gmp n ASP 25 N 1.54 -4.59 0.00 4.04 8.00 -0.50 -4.74 116.55 120.31 1gmp n ASP 25 Ca 0.21 -0.54 0.00 0.00 0.71 0.00 0.00 54.79 55.18 1gmp n ASP 25 Cb 0.61 -4.80 0.00 0.00 -0.02 0.00 0.00 41.12 36.91 1gmp n ASP 25 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1gmp n GLY 26 N -1.62 -1.69 3.78 0.44 0.00 0.42 -4.85 105.19 101.66 1gmp n GLY 26 Ca -0.10 -1.59 -0.33 0.00 0.00 0.00 0.00 46.02 44.01 1gmp n GLY 26 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gmp s PRO 27 N 0.00 2.76 0.07 1.61 0.04 -1.26 -4.91 135.00 133.32 1gmp s PRO 27 Ca 0.00 1.31 0.04 0.00 0.04 0.00 0.00 61.00 62.39 1gmp s PRO 27 Cb 0.00 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 1gmp s PRO 27 CO 0.00 -1.27 0.02 -0.06 0.04 0.00 0.00 177.00 175.74 1gmp s PHE 28 N -2.48 3.06 0.32 0.56 0.08 -1.26 -4.97 117.98 113.29 1gmp s PHE 28 Ca 0.65 0.02 0.16 0.00 0.12 0.00 0.00 56.93 57.88 1gmp s PHE 28 Cb -0.19 -1.58 0.78 0.00 -0.57 0.00 0.00 43.02 41.45 1gmp s PHE 28 CO 0.44 0.49 1.82 -1.00 -0.10 0.00 0.00 175.22 176.87 1gmp h PRO 29 N 3.52 0.00 -6.70 0.24 0.13 -1.99 -3.44 132.00 123.76 1gmp h PRO 29 Ca -0.48 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 63.97 1gmp h PRO 29 Cb 1.17 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.06 1gmp h PRO 29 CO 0.61 0.36 -0.84 0.71 -0.23 0.00 0.00 178.00 178.62 1gmp s TYR 30 N -3.98 2.44 0.31 1.56 2.02 -1.26 -5.02 117.35 113.42 1gmp s TYR 30 Ca -0.02 -0.33 0.23 0.00 -0.37 0.00 0.00 57.07 56.58 1gmp s TYR 30 Cb 0.13 -1.39 1.11 0.00 -0.40 0.00 0.00 41.96 41.41 1gmp s TYR 30 CO 0.70 0.24 1.93 0.66 -1.57 0.00 0.00 175.55 177.51 1gmp h SER 31 N 4.44 0.00 0.90 2.29 4.64 -2.05 -2.26 113.55 121.51 1gmp h SER 31 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1gmp h SER 31 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1gmp h SER 31 CO 0.45 0.22 0.00 0.00 -0.87 0.00 0.00 176.83 176.62 1gmp n GLN 32 N -3.65 0.12 -1.91 4.77 3.00 -1.26 -4.80 117.38 113.66 1gmp n GLN 32 Ca -0.01 0.24 -0.42 0.00 -0.01 0.00 0.00 57.00 56.80 1gmp n GLN 32 Cb 0.34 -1.68 -0.03 0.00 0.00 0.00 0.00 30.24 28.87 1gmp n GLN 32 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1gmp s ASP 33 N -3.73 6.60 0.00 1.08 1.01 -0.85 -2.15 116.67 118.63 1gmp s ASP 33 Ca 0.08 2.43 0.00 0.00 0.71 0.00 0.00 52.55 55.78 1gmp s ASP 33 Cb 0.12 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.50 1gmp s ASP 33 CO 0.43 -0.93 0.00 0.61 0.21 0.00 0.00 175.17 175.49 1gmp n GLY 34 N 4.14 0.54 3.79 0.21 0.00 0.14 -5.01 105.19 109.01 1gmp n GLY 34 Ca 0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 1gmp n GLY 34 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1gmp s VAL 35 N -2.06 3.16 0.27 1.61 -7.23 -0.91 -4.66 120.40 110.57 1gmp s VAL 35 Ca 0.00 0.38 -0.29 0.00 -1.81 0.00 0.00 61.98 60.25 1gmp s VAL 35 Cb 0.00 -3.08 -0.10 0.00 0.56 0.00 0.00 36.38 33.77 1gmp s VAL 35 CO 0.00 -0.49 1.25 -0.69 -0.31 0.00 0.00 175.10 174.86 1gmp s VAL 36 N -3.10 3.09 -0.27 1.32 1.01 -1.26 -0.99 120.40 120.20 1gmp s VAL 36 Ca 0.61 1.03 -0.12 0.00 0.00 0.00 0.00 61.98 63.49 1gmp s VAL 36 Cb -0.15 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 1gmp s VAL 36 CO 0.55 0.21 0.23 0.12 0.00 0.00 0.00 175.10 176.22 1gmp s PHE 37 N -0.71 3.24 -0.11 5.22 5.36 -0.33 -4.72 117.98 125.93 1gmp s PHE 37 Ca 0.50 0.22 0.29 0.00 -0.96 0.00 0.00 56.93 56.98 1gmp s PHE 37 Cb -0.36 -2.41 0.96 0.00 -0.34 0.00 0.00 43.02 40.86 1gmp s PHE 37 CO 0.45 -0.14 1.83 1.96 -1.46 0.00 0.00 175.22 177.86 1gmp h GLN 38 N 8.18 0.00 -5.76 10.12 4.20 -1.95 -3.40 115.11 126.50 1gmp h GLN 38 Ca -0.35 0.00 -0.43 0.00 0.06 0.00 0.00 58.65 57.94 1gmp h GLN 38 Cb 1.18 0.00 0.04 0.00 0.30 0.00 0.00 27.48 29.00 1gmp h GLN 38 CO 0.59 0.01 -0.69 -1.71 -0.67 0.00 0.00 178.83 176.36 1gmp n ASN 39 N -3.10 -5.58 -0.10 1.46 5.15 -1.26 -4.87 115.26 106.97 1gmp n ASN 39 Ca 0.02 -0.57 0.05 0.00 -0.60 0.00 0.00 54.58 53.47 1gmp n ASN 39 Cb 0.40 -4.44 0.38 0.00 -0.53 0.00 0.00 39.78 35.59 1gmp n ASN 39 CO 0.00 0.00 0.00 -0.09 1.40 0.00 0.00 177.26 178.57 1gmp h ARG 40 N -2.13 0.65 -0.01 1.20 2.43 -1.99 -1.68 114.38 112.86 1gmp h ARG 40 Ca -0.56 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.57 1gmp h ARG 40 Cb 1.37 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.77 1gmp h ARG 40 CO 0.60 0.43 -0.06 0.39 -1.51 0.00 0.00 179.97 179.82 1gmp n GLU 41 N -4.47 1.06 -2.47 0.20 4.71 -1.26 -4.94 120.64 113.48 1gmp n GLU 41 Ca 0.07 -0.42 -0.20 0.00 -0.01 0.00 0.00 57.16 56.60 1gmp n GLU 41 Cb 0.13 -1.49 -0.00 0.00 -1.01 0.00 0.00 31.44 29.07 1gmp n GLU 41 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 1gmp n SER 42 N -0.61 -5.71 -0.04 1.62 2.88 -0.63 -4.91 113.62 106.22 1gmp n SER 42 Ca 0.18 -0.06 -0.16 0.00 -1.33 0.00 0.00 58.87 57.50 1gmp n SER 42 Cb 0.27 -4.70 -0.07 0.00 -0.75 0.00 0.00 64.21 58.95 1gmp n SER 42 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1gmp h VAL 43 N -0.21 1.30 -2.54 2.46 2.07 -1.92 -3.40 116.25 114.01 1gmp h VAL 43 Ca -0.48 -1.86 -0.45 0.00 0.82 0.00 0.00 66.70 64.74 1gmp h VAL 43 Cb 1.35 1.95 0.03 0.00 -1.52 0.00 0.00 31.29 33.10 1gmp h VAL 43 CO 0.55 0.58 -0.10 -0.76 0.02 0.00 0.00 177.57 177.87 1gmp s LEU 44 N -8.55 3.53 0.39 2.57 1.43 -1.26 0.30 118.68 117.09 1gmp s LEU 44 Ca -0.11 0.11 -0.26 0.00 -1.03 0.00 0.00 54.13 52.84 1gmp s LEU 44 Cb 0.08 -3.00 -0.11 0.00 0.03 0.00 0.00 46.19 43.19 1gmp s LEU 44 CO 0.88 -0.85 1.20 -2.65 0.23 0.00 0.00 176.35 175.16 1gmp n PRO 45 N -2.14 1.81 -1.89 1.29 -0.02 -1.26 -4.87 135.00 127.92 1gmp n PRO 45 Ca 0.04 0.64 -0.42 0.00 -2.02 0.00 0.00 63.50 61.74 1gmp n PRO 45 Cb 0.58 -2.25 -0.03 0.00 -0.02 0.00 0.00 33.50 31.79 1gmp n PRO 45 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1gmp s THR 46 N -1.17 2.74 0.22 3.45 2.01 -1.26 -4.99 115.64 116.64 1gmp s THR 46 Ca 0.60 0.38 -0.06 0.00 0.31 0.00 0.00 61.69 62.91 1gmp s THR 46 Cb -0.55 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 68.69 1gmp s THR 46 CO 0.59 0.01 0.29 -1.10 -0.69 0.00 0.00 174.62 173.73 1gmp s GLN 47 N 1.99 1.37 0.85 4.92 -1.52 -1.26 -5.15 119.66 120.86 1gmp s GLN 47 Ca 0.73 -1.46 -0.10 0.00 -1.95 0.00 0.00 55.36 52.58 1gmp s GLN 47 Cb -0.43 0.36 0.10 0.00 -0.22 0.00 0.00 33.01 32.83 1gmp s GLN 47 CO 0.32 -0.51 1.12 -1.54 -0.25 0.00 0.00 175.29 174.43 1gmp s SER 48 N -3.10 3.66 0.16 5.90 1.04 -1.26 -4.92 113.70 115.19 1gmp s SER 48 Ca 0.31 2.03 -0.32 0.00 0.48 0.00 0.00 55.95 58.45 1gmp s SER 48 Cb 0.03 -2.55 -0.10 0.00 0.10 0.00 0.00 66.02 63.50 1gmp s SER 48 CO 0.11 -2.61 1.61 -0.47 0.98 0.00 0.00 173.24 172.86 1gmp s TYR 49 N -2.76 2.95 0.00 5.02 5.04 -1.26 -1.93 117.35 124.41 1gmp s TYR 49 Ca 0.64 0.53 0.00 0.00 -2.44 0.00 0.00 57.07 55.81 1gmp s TYR 49 Cb -0.20 -3.97 0.00 0.00 0.35 0.00 0.00 41.96 38.13 1gmp s TYR 49 CO 0.57 -3.65 0.00 0.41 -1.34 0.00 0.00 175.55 171.54 1gmp n GLY 50 N 3.83 0.63 0.23 8.97 0.00 -1.26 -4.92 105.19 112.66 1gmp n GLY 50 Ca 0.14 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.11 1gmp n GLY 50 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1gmp h TYR 51 N 0.00 0.60 -3.17 1.61 5.03 -1.72 -3.44 116.97 115.89 1gmp h TYR 51 Ca 0.00 -0.15 -0.67 0.00 2.58 0.00 0.00 58.73 60.49 1gmp h TYR 51 Cb 0.00 -0.14 -0.12 0.00 1.55 0.00 0.00 36.73 38.02 1gmp h TYR 51 CO 0.00 0.79 -0.59 0.71 -1.32 0.00 0.00 178.16 177.75 1gmp s TYR 52 N -4.35 3.25 0.07 -3.82 2.02 -1.26 -2.38 117.35 110.89 1gmp s TYR 52 Ca -0.07 0.23 0.04 0.00 -0.37 0.00 0.00 57.07 56.89 1gmp s TYR 52 Cb 0.13 -1.78 -0.03 0.00 -0.40 0.00 0.00 41.96 39.88 1gmp s TYR 52 CO 0.81 0.53 -0.11 -1.01 -1.57 0.00 0.00 175.55 174.20 1gmp s HIS 53 N -1.03 0.99 0.07 2.71 3.76 -0.58 -1.18 115.29 120.03 1gmp s HIS 53 Ca 0.17 -0.53 0.07 0.00 -0.15 0.00 0.00 55.06 54.62 1gmp s HIS 53 Cb -0.12 -0.56 -0.04 0.00 1.11 0.00 0.00 32.58 32.98 1gmp s HIS 53 CO 0.07 -0.01 -0.12 -1.83 -0.85 0.00 0.00 174.74 172.01 1gmp s GLU 54 N -1.97 2.16 0.00 1.40 -1.05 -0.16 -0.46 118.70 118.62 1gmp s GLU 54 Ca -0.03 -0.97 0.00 0.00 -0.15 0.00 0.00 54.97 53.82 1gmp s GLU 54 Cb -0.08 -2.30 -0.00 0.00 -0.44 0.00 0.00 34.13 31.31 1gmp s GLU 54 CO 0.01 0.53 -0.01 0.71 0.95 0.00 0.00 175.26 177.45 1gmp s TYR 55 N -1.11 0.09 0.33 4.83 1.51 0.06 0.27 117.35 123.34 1gmp s TYR 55 Ca 0.19 -0.09 -0.27 0.00 -1.01 0.00 0.00 57.07 55.89 1gmp s TYR 55 Cb -0.11 -0.06 -0.09 0.00 -0.11 0.00 0.00 41.96 41.59 1gmp s TYR 55 CO 0.11 -0.03 1.08 0.99 -1.11 0.00 0.00 175.55 176.59 1gmp s THR 56 N -0.24 3.56 -0.33 -0.71 2.01 -1.26 -0.58 115.64 118.09 1gmp s THR 56 Ca -0.02 1.40 -0.06 0.00 0.31 0.00 0.00 61.69 63.32 1gmp s THR 56 Cb -0.02 -3.82 0.03 0.00 0.01 0.00 0.00 72.50 68.70 1gmp s THR 56 CO -0.00 0.21 0.09 -0.69 -0.69 0.00 0.00 174.62 173.53 1gmp s VAL 57 N -1.37 3.73 0.30 3.82 1.01 -0.78 -4.77 120.40 122.34 1gmp s VAL 57 Ca 0.50 -1.08 -0.30 0.00 0.00 0.00 0.00 61.98 61.11 1gmp s VAL 57 Cb -0.28 -3.08 -0.12 0.00 0.00 0.00 0.00 36.38 32.91 1gmp s VAL 57 CO 0.36 -0.12 1.58 -0.38 0.00 0.00 0.00 175.10 176.53 1gmp n ILE 58 N 4.80 1.15 -3.51 2.22 5.41 -1.26 -4.36 119.36 123.81 1gmp n ILE 58 Ca -0.13 -0.29 -0.40 0.00 1.00 0.00 0.00 62.75 62.94 1gmp n ILE 58 Cb 0.45 -1.95 -0.10 0.00 -0.71 0.00 0.00 39.64 37.33 1gmp n ILE 58 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 1gmp s THR 59 N -0.15 5.26 0.24 1.39 2.01 -1.26 -4.81 115.64 118.32 1gmp s THR 59 Ca 0.63 0.06 -0.31 0.00 0.31 0.00 0.00 61.69 62.38 1gmp s THR 59 Cb -0.50 -3.68 -0.13 0.00 0.01 0.00 0.00 72.50 68.20 1gmp s THR 59 CO 0.51 0.08 1.38 -2.65 -0.69 0.00 0.00 174.62 173.24 1gmp n PRO 60 N 5.18 1.99 0.00 4.92 -0.02 -1.26 -1.99 135.00 143.82 1gmp n PRO 60 Ca -0.12 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1gmp n PRO 60 Cb 0.50 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1gmp n PRO 60 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gmp n GLY 61 N 2.02 2.99 3.77 -1.23 0.00 -1.26 -5.02 105.19 106.46 1gmp n GLY 61 Ca 0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1gmp n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gmp s ALA 62 N -1.60 3.42 -0.48 4.61 0.00 -0.84 -4.94 121.76 121.92 1gmp s ALA 62 Ca 0.00 1.17 0.24 0.00 0.00 0.00 0.00 51.96 53.37 1gmp s ALA 62 Cb 0.00 -3.45 0.33 0.00 0.00 0.00 0.00 23.12 20.00 1gmp s ALA 62 CO 0.00 -0.58 1.41 0.00 0.00 0.00 0.00 175.76 176.59 1gmp h ARG 63 N 3.27 0.00 0.00 0.00 3.08 -1.95 -3.47 114.38 115.31 1gmp h ARG 63 Ca -0.49 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.05 1gmp h ARG 63 Cb 1.23 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.19 1gmp h ARG 63 CO 0.65 0.00 -0.35 0.25 -1.07 0.00 0.00 179.97 179.45 1gmp n THR 64 N -2.59 0.00 0.46 2.04 -2.24 -1.26 -5.01 114.28 105.67 1gmp n THR 64 Ca 0.03 -1.88 0.09 0.00 -2.27 0.00 0.00 64.05 60.03 1gmp n THR 64 Cb 0.50 0.29 0.40 0.00 -2.10 0.00 0.00 70.33 69.41 1gmp n THR 64 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1gmp n ARG 65 N -1.11 0.09 0.00 -0.78 1.74 -1.26 -4.84 116.66 110.50 1gmp n ARG 65 Ca -0.14 0.33 0.00 0.00 -0.77 0.00 0.00 57.85 57.27 1gmp n ARG 65 Cb 0.51 -1.67 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 1gmp n ARG 65 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1gmp n GLY 66 N 0.03 0.37 0.26 -0.13 0.00 -1.26 -4.34 105.19 100.13 1gmp n GLY 66 Ca 0.03 -0.88 0.03 0.00 0.00 0.00 0.00 46.02 45.19 1gmp n GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gmp n THR 67 N 0.00 0.65 -3.71 2.61 -2.24 -1.26 -4.95 114.28 105.37 1gmp n THR 67 Ca 0.00 -0.82 -0.37 0.00 -2.27 0.00 0.00 64.05 60.59 1gmp n THR 67 Cb 0.00 0.71 -0.06 0.00 -2.10 0.00 0.00 70.33 68.88 1gmp n THR 67 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1gmp s ARG 68 N -0.80 3.77 0.11 -0.78 0.52 -1.26 -0.75 118.95 119.76 1gmp s ARG 68 Ca 0.09 0.04 -0.16 0.00 -0.52 0.00 0.00 55.73 55.18 1gmp s ARG 68 Cb 0.05 -3.26 0.03 0.00 0.52 0.00 0.00 34.95 32.30 1gmp s ARG 68 CO 0.07 0.63 0.38 1.03 0.02 0.00 0.00 175.30 177.43 1gmp s ARG 69 N -0.67 1.02 -0.11 3.54 1.81 -0.08 -1.87 118.95 122.59 1gmp s ARG 69 Ca 0.17 -0.67 0.02 0.00 -1.72 0.00 0.00 55.73 53.53 1gmp s ARG 69 Cb -0.13 0.45 -0.01 0.00 -0.45 0.00 0.00 34.95 34.80 1gmp s ARG 69 CO 0.06 -0.38 -0.18 0.42 -0.68 0.00 0.00 175.30 174.54 1gmp s ILE 70 N -3.56 2.62 -0.18 1.52 1.01 0.25 -1.61 121.20 121.25 1gmp s ILE 70 Ca 0.02 -0.82 -0.03 0.00 0.00 0.00 0.00 60.65 59.81 1gmp s ILE 70 Cb 0.02 -2.06 -0.02 0.00 0.01 0.00 0.00 42.46 40.41 1gmp s ILE 70 CO -0.10 0.54 -0.04 -0.63 0.00 0.00 0.00 174.94 174.71 1gmp s ILE 71 N 0.24 3.59 0.09 2.92 -1.09 0.92 -0.76 121.20 127.11 1gmp s ILE 71 Ca -0.12 -0.44 0.00 0.00 -2.23 0.00 0.00 60.65 57.86 1gmp s ILE 71 Cb -0.16 -2.60 -0.04 0.00 -1.58 0.00 0.00 42.46 38.08 1gmp s ILE 71 CO 0.06 0.46 0.24 0.00 -1.23 0.00 0.00 174.94 174.47 1gmp s GLY 73 N -2.68 2.13 0.53 0.00 0.00 0.62 -1.53 107.32 106.39 1gmp s GLY 73 Ca 0.35 -1.94 0.32 0.00 0.00 0.00 0.00 44.72 43.45 1gmp s GLY 73 CO 0.28 -1.79 1.96 0.83 0.00 0.00 0.00 173.10 174.38 1gmp h GLU 74 N 1.37 0.00 -7.21 2.90 5.08 -1.76 -3.42 114.58 111.53 1gmp h GLU 74 Ca -0.43 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.42 1gmp h GLU 74 Cb 1.26 0.00 0.12 0.00 0.50 0.00 0.00 28.75 30.63 1gmp h GLU 74 CO 0.64 0.04 0.36 0.00 -1.00 0.00 0.00 179.01 179.06 1gmp s ALA 75 N -3.69 2.33 0.15 3.43 0.00 -1.26 -4.94 121.76 117.77 1gmp s ALA 75 Ca 0.01 0.57 -0.32 0.00 0.00 0.00 0.00 51.96 52.23 1gmp s ALA 75 Cb 0.09 -3.35 -0.11 0.00 0.00 0.00 0.00 23.12 19.75 1gmp s ALA 75 CO 0.56 -1.52 1.79 2.41 0.00 0.00 0.00 175.76 179.00 1gmp n THR 76 N -2.70 0.24 -1.23 0.00 -1.04 -1.26 -1.69 114.28 106.61 1gmp n THR 76 Ca 0.11 -0.04 -0.08 0.00 -2.04 0.00 0.00 64.05 62.00 1gmp n THR 76 Cb 0.52 -2.05 -0.03 0.00 -1.82 0.00 0.00 70.33 66.95 1gmp n THR 76 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1gmp n GLN 77 N 5.06 -1.41 -2.89 -2.82 1.13 -1.26 -4.94 117.38 110.25 1gmp n GLN 77 Ca 0.17 0.72 -0.43 0.00 -1.94 0.00 0.00 57.00 55.53 1gmp n GLN 77 Cb 0.36 -4.93 -0.04 0.00 0.11 0.00 0.00 30.24 25.73 1gmp n GLN 77 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1gmp s GLU 78 N -2.45 3.18 -0.01 -1.09 2.12 -0.68 -4.87 118.70 114.89 1gmp s GLU 78 Ca 0.00 -0.68 -0.00 0.00 0.36 0.00 0.00 54.97 54.65 1gmp s GLU 78 Cb 0.00 -4.16 0.02 0.00 0.26 0.00 0.00 34.13 30.24 1gmp s GLU 78 CO 0.00 -1.65 0.02 -0.51 -0.54 0.00 0.00 175.26 172.58 1gmp s ASP 79 N 3.32 0.04 0.04 -1.70 1.01 -1.26 -0.28 116.67 117.84 1gmp s ASP 79 Ca 0.23 0.03 0.09 0.00 0.71 0.00 0.00 52.55 53.61 1gmp s ASP 79 Cb -0.16 -0.03 -0.03 0.00 1.01 0.00 0.00 42.92 43.71 1gmp s ASP 79 CO 0.13 -0.07 -0.25 -0.31 0.21 0.00 0.00 175.17 174.87 1gmp s TYR 80 N 0.61 2.35 -0.07 4.23 2.02 0.79 -0.86 117.35 126.42 1gmp s TYR 80 Ca -0.05 -0.40 0.00 0.00 -0.37 0.00 0.00 57.07 56.25 1gmp s TYR 80 Cb -0.07 -1.40 -0.03 0.00 -0.40 0.00 0.00 41.96 40.05 1gmp s TYR 80 CO -0.02 0.14 -0.05 -0.47 -1.57 0.00 0.00 175.55 173.58 1gmp s TYR 81 N -0.81 3.00 -0.06 2.71 5.04 0.65 -0.05 117.35 127.83 1gmp s TYR 81 Ca 0.12 0.07 0.02 0.00 -2.44 0.00 0.00 57.07 54.84 1gmp s TYR 81 Cb -0.10 -1.73 0.01 0.00 0.35 0.00 0.00 41.96 40.49 1gmp s TYR 81 CO 0.02 0.37 -0.10 -0.08 -1.34 0.00 0.00 175.55 174.42 1gmp s THR 82 N -0.83 0.96 -1.77 4.34 -1.32 -0.64 -1.16 115.64 115.23 1gmp s THR 82 Ca 0.13 -0.38 0.17 0.00 -1.21 0.00 0.00 61.69 60.39 1gmp s THR 82 Cb -0.11 -0.90 0.05 0.00 -1.51 0.00 0.00 72.50 70.04 1gmp s THR 82 CO 0.02 0.32 0.94 0.61 -2.21 0.00 0.00 174.62 174.29 1gmp n GLY 83 N 3.84 0.10 1.92 6.08 0.00 -1.26 -0.90 105.19 114.97 1gmp n GLY 83 Ca -0.23 -0.48 -0.12 0.00 0.00 0.00 0.00 46.02 45.18 1gmp n GLY 83 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gmp n ASP 84 N 0.33 3.42 -3.67 1.61 5.68 -1.22 -4.42 116.55 118.28 1gmp n ASP 84 Ca 0.08 -3.30 -0.24 0.00 -0.50 0.00 0.00 54.79 50.83 1gmp n ASP 84 Cb 0.38 -0.40 0.03 0.00 -1.14 0.00 0.00 41.12 39.99 1gmp n ASP 84 CO 0.00 0.00 0.00 1.57 -1.33 0.00 0.00 177.20 177.44 1gmp n HIS 85 N -0.68 -1.94 -1.03 2.11 -0.00 0.08 -3.19 115.22 110.56 1gmp n HIS 85 Ca 0.29 0.72 -0.01 0.00 -0.00 0.00 0.00 57.72 58.72 1gmp n HIS 85 Cb 0.90 -4.01 -0.00 0.00 -0.00 0.00 0.00 29.99 26.87 1gmp n HIS 85 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1gmp n TYR 86 N -4.14 0.00 0.01 1.57 4.01 -1.26 -4.93 117.16 112.42 1gmp n TYR 86 Ca -0.22 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.35 1gmp n TYR 86 Cb 0.65 -0.51 -0.11 0.00 -0.31 0.00 0.00 39.34 39.06 1gmp n TYR 86 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1gmp h ALA 87 N 0.00 0.08 -2.84 -0.72 0.00 -1.96 -3.47 119.26 110.35 1gmp h ALA 87 Ca -0.02 -0.59 -0.25 0.00 0.00 0.00 0.00 54.91 54.05 1gmp h ALA 87 Cb 0.16 0.04 -0.19 0.00 0.00 0.00 0.00 17.79 17.80 1gmp h ALA 87 CO 0.03 0.41 -0.72 0.95 0.00 0.00 0.00 179.25 179.92 1gmp s THR 88 N -3.22 0.57 0.03 0.00 -4.23 -1.26 -5.05 115.64 102.48 1gmp s THR 88 Ca -0.13 -1.37 0.01 0.00 -1.18 0.00 0.00 61.69 59.02 1gmp s THR 88 Cb 0.04 -0.97 -0.02 0.00 1.34 0.00 0.00 72.50 72.89 1gmp s THR 88 CO 0.84 -0.56 -0.05 -0.36 -0.54 0.00 0.00 174.62 173.95 1gmp s PHE 89 N -2.17 0.42 0.03 3.99 0.40 -1.26 -4.39 117.98 115.01 1gmp s PHE 89 Ca -0.03 -0.52 0.05 0.00 -0.60 0.00 0.00 56.93 55.83 1gmp s PHE 89 Cb -0.05 -0.27 -0.02 0.00 0.51 0.00 0.00 43.02 43.19 1gmp s PHE 89 CO -0.02 -0.15 -0.15 -1.12 0.70 0.00 0.00 175.22 174.49 1gmp s SER 90 N -1.51 1.77 0.17 1.36 0.01 -0.30 0.64 113.70 115.83 1gmp s SER 90 Ca -0.14 -0.44 -0.30 0.00 1.31 0.00 0.00 55.95 56.38 1gmp s SER 90 Cb -0.10 -0.13 -0.07 0.00 0.21 0.00 0.00 66.02 65.93 1gmp s SER 90 CO -0.00 0.07 0.94 -0.76 0.41 0.00 0.00 173.24 173.89 1gmp s LEU 91 N -1.06 4.57 -0.09 2.44 1.43 0.20 -0.25 118.68 125.92 1gmp s LEU 91 Ca 0.03 1.85 -0.18 0.00 -1.03 0.00 0.00 54.13 54.80 1gmp s LEU 91 Cb -0.08 -3.58 -0.04 0.00 0.03 0.00 0.00 46.19 42.52 1gmp s LEU 91 CO 0.01 0.04 0.48 -0.63 0.23 0.00 0.00 176.35 176.49 1gmp s ILE 92 N -0.55 5.14 -0.42 -0.59 1.01 -0.03 -0.35 121.20 125.40 1gmp s ILE 92 Ca 0.44 0.97 -0.13 0.00 0.00 0.00 0.00 60.65 61.93 1gmp s ILE 92 Cb -0.24 -3.82 0.05 0.00 0.01 0.00 0.00 42.46 38.46 1gmp s ILE 92 CO 0.31 0.36 0.30 -0.62 0.00 0.00 0.00 174.94 175.29 1gmp s ASP 93 N 0.35 5.91 0.00 3.58 -1.08 0.11 -4.70 116.67 120.84 1gmp s ASP 93 Ca 0.26 -1.22 0.26 0.00 -0.52 0.00 0.00 52.55 51.33 1gmp s ASP 93 Cb -0.16 -2.09 1.37 0.00 -1.46 0.00 0.00 42.92 40.59 1gmp s ASP 93 CO 0.11 -0.52 1.88 0.00 0.52 0.00 0.00 175.17 177.16 1gmp n GLN 94 N 5.07 0.49 0.00 4.34 6.02 -1.26 -0.84 117.38 131.20 1gmp n GLN 94 Ca -0.11 0.03 0.14 0.00 -0.01 0.00 0.00 57.00 57.05 1gmp n GLN 94 Cb 0.45 -1.50 0.53 0.00 1.02 0.00 0.00 30.24 30.74 1gmp n GLN 94 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 1gmp n THR 95 N -1.21 0.00 -1.31 5.09 -2.24 -1.26 -4.89 114.28 108.46 1gmp n THR 95 Ca 0.14 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.83 1gmp n THR 95 Cb 0.17 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.50 1gmp n THR 95 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50