#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gm5 n MET 1 N 0.00 0.00 -0.76 -1.46 2.81 -1.26 -4.64 117.12 111.81 3gm5 n MET 1 Ca 0.00 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 55.93 3gm5 n MET 1 Cb 0.00 -3.26 0.31 0.00 -0.71 0.00 0.00 33.22 29.57 3gm5 n MET 1 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3gm5 n SER 2 N 0.00 4.61 -0.30 7.83 3.41 -1.26 -4.62 113.62 123.29 3gm5 n SER 2 Ca 0.00 -3.10 0.06 0.00 -0.26 0.00 0.00 58.87 55.57 3gm5 n SER 2 Cb 0.00 -0.65 0.21 0.00 -0.26 0.00 0.00 64.21 63.51 3gm5 n SER 2 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3gm5 h LYS 3 N 2.64 0.69 -5.54 4.33 6.56 -2.00 -3.41 116.57 119.84 3gm5 h LYS 3 Ca 0.08 -0.04 -0.44 0.00 -1.06 0.00 0.00 60.65 59.19 3gm5 h LYS 3 Cb 1.86 -0.15 -0.17 0.00 -0.57 0.00 0.00 32.23 33.19 3gm5 h LYS 3 CO 0.45 0.45 -0.75 -0.80 -2.06 0.00 0.00 179.45 176.74 3gm5 s ASN 4 N -5.50 2.28 -0.01 0.86 0.01 -1.26 -5.11 114.94 106.20 3gm5 s ASN 4 Ca -0.12 -0.90 -0.28 0.00 -0.71 0.00 0.00 52.86 50.85 3gm5 s ASN 4 Cb 0.21 -0.10 -0.03 0.00 0.41 0.00 0.00 41.25 41.74 3gm5 s ASN 4 CO 0.78 -0.15 0.88 -0.63 -1.51 0.00 0.00 177.10 176.48 3gm5 s ILE 5 N -2.47 4.90 -0.23 0.60 -1.09 -1.26 -4.95 121.20 116.71 3gm5 s ILE 5 Ca 0.15 1.85 -0.39 0.00 -2.23 0.00 0.00 60.65 60.03 3gm5 s ILE 5 Cb -0.03 -4.22 -0.15 0.00 -1.58 0.00 0.00 42.46 36.47 3gm5 s ILE 5 CO 0.05 0.21 1.72 -0.11 -1.23 0.00 0.00 174.94 175.58 3gm5 n LEU 6 N 3.75 2.43 -4.19 2.97 0.00 -1.26 -4.91 117.00 115.79 3gm5 n LEU 6 Ca 0.03 1.07 -0.40 0.00 0.00 0.00 0.00 56.01 56.71 3gm5 n LEU 6 Cb 0.51 -1.17 -0.08 0.00 0.00 0.00 0.00 43.42 42.69 3gm5 n LEU 6 CO 0.50 -0.44 0.09 -0.62 0.00 0.00 0.00 177.39 176.92 3gm5 s ASP 7 N 3.33 5.76 0.28 1.96 2.15 -1.26 -4.91 116.67 123.97 3gm5 s ASP 7 Ca 0.97 -2.42 0.01 0.00 0.43 0.00 0.00 52.55 51.54 3gm5 s ASP 7 Cb -1.02 -1.99 0.65 0.00 -0.30 0.00 0.00 42.92 40.25 3gm5 s ASP 7 CO 0.63 -0.55 1.70 0.24 -0.17 0.00 0.00 175.17 177.02 3gm5 h MET 8 N 7.79 0.37 -0.56 4.34 2.86 -1.91 0.76 114.93 128.59 3gm5 h MET 8 Ca -0.07 -0.02 0.16 0.00 -2.06 0.00 0.00 59.70 57.71 3gm5 h MET 8 Cb 1.02 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.58 3gm5 h MET 8 CO 0.78 0.25 0.50 0.00 1.06 0.00 0.00 176.91 179.49 3gm5 h ARG 9 N 0.38 0.00 -0.50 1.72 -0.00 -1.91 0.30 114.38 114.37 3gm5 h ARG 9 Ca 0.52 0.00 -0.28 0.00 -0.50 0.00 0.00 59.98 59.72 3gm5 h ARG 9 Cb 0.95 0.00 -0.16 0.00 0.00 0.00 0.00 29.97 30.75 3gm5 h ARG 9 CO -0.52 0.00 0.03 0.09 0.00 0.00 0.00 179.97 179.57 3gm5 n ASN 10 N -3.94 3.00 -4.06 7.04 5.03 0.25 -4.85 115.26 117.74 3gm5 n ASN 10 Ca 0.11 -3.77 -0.15 0.00 0.87 0.00 0.00 54.58 51.64 3gm5 n ASN 10 Cb 0.72 -0.67 -0.12 0.00 -1.02 0.00 0.00 39.78 38.69 3gm5 n ASN 10 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 3gm5 s THR 11 N -3.41 0.61 -0.10 3.41 2.01 0.11 -4.88 115.64 113.39 3gm5 s THR 11 Ca 0.48 -0.91 -0.00 0.00 0.31 0.00 0.00 61.69 61.56 3gm5 s THR 11 Cb 0.42 -0.63 -0.03 0.00 0.01 0.00 0.00 72.50 72.28 3gm5 s THR 11 CO 0.01 -0.23 -0.06 0.54 -0.69 0.00 0.00 174.62 174.19 3gm5 s VAL 12 N -1.06 3.71 -0.09 3.82 0.11 -0.81 -4.64 120.40 121.43 3gm5 s VAL 12 Ca -0.06 -0.46 -0.01 0.00 -2.93 0.00 0.00 61.98 58.52 3gm5 s VAL 12 Cb -0.08 -2.55 -0.03 0.00 -1.53 0.00 0.00 36.38 32.19 3gm5 s VAL 12 CO 0.00 0.57 -0.04 -1.58 -3.33 0.00 0.00 175.10 170.72 3gm5 s GLN 13 N -0.40 3.03 -0.22 1.54 0.74 -0.94 -1.47 119.66 121.93 3gm5 s GLN 13 Ca 0.06 -0.49 0.01 0.00 0.05 0.00 0.00 55.36 54.99 3gm5 s GLN 13 Cb -0.12 -2.73 0.04 0.00 1.10 0.00 0.00 33.01 31.29 3gm5 s GLN 13 CO 0.02 0.59 -0.15 0.42 -0.55 0.00 0.00 175.29 175.62 3gm5 s ILE 14 N -0.58 2.22 -0.12 -2.34 1.01 -0.49 -0.19 121.20 120.71 3gm5 s ILE 14 Ca 0.09 -1.21 -0.18 0.00 0.00 0.00 0.00 60.65 59.35 3gm5 s ILE 14 Cb -0.12 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.21 3gm5 s ILE 14 CO 0.02 0.28 0.49 -0.83 0.00 0.00 0.00 174.94 174.89 3gm5 s GLY 15 N 1.23 2.39 -0.17 6.18 0.00 -0.20 -1.06 107.32 115.67 3gm5 s GLY 15 Ca -0.01 -0.19 0.01 0.00 0.00 0.00 0.00 44.72 44.53 3gm5 s GLY 15 CO -0.09 0.80 -0.18 -0.42 0.00 0.00 0.00 173.10 173.21 3gm5 s ILE 16 N 0.68 2.25 -0.11 0.90 1.01 0.19 0.34 121.20 126.46 3gm5 s ILE 16 Ca 0.26 -0.89 -0.24 0.00 0.00 0.00 0.00 60.65 59.79 3gm5 s ILE 16 Cb -0.15 -1.94 -0.03 0.00 0.01 0.00 0.00 42.46 40.34 3gm5 s ILE 16 CO 0.10 0.53 0.73 -0.69 0.00 0.00 0.00 174.94 175.61 3gm5 s VAL 17 N 1.18 4.99 0.22 2.92 1.01 -0.25 -0.09 120.40 130.38 3gm5 s VAL 17 Ca 0.02 1.47 0.03 0.00 0.00 0.00 0.00 61.98 63.50 3gm5 s VAL 17 Cb -0.14 -4.06 -0.05 0.00 0.00 0.00 0.00 36.38 32.13 3gm5 s VAL 17 CO -0.09 0.16 -0.01 0.68 0.00 0.00 0.00 175.10 175.85 3gm5 s VAL 18 N 1.36 0.99 -0.09 2.92 -7.23 0.45 -1.89 120.40 116.90 3gm5 s VAL 18 Ca 0.37 -2.03 0.15 0.00 -1.81 0.00 0.00 61.98 58.66 3gm5 s VAL 18 Cb -0.17 -2.29 -0.19 0.00 0.56 0.00 0.00 36.38 34.29 3gm5 s VAL 18 CO 0.15 -0.36 0.69 0.54 -0.31 0.00 0.00 175.10 175.81 3gm5 n ARG 19 N -0.38 0.63 -3.61 4.82 1.74 -1.26 -4.16 116.66 114.44 3gm5 n ARG 19 Ca -0.05 0.23 -0.29 0.00 -0.77 0.00 0.00 57.85 56.96 3gm5 n ARG 19 Cb 0.64 -1.77 -0.15 0.00 -1.02 0.00 0.00 32.46 30.15 3gm5 n ARG 19 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 3gm5 s ASP 20 N -5.86 3.71 0.33 0.55 -1.08 -1.26 -5.02 116.67 108.04 3gm5 s ASP 20 Ca -0.04 -1.41 0.05 0.00 -0.52 0.00 0.00 52.55 50.62 3gm5 s ASP 20 Cb 0.08 -0.52 0.59 0.00 -1.46 0.00 0.00 42.92 41.61 3gm5 s ASP 20 CO 0.82 -0.43 1.84 -0.29 0.52 0.00 0.00 175.17 177.63 3gm5 h ILE 21 N 6.43 1.21 -0.41 4.11 2.10 -1.95 -1.72 117.51 127.28 3gm5 h ILE 21 Ca -0.18 -0.91 -0.03 0.00 1.08 0.00 0.00 64.86 64.82 3gm5 h ILE 21 Cb 1.01 1.10 -0.02 0.00 -1.09 0.00 0.00 36.82 37.82 3gm5 h ILE 21 CO 0.45 0.30 0.14 -0.33 -1.08 0.00 0.00 178.15 177.63 3gm5 h GLU 22 N 0.43 0.64 0.21 2.19 3.07 -1.98 0.38 114.58 119.52 3gm5 h GLU 22 Ca 0.08 -0.13 -0.01 0.00 -0.50 0.00 0.00 59.36 58.80 3gm5 h GLU 22 Cb 0.42 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.24 3gm5 h GLU 22 CO 0.02 0.62 -0.10 1.49 -1.40 0.00 0.00 179.01 179.64 3gm5 h GLU 23 N 0.53 -0.28 -0.74 2.33 4.81 -1.94 -2.05 114.58 117.23 3gm5 h GLU 23 Ca 0.14 0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.33 3gm5 h GLU 23 Cb 0.24 0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 3gm5 h GLU 23 CO -0.01 -0.02 0.26 0.77 -0.73 0.00 0.00 179.01 179.28 3gm5 h SER 24 N -0.51 1.05 0.48 1.04 0.02 -1.30 -1.54 113.55 112.78 3gm5 h SER 24 Ca -0.03 -0.18 -0.07 0.00 -0.84 0.00 0.00 61.79 60.67 3gm5 h SER 24 Cb 0.38 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 3gm5 h SER 24 CO 0.05 0.95 -0.34 0.25 -1.14 0.00 0.00 176.83 176.60 3gm5 h LEU 25 N 1.09 0.00 -0.15 5.07 6.46 -0.93 -0.44 115.31 126.41 3gm5 h LEU 25 Ca 0.24 0.00 -0.20 0.00 -0.12 0.00 0.00 57.88 57.80 3gm5 h LEU 25 Cb 0.26 0.00 0.01 0.00 -0.73 0.00 0.00 40.66 40.20 3gm5 h LEU 25 CO -0.01 0.34 -0.70 -0.61 -0.62 0.00 0.00 178.44 176.83 3gm5 h GLN 26 N 0.00 0.74 -0.57 1.25 4.15 -0.80 -1.59 115.11 118.29 3gm5 h GLN 26 Ca -0.00 -0.60 0.02 0.00 0.77 0.00 0.00 58.65 58.83 3gm5 h GLN 26 Cb 0.67 0.12 -0.03 0.00 0.21 0.00 0.00 27.48 28.45 3gm5 h GLN 26 CO 0.04 1.21 0.36 -0.91 -1.93 0.00 0.00 178.83 177.61 3gm5 h ASN 27 N 0.46 0.61 -0.33 -0.69 -0.26 -0.85 -0.58 115.58 113.93 3gm5 h ASN 27 Ca -0.05 -0.01 -0.12 0.00 -0.56 0.00 0.00 56.30 55.57 3gm5 h ASN 27 Cb 1.34 -0.14 -0.01 0.00 -1.06 0.00 0.00 38.32 38.44 3gm5 h ASN 27 CO 0.15 0.43 -0.21 1.88 -1.06 0.00 0.00 177.43 178.62 3gm5 h TYR 28 N 0.73 0.93 -0.50 1.19 0.05 -1.07 -0.67 116.97 117.63 3gm5 h TYR 28 Ca 0.22 -0.21 -0.10 0.00 0.05 0.00 0.00 58.73 58.69 3gm5 h TYR 28 Cb -0.03 -0.22 -0.02 0.00 1.01 0.00 0.00 36.73 37.47 3gm5 h TYR 28 CO -0.05 0.95 -0.10 0.00 -1.05 0.00 0.00 178.16 177.92 3gm5 h ALA 29 N 1.04 0.88 0.01 3.88 0.00 -0.99 -2.29 119.26 121.79 3gm5 h ALA 29 Ca 0.10 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 3gm5 h ALA 29 Cb 0.74 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3gm5 h ALA 29 CO 0.06 0.64 -0.01 0.93 0.00 0.00 0.00 179.25 180.87 3gm5 h GLU 30 N 0.83 -0.02 -0.32 0.00 4.39 -0.96 0.14 114.58 118.65 3gm5 h GLU 30 Ca 0.13 0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.88 3gm5 h GLU 30 Cb 0.63 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.24 3gm5 h GLU 30 CO 0.04 0.42 0.08 0.35 -1.16 0.00 0.00 179.01 178.74 3gm5 h PHE 31 N -0.46 0.13 -0.03 4.33 3.57 -1.09 -2.32 116.94 121.07 3gm5 h PHE 31 Ca -0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3gm5 h PHE 31 Cb 0.44 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 39.17 3gm5 h PHE 31 CO 0.08 0.04 0.00 1.19 -2.23 0.00 0.00 178.31 177.38 3gm5 n PHE 32 N -5.07 0.03 -3.63 0.41 3.72 -0.87 -4.93 117.46 107.12 3gm5 n PHE 32 Ca 0.00 -0.02 -0.22 0.00 -0.05 0.00 0.00 57.45 57.17 3gm5 n PHE 32 Cb 0.13 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 38.73 3gm5 n PHE 32 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3gm5 n GLY 33 N 1.08 -0.38 3.42 1.37 0.00 -0.56 -4.99 105.19 105.14 3gm5 n GLY 33 Ca 0.20 0.15 -0.25 0.00 0.00 0.00 0.00 46.02 46.12 3gm5 n GLY 33 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gm5 s VAL 34 N -3.47 2.29 0.17 1.61 -7.23 -0.07 -4.97 120.40 108.73 3gm5 s VAL 34 Ca 0.18 -2.18 -0.31 0.00 -1.81 0.00 0.00 61.98 57.87 3gm5 s VAL 34 Cb -0.08 -2.15 -0.09 0.00 0.56 0.00 0.00 36.38 34.62 3gm5 s VAL 34 CO 0.78 -0.28 1.38 -1.61 -0.31 0.00 0.00 175.10 175.05 3gm5 s GLU 35 N -3.08 4.33 0.15 4.82 2.02 -1.26 -4.62 118.70 121.07 3gm5 s GLU 35 Ca 0.24 2.12 -0.34 0.00 0.02 0.00 0.00 54.97 57.00 3gm5 s GLU 35 Cb -0.06 -3.20 -0.14 0.00 0.10 0.00 0.00 34.13 30.82 3gm5 s GLU 35 CO 0.11 -0.37 1.51 1.17 0.02 0.00 0.00 175.26 177.70 3gm5 n LYS 36 N 3.21 1.92 -2.62 1.61 3.00 -1.26 -4.98 118.16 119.04 3gm5 n LYS 36 Ca 0.09 0.69 -0.26 0.00 -0.00 0.00 0.00 58.31 58.83 3gm5 n LYS 36 Cb 0.42 -2.42 0.02 0.00 0.00 0.00 0.00 35.03 33.04 3gm5 n LYS 36 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 3gm5 s PRO 37 N 0.70 3.15 0.13 1.64 0.04 -1.26 -5.07 135.00 134.33 3gm5 s PRO 37 Ca 0.79 -0.06 -0.10 0.00 0.04 0.00 0.00 61.00 61.68 3gm5 s PRO 37 Cb -0.73 -2.37 -0.06 0.00 0.04 0.00 0.00 34.50 31.37 3gm5 s PRO 37 CO 0.41 -0.44 0.45 -0.65 0.04 0.00 0.00 177.00 176.81 3gm5 s GLN 38 N -4.80 3.78 0.34 4.56 -0.21 -1.26 -4.99 119.66 117.08 3gm5 s GLN 38 Ca 0.50 0.21 0.07 0.00 0.02 0.00 0.00 55.36 56.16 3gm5 s GLN 38 Cb -0.10 -2.89 -0.02 0.00 1.00 0.00 0.00 33.01 31.00 3gm5 s GLN 38 CO 0.43 0.48 0.40 1.67 -2.12 0.00 0.00 175.29 176.15 3gm5 s TRP 39 N -1.54 2.99 0.12 0.91 1.48 -1.26 -4.57 118.94 117.06 3gm5 s TRP 39 Ca 0.38 -0.28 -0.22 0.00 -1.06 0.00 0.00 56.10 54.93 3gm5 s TRP 39 Cb -0.13 -1.94 0.06 0.00 -1.16 0.00 0.00 33.47 30.29 3gm5 s TRP 39 CO 0.20 0.04 0.54 -0.59 -4.06 0.00 0.00 176.95 173.08 3gm5 s PHE 40 N -2.25 -0.44 0.11 1.66 -0.12 -0.29 -4.94 117.98 111.72 3gm5 s PHE 40 Ca 0.44 0.29 -0.25 0.00 -0.05 0.00 0.00 56.93 57.37 3gm5 s PHE 40 Cb -0.08 0.43 -0.07 0.00 -0.63 0.00 0.00 43.02 42.67 3gm5 s PHE 40 CO 0.29 -0.75 0.76 -1.58 -0.05 0.00 0.00 175.22 173.88 3gm5 s TRP 41 N -3.34 3.83 0.85 3.49 0.52 -1.26 0.04 118.94 123.07 3gm5 s TRP 41 Ca -0.01 1.54 -0.11 0.00 0.02 0.00 0.00 56.10 57.54 3gm5 s TRP 41 Cb -0.00 -2.77 0.10 0.00 -1.15 0.00 0.00 33.47 29.65 3gm5 s TRP 41 CO -0.09 0.43 1.09 0.95 0.02 0.00 0.00 176.95 179.35 3gm5 s THR 42 N -0.71 2.90 0.73 2.01 -4.23 -0.21 -4.95 115.64 111.17 3gm5 s THR 42 Ca 0.36 0.29 -0.16 0.00 -1.18 0.00 0.00 61.69 61.01 3gm5 s THR 42 Cb -0.22 -2.83 0.03 0.00 1.34 0.00 0.00 72.50 70.82 3gm5 s THR 42 CO 0.24 -0.38 1.13 0.47 -0.54 0.00 0.00 174.62 175.54 3gm5 n ASP 43 N -3.71 1.09 -4.83 3.99 8.00 -1.26 -4.71 116.55 115.12 3gm5 n ASP 43 Ca 0.07 0.69 -0.31 0.00 0.71 0.00 0.00 54.79 55.95 3gm5 n ASP 43 Cb 0.55 -1.48 0.05 0.00 -0.02 0.00 0.00 41.12 40.22 3gm5 n ASP 43 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 3gm5 s ASP 44 N -1.71 5.29 0.54 -2.24 1.47 -1.26 -4.59 116.67 114.16 3gm5 s ASP 44 Ca 0.76 1.47 0.38 0.00 1.18 0.00 0.00 52.55 56.34 3gm5 s ASP 44 Cb -0.34 -2.33 1.56 0.00 -0.34 0.00 0.00 42.92 41.47 3gm5 s ASP 44 CO 0.48 -1.48 1.76 0.22 0.68 0.00 0.00 175.17 176.82 3gm5 h TYR 45 N -0.75 0.05 0.00 2.11 3.20 -1.86 0.10 116.97 119.82 3gm5 h TYR 45 Ca -0.45 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.42 3gm5 h TYR 45 Cb 1.23 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 39.48 3gm5 h TYR 45 CO 0.58 -0.00 -0.01 0.66 -1.64 0.00 0.00 178.16 177.75 3gm5 h SER 46 N 0.02 0.00 0.00 -2.11 4.64 -1.96 0.29 113.55 114.43 3gm5 h SER 46 Ca 0.64 0.00 -0.22 0.00 -0.47 0.00 0.00 61.79 61.74 3gm5 h SER 46 Cb 2.49 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 64.54 3gm5 h SER 46 CO -0.03 0.01 -1.82 0.29 -0.87 0.00 0.00 176.83 174.40 3gm5 n LYS 47 N -3.11 0.89 0.02 4.77 5.02 0.17 -4.70 118.16 121.23 3gm5 n LYS 47 Ca -0.01 0.06 -0.13 0.00 -2.02 0.00 0.00 58.31 56.20 3gm5 n LYS 47 Cb 0.20 -1.29 -0.02 0.00 -0.02 0.00 0.00 35.03 33.90 3gm5 n LYS 47 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3gm5 h ALA 48 N 0.17 0.45 -3.16 7.82 0.00 -0.93 -3.41 119.26 120.20 3gm5 h ALA 48 Ca -0.32 -0.61 -0.33 0.00 0.00 0.00 0.00 54.91 53.64 3gm5 h ALA 48 Cb 1.57 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.29 3gm5 h ALA 48 CO -0.03 0.73 -0.41 0.72 0.00 0.00 0.00 179.25 180.26 3gm5 n HIS 49 N -3.87 -1.09 -1.65 0.00 8.25 0.10 -0.21 115.22 116.75 3gm5 n HIS 49 Ca -0.06 0.00 -0.50 0.00 -0.26 0.00 0.00 57.72 56.90 3gm5 n HIS 49 Cb 0.74 -3.30 -0.05 0.00 1.12 0.00 0.00 29.99 28.50 3gm5 n HIS 49 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 3gm5 n THR 50 N -3.49 0.13 -3.95 1.59 -1.04 -1.26 -4.69 114.28 101.56 3gm5 n THR 50 Ca -0.19 -0.02 -0.29 0.00 -2.04 0.00 0.00 64.05 61.50 3gm5 n THR 50 Cb 0.64 -1.29 -0.16 0.00 -1.82 0.00 0.00 70.33 67.69 3gm5 n THR 50 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3gm5 s LYS 51 N 1.60 1.80 -0.22 -2.82 1.02 -0.61 -1.79 119.74 118.71 3gm5 s LYS 51 Ca 0.86 -0.63 -0.03 0.00 0.02 0.00 0.00 55.97 56.18 3gm5 s LYS 51 Cb -0.83 -2.15 -0.00 0.00 -0.52 0.00 0.00 37.83 34.33 3gm5 s LYS 51 CO 0.47 -0.39 -0.06 0.12 -0.92 0.00 0.00 175.35 174.57 3gm5 s PHE 52 N 1.53 2.95 -1.49 3.18 5.36 0.57 -2.08 117.98 128.00 3gm5 s PHE 52 Ca 0.01 -1.09 -0.11 0.00 -0.96 0.00 0.00 56.93 54.78 3gm5 s PHE 52 Cb -0.15 -2.08 0.07 0.00 -0.34 0.00 0.00 43.02 40.51 3gm5 s PHE 52 CO -0.08 -0.60 0.89 0.09 -1.46 0.00 0.00 175.22 174.06 3gm5 n ASN 53 N 4.76 -3.77 0.00 6.13 3.02 -0.08 -1.61 115.26 123.73 3gm5 n ASN 53 Ca -0.18 -0.81 0.00 0.00 -0.03 0.00 0.00 54.58 53.56 3gm5 n ASN 53 Cb 0.50 -3.83 0.00 0.00 -0.61 0.00 0.00 39.78 35.84 3gm5 n ASN 53 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gm5 n GLY 54 N -1.67 2.81 3.84 7.41 0.00 -1.26 -5.02 105.19 111.30 3gm5 n GLY 54 Ca -0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 3gm5 n GLY 54 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3gm5 s ARG 55 N -0.07 3.50 0.52 1.61 3.52 -0.63 -5.03 118.95 122.37 3gm5 s ARG 55 Ca 0.00 -0.17 -0.19 0.00 -0.13 0.00 0.00 55.73 55.24 3gm5 s ARG 55 Cb 0.00 -3.18 -0.07 0.00 -1.56 0.00 0.00 34.95 30.14 3gm5 s ARG 55 CO 0.00 0.70 1.08 -2.14 -0.81 0.00 0.00 175.30 174.13 3gm5 s PRO 56 N -0.81 3.55 -0.02 5.12 0.02 -1.26 -0.31 135.00 141.28 3gm5 s PRO 56 Ca 0.14 1.44 -0.03 0.00 0.02 0.00 0.00 61.00 62.56 3gm5 s PRO 56 Cb -0.12 -2.05 0.01 0.00 0.02 0.00 0.00 34.50 32.36 3gm5 s PRO 56 CO 0.03 -0.65 0.08 -0.08 -0.33 0.00 0.00 177.00 176.05 3gm5 s THR 57 N -1.97 0.02 -2.07 0.99 -1.32 -0.74 -4.84 115.64 105.71 3gm5 s THR 57 Ca 0.69 -0.13 0.21 0.00 -1.21 0.00 0.00 61.69 61.25 3gm5 s THR 57 Cb -0.19 -0.16 0.57 0.00 -1.51 0.00 0.00 72.50 71.20 3gm5 s THR 57 CO 0.25 -0.07 1.76 0.29 -2.21 0.00 0.00 174.62 174.63 3gm5 n LYS 58 N 2.78 1.16 -1.54 7.08 4.76 -1.26 -4.46 118.16 126.67 3gm5 n LYS 58 Ca -0.14 -0.24 -0.52 0.00 -2.87 0.00 0.00 58.31 54.55 3gm5 n LYS 58 Cb 0.59 -1.35 -0.05 0.00 -1.84 0.00 0.00 35.03 32.38 3gm5 n LYS 58 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3gm5 n ALA 59 N -0.58 -1.72 -2.11 7.82 0.00 -1.26 -4.57 120.51 118.08 3gm5 n ALA 59 Ca 0.16 0.50 -0.08 0.00 0.00 0.00 0.00 53.44 54.02 3gm5 n ALA 59 Cb 0.13 -1.93 -0.10 0.00 0.00 0.00 0.00 19.45 17.55 3gm5 n ALA 59 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3gm5 s ARG 60 N -0.21 0.68 0.05 0.00 0.52 -1.26 -4.78 118.95 113.95 3gm5 s ARG 60 Ca 0.78 -1.26 -0.09 0.00 -0.52 0.00 0.00 55.73 54.64 3gm5 s ARG 60 Cb -0.98 0.11 0.00 0.00 0.52 0.00 0.00 34.95 34.60 3gm5 s ARG 60 CO 0.53 -0.09 0.19 0.00 0.02 0.00 0.00 175.30 175.94 3gm5 s ALA 61 N -3.85 -0.32 -0.02 2.13 0.00 -1.26 -1.39 121.76 117.05 3gm5 s ALA 61 Ca 0.09 -0.36 -0.23 0.00 0.00 0.00 0.00 51.96 51.47 3gm5 s ALA 61 Cb 0.07 0.31 -0.05 0.00 0.00 0.00 0.00 23.12 23.46 3gm5 s ALA 61 CO -0.08 -0.39 0.67 0.15 0.00 0.00 0.00 175.76 176.12 3gm5 s LYS 62 N -2.80 4.41 0.10 0.00 1.02 0.10 -1.05 119.74 121.52 3gm5 s LYS 62 Ca -0.03 0.86 0.08 0.00 0.02 0.00 0.00 55.97 56.90 3gm5 s LYS 62 Cb 0.00 -3.39 -0.03 0.00 -0.52 0.00 0.00 37.83 33.89 3gm5 s LYS 62 CO -0.05 0.23 -0.21 -0.51 -0.92 0.00 0.00 175.35 173.88 3gm5 s LEU 63 N 0.24 2.28 -0.08 3.17 1.43 0.11 -1.26 118.68 124.57 3gm5 s LEU 63 Ca 0.35 -0.67 -0.06 0.00 -1.03 0.00 0.00 54.13 52.72 3gm5 s LEU 63 Cb -0.18 -0.92 0.03 0.00 0.03 0.00 0.00 46.19 45.14 3gm5 s LEU 63 CO 0.19 0.08 0.21 0.00 0.23 0.00 0.00 176.35 177.06 3gm5 s ALA 64 N -1.10 -0.49 0.09 4.21 0.00 -1.04 -1.13 121.76 122.30 3gm5 s ALA 64 Ca 0.07 0.68 0.09 0.00 0.00 0.00 0.00 51.96 52.80 3gm5 s ALA 64 Cb -0.10 -0.41 -0.04 0.00 0.00 0.00 0.00 23.12 22.57 3gm5 s ALA 64 CO 0.04 -0.13 -0.21 -0.06 0.00 0.00 0.00 175.76 175.40 3gm5 s PHE 65 N 0.48 2.47 -0.04 0.00 0.08 -1.26 -1.02 117.98 118.68 3gm5 s PHE 65 Ca -0.03 -0.30 0.03 0.00 0.12 0.00 0.00 56.93 56.75 3gm5 s PHE 65 Cb -0.04 -1.37 0.00 0.00 -0.57 0.00 0.00 43.02 41.04 3gm5 s PHE 65 CO -0.02 0.30 -0.13 -0.06 -0.10 0.00 0.00 175.22 175.21 3gm5 s PHE 66 N -1.02 1.41 -0.27 0.36 0.08 -0.22 -4.71 117.98 113.61 3gm5 s PHE 66 Ca 0.15 -0.43 -0.06 0.00 0.12 0.00 0.00 56.93 56.72 3gm5 s PHE 66 Cb -0.10 -0.99 0.00 0.00 -0.57 0.00 0.00 43.02 41.36 3gm5 s PHE 66 CO 0.07 -0.18 0.05 -1.21 -0.10 0.00 0.00 175.22 173.85 3gm5 s GLU 67 N 0.26 3.19 -0.57 0.44 8.01 -1.26 -0.86 118.70 127.92 3gm5 s GLU 67 Ca -0.07 -0.78 0.05 0.00 0.01 0.00 0.00 54.97 54.18 3gm5 s GLU 67 Cb -0.12 -3.28 0.18 0.00 -4.31 0.00 0.00 34.13 26.60 3gm5 s GLU 67 CO 0.02 -0.37 0.44 1.28 0.01 0.00 0.00 175.26 176.65 3gm5 n LEU 68 N 4.85 1.46 0.00 1.80 4.77 0.87 -4.72 117.00 126.03 3gm5 n LEU 68 Ca -0.15 -4.85 0.00 0.00 -0.03 0.00 0.00 56.01 50.98 3gm5 n LEU 68 Cb 0.49 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.44 3gm5 n LEU 68 CO 0.31 1.83 0.00 0.61 -1.33 0.00 0.00 177.39 178.80 3gm5 n GLY 69 N 2.25 3.33 0.00 -0.72 0.00 -1.26 -1.95 105.19 106.84 3gm5 n GLY 69 Ca 0.25 -0.12 0.09 0.00 0.00 0.00 0.00 46.02 46.23 3gm5 n GLY 69 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3gm5 n PRO 70 N 13.49 0.29 -4.83 1.61 -0.04 -1.26 -4.77 135.00 139.49 3gm5 n PRO 70 Ca 0.00 0.11 -0.33 0.00 -0.04 0.00 0.00 63.50 63.24 3gm5 n PRO 70 Cb 0.00 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.82 3gm5 n PRO 70 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 3gm5 s LEU 71 N -2.50 2.75 -0.22 1.53 2.96 -0.82 -1.92 118.68 120.46 3gm5 s LEU 71 Ca 0.18 -0.24 -0.01 0.00 -0.22 0.00 0.00 54.13 53.84 3gm5 s LEU 71 Cb 0.12 -1.59 0.02 0.00 0.50 0.00 0.00 46.19 45.24 3gm5 s LEU 71 CO 0.26 0.27 -0.10 -1.58 -1.32 0.00 0.00 176.35 173.88 3gm5 s GLN 72 N -0.27 2.97 -0.23 1.98 0.74 -0.54 -0.09 119.66 124.21 3gm5 s GLN 72 Ca 0.02 -0.88 -0.12 0.00 0.05 0.00 0.00 55.36 54.43 3gm5 s GLN 72 Cb -0.13 -2.87 -0.05 0.00 1.10 0.00 0.00 33.01 31.06 3gm5 s GLN 72 CO 0.03 -0.31 0.24 -0.51 -0.55 0.00 0.00 175.29 174.18 3gm5 s LEU 73 N 1.34 4.12 -0.20 3.68 1.43 -0.04 -1.40 118.68 127.61 3gm5 s LEU 73 Ca 0.02 0.23 -0.03 0.00 -1.03 0.00 0.00 54.13 53.32 3gm5 s LEU 73 Cb -0.15 -2.23 -0.01 0.00 0.03 0.00 0.00 46.19 43.83 3gm5 s LEU 73 CO -0.07 0.01 -0.07 -0.70 0.23 0.00 0.00 176.35 175.76 3gm5 s GLU 74 N 1.18 3.37 -0.05 1.70 2.12 -0.23 -1.05 118.70 125.75 3gm5 s GLU 74 Ca 0.11 -0.64 -0.14 0.00 0.36 0.00 0.00 54.97 54.66 3gm5 s GLU 74 Cb -0.14 -2.90 -0.05 0.00 0.26 0.00 0.00 34.13 31.30 3gm5 s GLU 74 CO 0.06 -0.09 0.36 -0.51 -0.54 0.00 0.00 175.26 174.54 3gm5 s LEU 75 N 1.17 4.42 -0.13 2.70 1.43 -0.19 0.55 118.68 128.63 3gm5 s LEU 75 Ca 0.02 0.83 -0.01 0.00 -1.03 0.00 0.00 54.13 53.94 3gm5 s LEU 75 Cb -0.14 -2.50 0.03 0.00 0.03 0.00 0.00 46.19 43.61 3gm5 s LEU 75 CO -0.02 0.28 -0.06 -0.63 0.23 0.00 0.00 176.35 176.16 3gm5 s ILE 76 N -0.73 0.95 -0.39 -0.59 1.01 0.87 -2.49 121.20 119.82 3gm5 s ILE 76 Ca 0.22 -0.34 0.02 0.00 0.00 0.00 0.00 60.65 60.54 3gm5 s ILE 76 Cb -0.15 -1.05 0.11 0.00 0.01 0.00 0.00 42.46 41.37 3gm5 s ILE 76 CO 0.11 0.27 0.14 -0.70 0.00 0.00 0.00 174.94 174.75 3gm5 s GLU 77 N 1.72 1.74 0.60 2.79 2.12 -0.39 -0.41 118.70 126.88 3gm5 s GLU 77 Ca 0.04 -1.97 -0.14 0.00 0.36 0.00 0.00 54.97 53.26 3gm5 s GLU 77 Cb -0.13 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.86 3gm5 s GLU 77 CO -0.08 -1.01 1.03 -1.25 -0.54 0.00 0.00 175.26 173.42 3gm5 s PRO 78 N 0.81 3.43 0.00 4.30 0.04 -1.26 0.02 135.00 142.34 3gm5 s PRO 78 Ca 0.11 1.00 0.00 0.00 0.04 0.00 0.00 61.00 62.15 3gm5 s PRO 78 Cb -0.21 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.28 3gm5 s PRO 78 CO -0.06 -0.71 0.00 -0.40 0.04 0.00 0.00 177.00 175.87 3gm5 n ASP 79 N -2.33 0.00 -0.62 6.66 5.68 -0.49 -4.91 116.55 120.55 3gm5 n ASP 79 Ca 0.07 -0.60 0.13 0.00 -0.50 0.00 0.00 54.79 53.90 3gm5 n ASP 79 Cb 0.53 0.00 0.40 0.00 -1.14 0.00 0.00 41.12 40.92 3gm5 n ASP 79 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3gm5 n GLU 80 N -0.60 1.85 -1.13 0.11 -0.58 -1.26 -4.79 120.64 114.25 3gm5 n GLU 80 Ca 0.00 -1.25 -0.29 0.00 -0.42 0.00 0.00 57.16 55.20 3gm5 n GLU 80 Cb 0.00 -1.47 0.16 0.00 -0.57 0.00 0.00 31.44 29.56 3gm5 n GLU 80 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 3gm5 s ASN 81 N -1.92 3.07 0.17 1.62 0.02 -1.26 -4.96 114.94 111.68 3gm5 s ASN 81 Ca 0.35 1.45 -0.30 0.00 -1.02 0.00 0.00 52.86 53.34 3gm5 s ASN 81 Cb 0.20 -2.13 -0.08 0.00 0.02 0.00 0.00 41.25 39.27 3gm5 s ASN 81 CO 0.32 -2.89 1.29 -2.84 0.02 0.00 0.00 177.10 173.00 3gm5 s PRO 82 N -4.89 4.40 0.06 -0.60 0.02 -1.26 -4.75 135.00 127.98 3gm5 s PRO 82 Ca 0.64 2.00 -0.28 0.00 0.02 0.00 0.00 61.00 63.39 3gm5 s PRO 82 Cb -0.19 -3.22 0.09 0.00 0.02 0.00 0.00 34.50 31.20 3gm5 s PRO 82 CO 0.58 -0.25 1.06 -1.54 -0.33 0.00 0.00 177.00 176.52 3gm5 s SER 83 N 0.45 -0.17 0.24 2.53 1.04 -1.26 -4.51 113.70 112.03 3gm5 s SER 83 Ca 0.57 -0.24 -0.04 0.00 0.48 0.00 0.00 55.95 56.72 3gm5 s SER 83 Cb -0.35 0.36 0.26 0.00 0.10 0.00 0.00 66.02 66.39 3gm5 s SER 83 CO 0.36 -0.64 1.76 0.00 0.98 0.00 0.00 173.24 175.70 3gm5 h THR 84 N 2.00 1.25 -0.07 2.02 1.03 -1.94 -1.43 112.91 115.76 3gm5 h THR 84 Ca -0.24 -0.93 -0.01 0.00 -0.01 0.00 0.00 66.41 65.22 3gm5 h THR 84 Cb 1.22 0.65 -0.00 0.00 -1.07 0.00 0.00 68.15 68.95 3gm5 h THR 84 CO 0.27 0.35 0.02 -0.50 -0.01 0.00 0.00 175.52 175.64 3gm5 h TRP 85 N 0.91 0.12 -0.52 0.00 6.55 -1.97 -0.60 115.95 120.44 3gm5 h TRP 85 Ca 0.19 -0.01 -0.05 0.00 0.95 0.00 0.00 58.89 59.97 3gm5 h TRP 85 Cb 0.36 -0.03 -0.02 0.00 -0.86 0.00 0.00 29.16 28.61 3gm5 h TRP 85 CO 0.02 0.31 0.13 -0.09 -1.05 0.00 0.00 178.44 177.76 3gm5 h ARG 86 N -0.10 0.84 -0.66 0.49 9.65 -1.84 0.31 114.38 123.07 3gm5 h ARG 86 Ca 0.02 -0.20 0.04 0.00 -1.10 0.00 0.00 59.98 58.74 3gm5 h ARG 86 Cb 0.25 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.67 3gm5 h ARG 86 CO 0.00 0.79 0.40 1.49 2.80 0.00 0.00 179.97 185.45 3gm5 h GLU 87 N 0.73 0.75 -0.02 0.20 4.81 -1.20 -0.62 114.58 119.22 3gm5 h GLU 87 Ca 0.17 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3gm5 h GLU 87 Cb 0.33 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 3gm5 h GLU 87 CO 0.00 0.49 0.01 0.35 -0.73 0.00 0.00 179.01 179.13 3gm5 h PHE 88 N 0.77 0.03 0.43 0.92 3.57 -0.65 -2.57 116.94 119.43 3gm5 h PHE 88 Ca 0.27 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.76 3gm5 h PHE 88 Cb 0.06 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 3gm5 h PHE 88 CO -0.06 0.13 -0.28 1.25 -2.23 0.00 0.00 178.31 177.12 3gm5 h LEU 89 N -0.08 -0.72 -0.47 0.59 5.85 -0.58 0.23 115.31 120.13 3gm5 h LEU 89 Ca 0.01 0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.85 3gm5 h LEU 89 Cb 0.11 0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.30 3gm5 h LEU 89 CO -0.00 -0.44 0.11 0.44 -0.34 0.00 0.00 178.44 178.21 3gm5 h ASP 90 N -0.69 0.04 1.25 1.25 3.32 -1.16 0.40 116.42 120.84 3gm5 h ASP 90 Ca -0.05 0.08 -0.11 0.00 0.02 0.00 0.00 57.03 56.97 3gm5 h ASP 90 Cb 0.57 0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.20 3gm5 h ASP 90 CO 0.04 0.05 -0.78 0.50 -1.72 0.00 0.00 179.24 177.33 3gm5 h LYS 91 N 0.25 0.00 0.00 3.56 3.64 -1.40 -3.39 116.57 119.22 3gm5 h LYS 91 Ca 0.23 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.61 3gm5 h LYS 91 Cb 0.29 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 3gm5 h LYS 91 CO -0.29 0.39 -0.86 -1.71 -2.27 0.00 0.00 179.45 174.71 3gm5 n ASN 92 N -3.09 4.28 0.00 4.20 2.85 0.80 -5.08 115.26 119.21 3gm5 n ASN 92 Ca -0.01 -0.06 0.00 0.00 -0.11 0.00 0.00 54.58 54.39 3gm5 n ASN 92 Cb 0.75 0.98 0.00 0.00 1.24 0.00 0.00 39.78 42.74 3gm5 n ASN 92 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3gm5 n GLY 93 N 2.26 -1.35 3.72 8.20 0.00 0.14 -4.87 105.19 113.29 3gm5 n GLY 93 Ca 0.00 -1.56 -0.41 0.00 0.00 0.00 0.00 46.02 44.05 3gm5 n GLY 93 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3gm5 n GLU 94 N -1.34 2.13 0.00 1.61 1.02 -1.26 -4.55 120.64 118.26 3gm5 n GLU 94 Ca 0.00 0.75 0.00 0.00 -0.02 0.00 0.00 57.16 57.89 3gm5 n GLU 94 Cb 0.00 -2.45 0.00 0.00 -0.02 0.00 0.00 31.44 28.97 3gm5 n GLU 94 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3gm5 n GLY 95 N 0.71 -0.81 3.67 0.62 0.00 -0.79 -4.99 105.19 103.59 3gm5 n GLY 95 Ca 0.05 -1.23 -0.42 0.00 0.00 0.00 0.00 46.02 44.42 3gm5 n GLY 95 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gm5 s ILE 96 N -2.00 3.48 -0.14 -0.61 1.01 -1.26 -1.09 121.20 120.58 3gm5 s ILE 96 Ca 0.00 0.65 0.01 0.00 0.00 0.00 0.00 60.65 61.31 3gm5 s ILE 96 Cb 0.00 -3.42 -0.23 0.00 0.01 0.00 0.00 42.46 38.81 3gm5 s ILE 96 CO 0.00 -0.05 0.27 1.57 0.00 0.00 0.00 174.94 176.73 3gm5 n HIS 97 N 6.84 0.83 -3.83 3.97 -0.00 0.15 -4.90 115.22 118.28 3gm5 n HIS 97 Ca 0.17 0.20 -0.06 0.00 -0.00 0.00 0.00 57.72 58.03 3gm5 n HIS 97 Cb 0.42 -1.12 -0.01 0.00 -0.00 0.00 0.00 29.99 29.28 3gm5 n HIS 97 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 3gm5 s HIS 98 N -2.55 -0.14 -0.12 1.57 -3.43 -1.06 -3.99 115.29 105.58 3gm5 s HIS 98 Ca -0.21 -0.31 0.01 0.00 -0.80 0.00 0.00 55.06 53.75 3gm5 s HIS 98 Cb 0.07 0.71 0.02 0.00 -1.43 0.00 0.00 32.58 31.95 3gm5 s HIS 98 CO 0.75 -1.17 -0.13 0.42 -2.00 0.00 0.00 174.74 172.61 3gm5 s ILE 99 N -3.55 1.40 0.01 -5.38 1.01 -0.72 -1.04 121.20 112.93 3gm5 s ILE 99 Ca 0.12 -0.55 0.06 0.00 0.00 0.00 0.00 60.65 60.28 3gm5 s ILE 99 Cb -0.05 -1.31 -0.03 0.00 0.01 0.00 0.00 42.46 41.08 3gm5 s ILE 99 CO 0.06 0.43 -0.16 0.00 0.00 0.00 0.00 174.94 175.27 3gm5 s ALA 100 N 1.30 2.67 -0.02 9.38 0.00 0.73 -1.20 121.76 134.62 3gm5 s ALA 100 Ca -0.01 -1.12 0.06 0.00 0.00 0.00 0.00 51.96 50.90 3gm5 s ALA 100 Cb -0.14 -0.84 -0.01 0.00 0.00 0.00 0.00 23.12 22.13 3gm5 s ALA 100 CO -0.06 0.58 -0.20 -0.06 0.00 0.00 0.00 175.76 176.02 3gm5 s PHE 101 N -0.89 1.78 0.07 0.00 0.08 -0.55 -2.22 117.98 116.25 3gm5 s PHE 101 Ca 0.14 -0.35 -0.26 0.00 0.12 0.00 0.00 56.93 56.58 3gm5 s PHE 101 Cb -0.11 -1.15 -0.06 0.00 -0.57 0.00 0.00 43.02 41.13 3gm5 s PHE 101 CO 0.05 -0.04 0.79 0.08 -0.10 0.00 0.00 175.22 176.00 3gm5 s VAL 102 N -0.43 4.64 0.12 -0.44 1.01 -1.26 -0.70 120.40 123.33 3gm5 s VAL 102 Ca 0.07 1.70 0.08 0.00 0.00 0.00 0.00 61.98 63.83 3gm5 s VAL 102 Cb -0.08 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 3gm5 s VAL 102 CO -0.00 0.38 -0.19 0.68 0.00 0.00 0.00 175.10 175.97 3gm5 s VAL 103 N -0.23 1.64 0.21 2.92 -7.23 0.83 -4.88 120.40 113.66 3gm5 s VAL 103 Ca 0.39 -1.62 0.01 0.00 -1.81 0.00 0.00 61.98 58.95 3gm5 s VAL 103 Cb -0.21 -1.57 -0.07 0.00 0.56 0.00 0.00 36.38 35.09 3gm5 s VAL 103 CO 0.24 -0.17 1.50 0.50 -0.31 0.00 0.00 175.10 176.87 3gm5 h LYS 104 N 3.86 0.36 -3.35 4.82 3.11 -1.97 -3.41 116.57 119.99 3gm5 h LYS 104 Ca -0.44 -0.26 -0.56 0.00 -2.81 0.00 0.00 60.65 56.58 3gm5 h LYS 104 Cb 1.19 0.04 -0.40 0.00 -1.00 0.00 0.00 32.23 32.06 3gm5 h LYS 104 CO 0.43 0.88 -0.76 0.34 -2.81 0.00 0.00 179.45 177.53 3gm5 s ASP 105 N -6.93 3.82 0.10 4.20 -1.08 -1.26 -4.98 116.67 110.55 3gm5 s ASP 105 Ca -0.05 -1.49 -0.33 0.00 -0.52 0.00 0.00 52.55 50.16 3gm5 s ASP 105 Cb 0.11 -0.71 -0.13 0.00 -1.46 0.00 0.00 42.92 40.73 3gm5 s ASP 105 CO 0.82 -0.41 1.59 -0.03 0.52 0.00 0.00 175.17 177.65 3gm5 h MET 106 N 8.19 -0.77 -0.62 4.34 1.85 -1.93 -2.26 114.93 123.73 3gm5 h MET 106 Ca -0.16 0.05 0.13 0.00 -0.61 0.00 0.00 59.70 59.12 3gm5 h MET 106 Cb 1.02 0.18 -0.11 0.00 0.43 0.00 0.00 31.60 33.12 3gm5 h MET 106 CO 0.45 -0.51 -0.04 -0.44 -0.40 0.00 0.00 176.91 175.97 3gm5 h ASP 107 N -0.80 -0.36 0.40 1.39 5.19 -1.98 0.15 116.42 120.40 3gm5 h ASP 107 Ca -0.02 0.16 -0.16 0.00 -0.62 0.00 0.00 57.03 56.40 3gm5 h ASP 107 Cb 0.74 0.31 -0.01 0.00 0.18 0.00 0.00 39.33 40.55 3gm5 h ASP 107 CO -0.13 -0.15 -0.66 0.08 -3.12 0.00 0.00 179.24 175.26 3gm5 h ARG 108 N 0.08 0.24 -0.32 3.56 0.11 -1.98 -1.38 114.38 114.70 3gm5 h ARG 108 Ca 0.32 -0.18 -0.06 0.00 0.10 0.00 0.00 59.98 60.15 3gm5 h ARG 108 Cb 0.51 0.03 -0.01 0.00 1.11 0.00 0.00 29.97 31.62 3gm5 h ARG 108 CO -0.56 0.82 -0.04 -0.22 0.10 0.00 0.00 179.97 180.07 3gm5 h LYS 109 N 0.17 0.59 0.00 0.08 3.11 -0.72 -0.89 116.57 118.90 3gm5 h LYS 109 Ca -0.01 -0.21 -0.04 0.00 -2.81 0.00 0.00 60.65 57.58 3gm5 h LYS 109 Cb 1.20 -0.04 -0.01 0.00 -1.00 0.00 0.00 32.23 32.38 3gm5 h LYS 109 CO 0.10 0.74 -0.19 0.28 -2.81 0.00 0.00 179.45 177.58 3gm5 h VAL 110 N 0.37 1.10 0.16 2.00 2.07 -0.63 -1.94 116.25 119.39 3gm5 h VAL 110 Ca 0.09 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 3gm5 h VAL 110 Cb 0.50 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 3gm5 h VAL 110 CO 0.02 0.18 -0.08 -0.08 0.02 0.00 0.00 177.57 177.64 3gm5 h GLU 111 N 0.00 -0.21 -0.51 1.57 4.81 -0.48 -0.70 114.58 119.05 3gm5 h GLU 111 Ca -0.00 0.01 0.10 0.00 -0.13 0.00 0.00 59.36 59.35 3gm5 h GLU 111 Cb 0.34 0.05 -0.10 0.00 0.63 0.00 0.00 28.75 29.67 3gm5 h GLU 111 CO 0.02 0.02 -0.13 0.93 -0.73 0.00 0.00 179.01 179.12 3gm5 h GLU 112 N -0.42 -0.01 -0.25 1.92 5.08 -0.53 -0.43 114.58 119.94 3gm5 h GLU 112 Ca -0.02 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 3gm5 h GLU 112 Cb 0.33 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3gm5 h GLU 112 CO 0.04 -0.00 -0.11 -0.07 -1.00 0.00 0.00 179.01 177.87 3gm5 h LEU 113 N -0.01 0.39 -0.46 1.33 3.38 -1.23 -1.51 115.31 117.21 3gm5 h LEU 113 Ca 0.25 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 3gm5 h LEU 113 Cb 0.38 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 3gm5 h LEU 113 CO -0.53 0.54 0.19 1.88 0.09 0.00 0.00 178.44 180.60 3gm5 h TYR 114 N 0.39 0.69 0.00 1.13 0.05 0.41 0.18 116.97 119.82 3gm5 h TYR 114 Ca 0.08 -0.05 -0.02 0.00 0.05 0.00 0.00 58.73 58.79 3gm5 h TYR 114 Cb 0.43 -0.21 -0.00 0.00 1.01 0.00 0.00 36.73 37.96 3gm5 h TYR 114 CO 0.01 0.59 -0.08 0.00 -1.05 0.00 0.00 178.16 177.63 3gm5 h ARG 115 N 0.60 0.00 -0.28 4.88 3.08 -0.58 0.88 114.38 122.96 3gm5 h ARG 115 Ca 0.15 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.20 3gm5 h ARG 115 Cb 0.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.23 3gm5 h ARG 115 CO -0.01 0.08 0.00 1.63 -1.07 0.00 0.00 179.97 180.59 3gm5 n LYS 116 N -3.67 1.75 -1.00 0.04 5.02 -0.62 -4.90 118.16 114.77 3gm5 n LYS 116 Ca -0.02 -1.15 0.00 0.00 -2.02 0.00 0.00 58.31 55.12 3gm5 n LYS 116 Cb 0.19 -1.31 0.00 0.00 -0.02 0.00 0.00 35.03 33.89 3gm5 n LYS 116 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3gm5 n GLY 117 N 1.06 0.55 2.56 0.72 0.00 0.30 -5.05 105.19 105.33 3gm5 n GLY 117 Ca 0.13 -0.84 -0.13 0.00 0.00 0.00 0.00 46.02 45.17 3gm5 n GLY 117 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3gm5 n MET 118 N -2.37 0.55 -3.60 1.61 2.81 0.54 -4.99 117.12 111.67 3gm5 n MET 118 Ca 0.00 -1.96 -0.16 0.00 -1.81 0.00 0.00 57.70 53.76 3gm5 n MET 118 Cb 0.10 -0.24 -0.07 0.00 -0.71 0.00 0.00 33.22 32.29 3gm5 n MET 118 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 3gm5 s LYS 119 N -3.86 0.92 -0.19 0.03 2.20 -1.26 -4.52 119.74 113.06 3gm5 s LYS 119 Ca 0.41 0.20 -0.24 0.00 -0.36 0.00 0.00 55.97 55.98 3gm5 s LYS 119 Cb -0.03 0.43 -0.02 0.00 -1.51 0.00 0.00 37.83 36.71 3gm5 s LYS 119 CO 0.26 -0.27 0.78 0.08 -0.36 0.00 0.00 175.35 175.84 3gm5 s VAL 120 N -1.07 4.91 -0.12 4.02 1.01 -1.26 -0.77 120.40 127.12 3gm5 s VAL 120 Ca -0.11 1.50 0.19 0.00 0.00 0.00 0.00 61.98 63.57 3gm5 s VAL 120 Cb -0.02 -4.08 -0.23 0.00 0.00 0.00 0.00 36.38 32.05 3gm5 s VAL 120 CO 0.08 0.03 0.51 2.30 0.00 0.00 0.00 175.10 178.01 3gm5 n ILE 121 N 4.85 0.78 -3.66 2.22 -6.64 0.61 -4.83 119.36 112.70 3gm5 n ILE 121 Ca 0.03 -0.66 -0.14 0.00 -1.77 0.00 0.00 62.75 60.21 3gm5 n ILE 121 Cb 0.49 -0.37 -0.08 0.00 -1.44 0.00 0.00 39.64 38.24 3gm5 n ILE 121 CO 0.00 0.00 0.00 -1.58 -1.77 0.00 0.00 176.55 173.20 3gm5 s GLN 122 N -3.05 0.73 0.13 6.28 0.74 -1.23 -0.90 119.66 122.36 3gm5 s GLN 122 Ca -0.07 0.87 -0.09 0.00 0.05 0.00 0.00 55.36 56.13 3gm5 s GLN 122 Cb 0.10 0.35 -0.00 0.00 1.10 0.00 0.00 33.01 34.56 3gm5 s GLN 122 CO 0.85 -0.09 0.25 -1.59 -0.55 0.00 0.00 175.29 174.16 3gm5 s LYS 123 N 0.35 1.01 0.00 1.67 -2.85 -0.89 0.05 119.74 119.09 3gm5 s LYS 123 Ca -0.00 -1.06 0.00 0.00 -1.00 0.00 0.00 55.97 53.91 3gm5 s LYS 123 Cb -0.04 0.36 0.00 0.00 -2.06 0.00 0.00 37.83 36.09 3gm5 s LYS 123 CO 0.01 -0.35 0.00 0.41 0.10 0.00 0.00 175.35 175.51 3gm5 n GLY 124 N -0.15 -1.52 3.59 0.59 0.00 -1.08 -1.58 105.19 105.05 3gm5 n GLY 124 Ca -0.11 -1.06 -0.24 0.00 0.00 0.00 0.00 46.02 44.61 3gm5 n GLY 124 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3gm5 s ASP 125 N -0.75 4.13 0.17 1.61 1.01 0.70 -1.52 116.67 122.02 3gm5 s ASP 125 Ca 0.00 -0.89 -0.08 0.00 0.71 0.00 0.00 52.55 52.29 3gm5 s ASP 125 Cb 0.00 -0.57 -0.01 0.00 1.01 0.00 0.00 42.92 43.35 3gm5 s ASP 125 CO 0.00 -0.08 0.27 0.72 0.21 0.00 0.00 175.17 176.29 3gm5 s PHE 126 N -2.45 0.46 -0.17 4.23 -0.12 -0.47 -4.31 117.98 115.13 3gm5 s PHE 126 Ca 0.32 -0.82 -0.29 0.00 -0.05 0.00 0.00 56.93 56.10 3gm5 s PHE 126 Cb -0.04 -0.09 -0.05 0.00 -0.63 0.00 0.00 43.02 42.21 3gm5 s PHE 126 CO 0.18 -0.71 2.06 -1.21 -0.05 0.00 0.00 175.22 175.49 3gm5 s GLU 127 N -3.98 3.45 0.00 1.99 0.41 -1.26 -1.70 118.70 117.61 3gm5 s GLU 127 Ca 0.19 2.07 0.00 0.00 -0.41 0.00 0.00 54.97 56.82 3gm5 s GLU 127 Cb 0.04 -4.27 0.00 0.00 -1.78 0.00 0.00 34.13 28.11 3gm5 s GLU 127 CO 0.01 -1.73 0.00 0.41 -0.49 0.00 0.00 175.26 173.45 3gm5 n GLY 128 N 5.33 0.91 0.00 -1.39 0.00 -1.26 -5.02 105.19 103.76 3gm5 n GLY 128 Ca 0.26 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.25 3gm5 n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gm5 n GLY 129 N -2.18 -0.76 3.53 -0.02 0.00 -0.69 -1.91 105.19 103.17 3gm5 n GLY 129 Ca 0.00 -0.93 -0.09 0.00 0.00 0.00 0.00 46.02 44.99 3gm5 n GLY 129 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3gm5 s ARG 130 N -1.13 1.45 0.16 1.61 1.70 -0.31 -1.37 118.95 121.06 3gm5 s ARG 130 Ca 0.00 -1.17 -0.07 0.00 -0.47 0.00 0.00 55.73 54.02 3gm5 s ARG 130 Cb 0.00 0.46 -0.02 0.00 -0.57 0.00 0.00 34.95 34.83 3gm5 s ARG 130 CO 0.00 -0.60 0.24 1.52 -1.08 0.00 0.00 175.30 175.38 3gm5 s TYR 131 N -3.99 0.55 -0.22 5.89 -0.85 -0.58 -1.19 117.35 116.97 3gm5 s TYR 131 Ca 0.19 -0.91 -0.08 0.00 -0.52 0.00 0.00 57.07 55.76 3gm5 s TYR 131 Cb -0.00 -0.17 0.09 0.00 0.38 0.00 0.00 41.96 42.26 3gm5 s TYR 131 CO 0.06 -0.69 0.47 0.00 -1.52 0.00 0.00 175.55 173.87 3gm5 s ALA 132 N -4.00 -1.33 -0.10 9.51 0.00 -0.58 -2.64 121.76 122.63 3gm5 s ALA 132 Ca 0.21 1.69 -0.20 0.00 0.00 0.00 0.00 51.96 53.65 3gm5 s ALA 132 Cb 0.04 -1.36 -0.04 0.00 0.00 0.00 0.00 23.12 21.76 3gm5 s ALA 132 CO 0.02 -0.71 0.57 0.71 0.00 0.00 0.00 175.76 176.35 3gm5 s TYR 133 N 2.48 3.54 0.01 0.00 2.02 0.11 -0.64 117.35 124.87 3gm5 s TYR 133 Ca -0.04 1.05 -0.01 0.00 -0.37 0.00 0.00 57.07 57.69 3gm5 s TYR 133 Cb -0.11 -2.66 -0.04 0.00 -0.40 0.00 0.00 41.96 38.75 3gm5 s TYR 133 CO -0.14 0.13 0.17 0.42 -1.57 0.00 0.00 175.55 174.56 3gm5 s ILE 134 N 0.70 5.29 -1.18 2.71 -1.09 0.10 -0.28 121.20 127.45 3gm5 s ILE 134 Ca 0.31 -0.28 -0.08 0.00 -2.23 0.00 0.00 60.65 58.37 3gm5 s ILE 134 Cb -0.16 -3.50 -0.11 0.00 -1.58 0.00 0.00 42.46 37.11 3gm5 s ILE 134 CO 0.14 0.28 2.87 -0.90 -1.23 0.00 0.00 174.94 176.09 3gm5 n ASP 135 N 0.80 7.27 -0.54 3.58 5.75 0.05 -4.04 116.55 129.42 3gm5 n ASP 135 Ca -0.10 -2.49 0.13 0.00 -0.01 0.00 0.00 54.79 52.33 3gm5 n ASP 135 Cb 0.52 -1.42 0.32 0.00 -1.03 0.00 0.00 41.12 39.52 3gm5 n ASP 135 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3gm5 n THR 136 N 3.51 0.00 -0.23 2.12 -2.24 -1.26 -4.56 114.28 111.62 3gm5 n THR 136 Ca 0.65 -0.28 0.01 0.00 -2.27 0.00 0.00 64.05 62.16 3gm5 n THR 136 Cb 0.32 0.81 0.13 0.00 -2.10 0.00 0.00 70.33 69.49 3gm5 n THR 136 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3gm5 h LEU 137 N 2.65 0.34 -0.45 3.22 5.85 -1.79 0.23 115.31 125.36 3gm5 h LEU 137 Ca 0.00 0.07 -0.12 0.00 0.84 0.00 0.00 57.88 58.67 3gm5 h LEU 137 Cb 0.65 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 3gm5 h LEU 137 CO 0.00 0.19 -0.17 0.03 -0.34 0.00 0.00 178.44 178.15 3gm5 h ARG 138 N 0.50 0.92 0.20 1.25 3.08 -1.89 -0.57 114.38 117.86 3gm5 h ARG 138 Ca 0.34 -0.38 -0.34 0.00 0.07 0.00 0.00 59.98 59.67 3gm5 h ARG 138 Cb 0.39 -0.04 0.02 0.00 0.08 0.00 0.00 29.97 30.42 3gm5 h ARG 138 CO -0.29 1.04 -1.60 0.00 -1.07 0.00 0.00 179.97 178.04 3gm5 h ALA 139 N 0.86 0.06 0.00 0.04 0.00 -1.80 -3.38 119.26 115.04 3gm5 h ALA 139 Ca 0.11 -1.03 0.00 0.00 0.00 0.00 0.00 54.91 53.99 3gm5 h ALA 139 Cb 0.74 0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3gm5 h ALA 139 CO 0.06 0.93 -1.00 1.28 0.00 0.00 0.00 179.25 180.52 3gm5 n LEU 140 N -3.61 0.88 0.00 0.00 4.77 0.77 -4.97 117.00 114.85 3gm5 n LEU 140 Ca -0.20 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.38 3gm5 n LEU 140 Cb 1.08 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 42.14 3gm5 n LEU 140 CO 0.55 0.22 0.00 0.29 -1.33 0.00 0.00 177.39 177.11 3gm5 n LYS 141 N -1.55 -0.38 -3.47 3.23 4.76 -0.22 -4.96 118.16 115.56 3gm5 n LYS 141 Ca 0.04 0.10 -0.14 0.00 -2.87 0.00 0.00 58.31 55.43 3gm5 n LYS 141 Cb 0.35 -3.38 -0.04 0.00 -1.84 0.00 0.00 35.03 30.12 3gm5 n LYS 141 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3gm5 s VAL 142 N -2.06 0.00 -0.10 -0.18 0.11 -1.25 -4.98 120.40 111.94 3gm5 s VAL 142 Ca 0.00 -0.03 -0.23 0.00 -2.93 0.00 0.00 61.98 58.79 3gm5 s VAL 142 Cb 0.00 -1.00 -0.03 0.00 -1.53 0.00 0.00 36.38 33.82 3gm5 s VAL 142 CO 0.00 -0.02 0.69 -0.32 -3.33 0.00 0.00 175.10 172.12 3gm5 s MET 143 N -2.75 4.38 -0.13 1.54 1.75 -1.26 -3.39 119.30 119.45 3gm5 s MET 143 Ca -0.04 0.83 -0.09 0.00 -1.25 0.00 0.00 55.69 55.14 3gm5 s MET 143 Cb -0.01 -3.48 -0.04 0.00 2.84 0.00 0.00 34.83 34.14 3gm5 s MET 143 CO -0.04 -0.02 0.17 0.42 -0.65 0.00 0.00 175.02 174.91 3gm5 s ILE 144 N 1.11 5.43 0.03 10.11 -1.09 -1.26 -1.75 121.20 133.77 3gm5 s ILE 144 Ca 0.36 0.29 0.08 0.00 -2.23 0.00 0.00 60.65 59.15 3gm5 s ILE 144 Cb -0.17 -3.46 -0.02 0.00 -1.58 0.00 0.00 42.46 37.22 3gm5 s ILE 144 CO 0.16 0.56 -0.24 -0.70 -1.23 0.00 0.00 174.94 173.49 3gm5 s GLU 145 N -0.63 1.69 -0.10 2.79 2.12 -0.34 -0.72 118.70 123.50 3gm5 s GLU 145 Ca 0.14 -0.98 -0.02 0.00 0.36 0.00 0.00 54.97 54.47 3gm5 s GLU 145 Cb -0.12 -1.78 -0.03 0.00 0.26 0.00 0.00 34.13 32.45 3gm5 s GLU 145 CO 0.04 0.47 -0.01 -0.51 -0.54 0.00 0.00 175.26 174.70 3gm5 s LEU 146 N -1.03 3.48 -0.00 2.70 1.43 0.19 -1.49 118.68 123.96 3gm5 s LEU 146 Ca 0.10 0.07 0.07 0.00 -1.03 0.00 0.00 54.13 53.34 3gm5 s LEU 146 Cb -0.09 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 3gm5 s LEU 146 CO 0.01 0.33 -0.21 -0.76 0.23 0.00 0.00 176.35 175.95 3gm5 s LEU 147 N -0.60 2.07 -0.10 1.79 1.43 0.12 -1.53 118.68 121.86 3gm5 s LEU 147 Ca 0.10 -0.41 -0.00 0.00 -1.03 0.00 0.00 54.13 52.78 3gm5 s LEU 147 Cb -0.12 -1.07 0.02 0.00 0.03 0.00 0.00 46.19 45.05 3gm5 s LEU 147 CO 0.02 0.24 -0.07 -0.70 0.23 0.00 0.00 176.35 176.08 3gm5 s GLU 148 N -0.63 1.38 -0.21 1.70 2.12 -0.34 -0.12 118.70 122.61 3gm5 s GLU 148 Ca 0.08 -0.21 -0.06 0.00 0.36 0.00 0.00 54.97 55.14 3gm5 s GLU 148 Cb -0.08 -1.45 -0.03 0.00 0.26 0.00 0.00 34.13 32.83 3gm5 s GLU 148 CO -0.00 -0.23 0.02 -0.80 -0.54 0.00 0.00 175.26 173.71 3gm5 s ASN 149 N 1.60 4.99 0.00 -1.70 0.01 -1.26 -1.17 114.94 117.41 3gm5 s ASN 149 Ca 0.02 -0.17 0.19 0.00 -0.71 0.00 0.00 52.86 52.19 3gm5 s ASN 149 Cb -0.13 -1.86 1.14 0.00 0.41 0.00 0.00 41.25 40.81 3gm5 s ASN 149 CO -0.06 0.06 1.54 -1.22 -1.51 0.00 0.00 177.10 175.90