#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fz5 n ASN -1 N 0.00 0.83 -1.49 6.43 6.94 -1.26 -5.09 115.26 121.62 3fz5 n ASN -1 Ca 0.00 -0.58 0.00 0.00 -0.02 0.00 0.00 54.58 53.98 3fz5 n ASN -1 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 3fz5 n ASN -1 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3fz5 n ALA 0 N -3.00 2.14 -2.18 -2.53 0.00 -1.26 -5.01 120.51 108.67 3fz5 n ALA 0 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 3fz5 n ALA 0 Cb 0.00 -1.39 -0.06 0.00 0.00 0.00 0.00 19.45 18.00 3fz5 n ALA 0 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3fz5 s ASN 2 N 1.59 6.98 0.59 0.00 0.01 -1.26 -5.21 114.94 117.64 3fz5 s ASN 2 Ca 0.00 1.31 -0.11 0.00 -0.71 0.00 0.00 52.86 53.35 3fz5 s ASN 2 Cb 0.00 -2.38 -0.04 0.00 0.41 0.00 0.00 41.25 39.24 3fz5 s ASN 2 CO 0.00 0.06 1.00 -2.16 -1.51 0.00 0.00 177.10 174.48 3fz5 s PRO 3 N -1.96 3.63 -0.16 -0.60 0.04 -1.26 -4.61 135.00 130.08 3fz5 s PRO 3 Ca 0.41 0.71 -0.29 0.00 0.04 0.00 0.00 61.00 61.87 3fz5 s PRO 3 Cb -0.16 -2.12 -0.01 0.00 0.04 0.00 0.00 34.50 32.25 3fz5 s PRO 3 CO 0.20 -0.49 1.14 0.42 0.04 0.00 0.00 177.00 178.31 3fz5 s ILE 4 N -3.07 4.48 -0.12 0.56 1.01 -0.01 -4.58 121.20 119.47 3fz5 s ILE 4 Ca 0.55 1.78 -0.27 0.00 0.00 0.00 0.00 60.65 62.71 3fz5 s ILE 4 Cb -0.11 -4.15 -0.02 0.00 0.01 0.00 0.00 42.46 38.20 3fz5 s ILE 4 CO 0.50 -0.11 0.91 -1.61 0.00 0.00 0.00 174.94 174.63 3fz5 s GLU 5 N 3.01 4.38 -0.56 2.79 2.02 0.12 -0.64 118.70 129.81 3fz5 s GLU 5 Ca 0.50 1.20 -0.06 0.00 0.02 0.00 0.00 54.97 56.64 3fz5 s GLU 5 Cb -0.19 -3.54 0.15 0.00 0.10 0.00 0.00 34.13 30.64 3fz5 s GLU 5 CO 0.13 -0.28 0.41 0.12 0.02 0.00 0.00 175.26 175.66 3fz5 s PHE 6 N 1.92 3.49 -0.06 1.61 5.36 0.45 -1.26 117.98 129.49 3fz5 s PHE 6 Ca 0.44 -2.34 -0.18 0.00 -0.96 0.00 0.00 56.93 53.89 3fz5 s PHE 6 Cb -0.18 -3.37 -0.05 0.00 -0.34 0.00 0.00 43.02 39.09 3fz5 s PHE 6 CO 0.16 -0.93 0.48 -1.58 -1.46 0.00 0.00 175.22 171.90 3fz5 s TRP 7 N 0.60 3.61 0.22 10.12 0.52 0.17 -1.00 118.94 133.17 3fz5 s TRP 7 Ca 0.12 0.99 -0.21 0.00 0.02 0.00 0.00 56.10 57.01 3fz5 s TRP 7 Cb -0.21 -2.50 0.04 0.00 -1.15 0.00 0.00 33.47 29.65 3fz5 s TRP 7 CO -0.03 0.33 0.64 -0.59 0.02 0.00 0.00 176.95 177.32 3fz5 s PHE 8 N -0.01 -0.32 -0.10 -1.98 -0.12 -0.94 -0.43 117.98 114.08 3fz5 s PHE 8 Ca 0.26 -0.01 -0.00 0.00 -0.05 0.00 0.00 56.93 57.13 3fz5 s PHE 8 Cb -0.16 0.60 -0.02 0.00 -0.63 0.00 0.00 43.02 42.80 3fz5 s PHE 8 CO 0.13 -1.03 -0.09 0.34 -0.05 0.00 0.00 175.22 174.52 3fz5 s ASP 9 N -2.84 4.41 0.49 1.98 -1.08 -1.26 -0.99 116.67 117.38 3fz5 s ASP 9 Ca 0.07 -0.16 0.19 0.00 -0.52 0.00 0.00 52.55 52.13 3fz5 s ASP 9 Cb -0.03 -1.38 1.22 0.00 -1.46 0.00 0.00 42.92 41.27 3fz5 s ASP 9 CO -0.03 0.26 2.06 -0.26 0.52 0.00 0.00 175.17 177.72 3fz5 h PHE 10 N 5.99 0.00 -0.16 -5.34 -1.00 -1.92 -1.24 116.94 113.27 3fz5 h PHE 10 Ca -0.38 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.40 3fz5 h PHE 10 Cb 1.18 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.74 3fz5 h PHE 10 CO 0.53 0.13 0.00 0.43 -1.61 0.00 0.00 178.31 177.79 3fz5 n SER 11 N -4.17 1.22 -4.66 2.17 7.64 -1.26 -4.87 113.62 109.69 3fz5 n SER 11 Ca -0.02 -1.74 -0.42 0.00 1.01 0.00 0.00 58.87 57.69 3fz5 n SER 11 Cb 0.20 -0.10 -0.03 0.00 -1.01 0.00 0.00 64.21 63.27 3fz5 n SER 11 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3fz5 s SER 12 N -1.39 6.96 0.06 6.43 0.15 -0.47 -4.90 113.70 120.54 3fz5 s SER 12 Ca 0.26 1.19 -0.24 0.00 0.70 0.00 0.00 55.95 57.86 3fz5 s SER 12 Cb 0.14 -2.48 -0.16 0.00 -1.71 0.00 0.00 66.02 61.81 3fz5 s SER 12 CO 0.20 -0.52 1.61 1.23 1.20 0.00 0.00 173.24 176.96 3fz5 h GLY 13 N 8.96 -0.09 1.46 9.45 0.00 -1.89 -1.43 103.07 119.53 3fz5 h GLY 13 Ca -0.24 0.03 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 3fz5 h GLY 13 CO 0.89 -0.03 0.31 -0.97 0.00 0.00 0.00 176.54 176.74 3fz5 h TYR 14 N -0.20 0.69 -0.69 5.60 0.05 -1.93 -1.95 116.97 118.54 3fz5 h TYR 14 Ca -0.01 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.75 3fz5 h TYR 14 Cb 0.17 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 37.65 3fz5 h TYR 14 CO -0.04 0.47 0.32 0.00 -1.05 0.00 0.00 178.16 177.87 3fz5 h ALA 15 N 1.61 1.27 -0.56 3.88 0.00 -1.68 -2.20 119.26 121.58 3fz5 h ALA 15 Ca 0.19 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.99 3fz5 h ALA 15 Cb -0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.46 3fz5 h ALA 15 CO -0.03 0.56 0.32 0.35 0.00 0.00 0.00 179.25 180.45 3fz5 h PHE 16 N 0.98 0.60 -0.34 0.00 3.57 -0.48 0.08 116.94 121.36 3fz5 h PHE 16 Ca 0.24 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.69 3fz5 h PHE 16 Cb 0.11 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 3fz5 h PHE 16 CO 0.01 0.33 -0.07 0.74 -2.23 0.00 0.00 178.31 177.09 3fz5 h PHE 17 N 0.64 0.72 -0.94 0.41 0.04 -1.27 -2.42 116.94 114.11 3fz5 h PHE 17 Ca 0.23 -0.15 0.07 0.00 2.80 0.00 0.00 57.97 60.92 3fz5 h PHE 17 Cb 0.06 -0.18 -0.06 0.00 2.20 0.00 0.00 35.95 37.97 3fz5 h PHE 17 CO -0.07 0.80 0.61 0.00 -0.60 0.00 0.00 178.31 179.05 3fz5 h ALA 18 N 0.82 1.48 0.00 2.45 0.00 -1.21 -2.40 119.26 120.40 3fz5 h ALA 18 Ca 0.09 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3fz5 h ALA 18 Cb 0.56 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 3fz5 h ALA 18 CO 0.03 0.37 -0.16 0.00 0.00 0.00 0.00 179.25 179.48 3fz5 h ALA 19 N 1.50 1.72 0.00 0.00 0.00 -0.50 0.34 119.26 122.32 3fz5 h ALA 19 Ca 0.41 -0.15 -0.14 0.00 0.00 0.00 0.00 54.91 55.03 3fz5 h ALA 19 Cb 0.21 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3fz5 h ALA 19 CO -0.16 0.21 -0.65 1.96 0.00 0.00 0.00 179.25 180.61 3fz5 h GLN 20 N 0.00 0.00 0.00 0.00 1.08 -1.11 -3.36 115.11 111.72 3fz5 h GLN 20 Ca -0.00 0.00 -0.22 0.00 -1.45 0.00 0.00 58.65 56.98 3fz5 h GLN 20 Cb 0.29 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 27.68 3fz5 h GLN 20 CO 0.02 0.65 -2.15 -2.13 -0.95 0.00 0.00 178.83 174.27 3fz5 n ARG 21 N -3.58 0.67 0.22 1.46 3.00 -0.68 -4.83 116.66 112.93 3fz5 n ARG 21 Ca -0.00 -0.05 -0.15 0.00 -0.00 0.00 0.00 57.85 57.65 3fz5 n ARG 21 Cb 0.68 -1.55 -0.08 0.00 0.00 0.00 0.00 32.46 31.51 3fz5 n ARG 21 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.63 178.60 3fz5 h ILE 22 N 0.00 0.60 -0.75 5.15 6.09 -1.11 -1.43 117.51 126.06 3fz5 h ILE 22 Ca -0.31 -0.26 0.05 0.00 -1.37 0.00 0.00 64.86 62.97 3fz5 h ILE 22 Cb 1.73 0.73 -0.05 0.00 0.47 0.00 0.00 36.82 39.70 3fz5 h ILE 22 CO 0.02 0.05 0.45 -0.33 -3.07 0.00 0.00 178.15 175.27 3fz5 h GLU 23 N -0.69 0.83 -0.31 2.19 4.39 -1.86 -0.86 114.58 118.27 3fz5 h GLU 23 Ca -0.06 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 3fz5 h GLU 23 Cb 0.49 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 3fz5 h GLU 23 CO 0.09 0.55 0.14 0.00 -1.16 0.00 0.00 179.01 178.63 3fz5 h ALA 24 N 1.35 0.40 -0.32 3.43 0.00 -1.85 -0.95 119.26 121.33 3fz5 h ALA 24 Ca 0.32 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3fz5 h ALA 24 Cb 0.11 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3fz5 h ALA 24 CO -0.15 -0.02 0.20 1.25 0.00 0.00 0.00 179.25 180.53 3fz5 h LEU 25 N 0.36 0.37 -0.26 0.00 5.85 -0.82 -0.35 115.31 120.47 3fz5 h LEU 25 Ca 0.11 -0.03 0.03 0.00 0.84 0.00 0.00 57.88 58.82 3fz5 h LEU 25 Cb 0.14 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 3fz5 h LEU 25 CO -0.01 0.29 0.08 0.00 -0.34 0.00 0.00 178.44 178.46 3fz5 h ALA 26 N 1.09 0.28 -0.73 1.25 0.00 -1.13 -0.24 119.26 119.78 3fz5 h ALA 26 Ca 0.11 0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.15 3fz5 h ALA 26 Cb -0.02 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 3fz5 h ALA 26 CO -0.02 -0.34 0.48 0.00 0.00 0.00 0.00 179.25 179.37 3fz5 h ALA 27 N 1.17 1.82 -0.38 0.00 0.00 -0.80 0.37 119.26 121.44 3fz5 h ALA 27 Ca 0.11 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 3fz5 h ALA 27 Cb 0.09 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3fz5 h ALA 27 CO -0.13 0.04 -0.25 1.49 0.00 0.00 0.00 179.25 180.40 3fz5 h GLU 28 N 0.65 0.77 -0.01 0.00 4.57 -0.42 -3.12 114.58 117.02 3fz5 h GLU 28 Ca 0.33 -0.32 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 3fz5 h GLU 28 Cb 0.43 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.00 3fz5 h GLU 28 CO -0.12 0.94 0.00 1.28 -1.18 0.00 0.00 179.01 179.93 3fz5 n LEU 29 N -4.10 1.12 -1.79 1.64 4.77 0.13 -4.92 117.00 113.85 3fz5 n LEU 29 Ca -0.00 -0.37 -0.13 0.00 -0.03 0.00 0.00 56.01 55.47 3fz5 n LEU 29 Cb 0.45 -0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.55 3fz5 n LEU 29 CO 0.45 0.19 -0.04 0.61 -1.33 0.00 0.00 177.39 177.27 3fz5 n GLY 30 N 1.13 -0.06 3.45 -0.72 0.00 0.94 -4.97 105.19 104.95 3fz5 n GLY 30 Ca 0.20 -0.27 -0.27 0.00 0.00 0.00 0.00 46.02 45.69 3fz5 n GLY 30 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3fz5 s ARG 31 N -5.09 1.60 0.58 1.61 1.81 0.84 -4.96 118.95 115.34 3fz5 s ARG 31 Ca 0.14 -1.47 0.01 0.00 -1.72 0.00 0.00 55.73 52.69 3fz5 s ARG 31 Cb -0.06 -1.90 0.04 0.00 -0.45 0.00 0.00 34.95 32.58 3fz5 s ARG 31 CO 0.17 0.41 0.81 0.95 -0.68 0.00 0.00 175.30 176.96 3fz5 s THR 32 N -1.62 2.59 -0.09 0.02 -4.23 -1.26 -3.78 115.64 107.27 3fz5 s THR 32 Ca 0.21 -0.63 0.02 0.00 -1.18 0.00 0.00 61.69 60.10 3fz5 s THR 32 Cb -0.08 -2.96 0.02 0.00 1.34 0.00 0.00 72.50 70.82 3fz5 s THR 32 CO 0.10 0.00 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.37 3fz5 s VAL 33 N -2.83 1.20 -0.36 2.29 1.01 -1.26 -0.83 120.40 119.62 3fz5 s VAL 33 Ca 0.58 -0.48 -0.12 0.00 0.00 0.00 0.00 61.98 61.96 3fz5 s VAL 33 Cb -0.10 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 35.17 3fz5 s VAL 33 CO 0.39 0.38 0.23 -0.22 0.00 0.00 0.00 175.10 175.88 3fz5 s LEU 34 N 0.95 4.64 -0.11 3.92 2.96 0.18 -4.94 118.68 126.28 3fz5 s LEU 34 Ca -0.09 -0.70 -0.26 0.00 -0.22 0.00 0.00 54.13 52.86 3fz5 s LEU 34 Cb -0.15 -2.09 -0.02 0.00 0.50 0.00 0.00 46.19 44.43 3fz5 s LEU 34 CO 0.00 -0.32 0.84 0.26 -1.32 0.00 0.00 176.35 175.81 3fz5 s TRP 35 N 1.65 3.50 -0.38 5.38 0.52 -1.26 -0.41 118.94 127.94 3fz5 s TRP 35 Ca 0.05 1.36 0.01 0.00 0.02 0.00 0.00 56.10 57.53 3fz5 s TRP 35 Cb -0.18 -3.00 0.14 0.00 -1.15 0.00 0.00 33.47 29.28 3fz5 s TRP 35 CO 0.09 -0.13 0.22 1.03 0.02 0.00 0.00 176.95 178.18 3fz5 s ARG 36 N 1.66 0.82 0.40 4.98 1.81 -0.17 -4.95 118.95 123.49 3fz5 s ARG 36 Ca 0.41 -1.59 -0.24 0.00 -1.72 0.00 0.00 55.73 52.59 3fz5 s ARG 36 Cb -0.18 -1.68 -0.09 0.00 -0.45 0.00 0.00 34.95 32.56 3fz5 s ARG 36 CO 0.17 -1.20 1.07 -1.25 -0.68 0.00 0.00 175.30 173.41 3fz5 s PRO 37 N 0.79 4.16 0.00 3.54 0.04 -1.26 -2.21 135.00 140.07 3fz5 s PRO 37 Ca 0.18 1.57 0.00 0.00 0.04 0.00 0.00 61.00 62.79 3fz5 s PRO 37 Cb -0.23 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.73 3fz5 s PRO 37 CO 0.00 -0.16 0.00 2.48 0.04 0.00 0.00 177.00 179.37 3fz5 n TYR 38 N -0.01 0.00 -2.82 0.56 -0.00 -0.16 -4.85 117.16 109.88 3fz5 n TYR 38 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.95 3fz5 n TYR 38 Cb 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.83 3fz5 n TYR 38 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 176.86 178.33 3fz5 n LEU 40 N 0.00 0.00 -3.18 -3.48 -0.00 -1.26 -4.25 117.00 104.84 3fz5 n LEU 40 Ca 0.00 0.00 0.05 0.00 -0.00 0.00 0.00 56.01 56.06 3fz5 n LEU 40 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.40 3fz5 n LEU 40 CO 0.00 0.00 0.66 -0.83 -0.00 0.00 0.00 177.39 177.22 3fz5 s GLY 41 N -3.69 -0.21 0.19 1.47 0.00 -1.26 -4.49 107.32 99.34 3fz5 s GLY 41 Ca 0.00 2.98 0.00 0.00 0.00 0.00 0.00 44.72 47.70 3fz5 s GLY 41 CO 0.00 3.74 0.00 1.47 0.00 0.00 0.00 173.10 178.31 3fz5 n LEU 52 N 5.33 -1.30 0.00 0.66 -0.00 -1.26 -4.92 117.00 115.50 3fz5 n LEU 52 Ca -0.08 1.06 0.00 0.00 -0.00 0.00 0.00 56.01 56.99 3fz5 n LEU 52 Cb 0.54 -0.40 0.00 0.00 -0.00 0.00 0.00 43.42 43.56 3fz5 n LEU 52 CO -0.10 0.09 0.00 -0.24 -0.00 0.00 0.00 177.39 177.14 3fz5 n SER 53 N -1.10 0.03 -2.77 1.45 2.88 -1.26 -4.81 113.62 108.03 3fz5 n SER 53 Ca 0.00 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.36 3fz5 n SER 53 Cb 0.02 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.49 3fz5 n SER 53 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3fz5 n SER 54 N 0.00 -4.53 0.16 -3.46 7.64 -1.26 -4.89 113.62 107.28 3fz5 n SER 54 Ca 0.00 -0.07 0.12 0.00 1.01 0.00 0.00 58.87 59.93 3fz5 n SER 54 Cb 0.00 -3.77 0.18 0.00 -1.01 0.00 0.00 64.21 59.61 3fz5 n SER 54 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 3fz5 h THR 55 N -0.50 0.00 -0.13 0.44 1.35 -1.98 -0.58 112.91 111.51 3fz5 h THR 55 Ca -0.40 -0.86 -0.04 0.00 -0.55 0.00 0.00 66.41 64.56 3fz5 h THR 55 Cb 1.28 1.71 -0.01 0.00 -1.73 0.00 0.00 68.15 69.40 3fz5 h THR 55 CO 0.47 0.00 -0.11 1.55 -0.25 0.00 0.00 175.52 177.17 3fz5 h PRO 56 N 0.00 0.20 -0.31 4.72 0.13 -1.99 -0.51 132.00 134.25 3fz5 h PRO 56 Ca 0.00 -0.04 -0.17 0.00 -0.87 0.00 0.00 66.00 64.92 3fz5 h PRO 56 Cb 0.93 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.03 3fz5 h PRO 56 CO 0.00 0.32 -0.46 -0.07 -0.23 0.00 0.00 178.00 177.56 3fz5 h LEU 57 N 0.19 0.94 -0.21 1.56 4.07 -1.73 -2.17 115.31 117.96 3fz5 h LEU 57 Ca 0.04 -0.51 -0.03 0.00 0.08 0.00 0.00 57.88 57.46 3fz5 h LEU 57 Cb 0.32 -0.27 -0.01 0.00 1.08 0.00 0.00 40.66 41.79 3fz5 h LEU 57 CO 0.02 1.27 0.00 0.11 -1.08 0.00 0.00 178.44 178.76 3fz5 h LYS 58 N 0.64 0.37 -0.83 1.13 1.57 -1.08 -1.51 116.57 116.86 3fz5 h LYS 58 Ca 0.03 -0.12 0.02 0.00 -1.87 0.00 0.00 60.65 58.71 3fz5 h LYS 58 Cb 1.07 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 33.30 3fz5 h LYS 58 CO 0.11 0.56 0.54 -0.09 -0.57 0.00 0.00 179.45 180.00 3fz5 h ARG 59 N 0.13 1.04 -0.59 3.15 9.65 -1.15 -0.34 114.38 126.28 3fz5 h ARG 59 Ca 0.06 -0.06 -0.06 0.00 -1.10 0.00 0.00 59.98 58.82 3fz5 h ARG 59 Cb 0.39 -0.24 -0.02 0.00 -1.39 0.00 0.00 29.97 28.71 3fz5 h ARG 59 CO 0.01 0.69 0.14 0.22 2.80 0.00 0.00 179.97 183.83 3fz5 h ASP 60 N 1.08 0.90 -0.34 -3.80 3.58 -1.30 -2.37 116.42 114.17 3fz5 h ASP 60 Ca 0.32 -0.23 -0.06 0.00 0.42 0.00 0.00 57.03 57.47 3fz5 h ASP 60 Cb -0.05 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.75 3fz5 h ASP 60 CO -0.09 0.90 -0.04 0.22 -2.88 0.00 0.00 179.24 177.35 3fz5 h TYR 61 N 0.86 0.70 -0.14 0.28 3.20 -0.76 -2.57 116.97 118.54 3fz5 h TYR 61 Ca 0.19 -0.14 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 3fz5 h TYR 61 Cb 0.35 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.43 3fz5 h TYR 61 CO 0.03 0.77 -0.11 0.00 -1.64 0.00 0.00 178.16 177.20 3fz5 h ALA 62 N 0.83 1.56 -0.02 1.82 0.00 -0.98 0.18 119.26 122.65 3fz5 h ALA 62 Ca 0.09 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3fz5 h ALA 62 Cb 0.52 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 3fz5 h ALA 62 CO 0.03 0.32 -0.02 0.37 0.00 0.00 0.00 179.25 179.94 3fz5 h GLN 63 N 0.21 0.04 -0.79 0.00 4.15 -1.35 0.29 115.11 117.66 3fz5 h GLN 63 Ca 0.04 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.45 3fz5 h GLN 63 Cb 0.33 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 27.98 3fz5 h GLN 63 CO 0.02 0.54 0.52 -0.09 -1.93 0.00 0.00 178.83 177.89 3fz5 h ARG 64 N -0.45 1.03 -0.24 1.69 2.43 -1.20 -2.26 114.38 115.38 3fz5 h ARG 64 Ca 0.00 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 3fz5 h ARG 64 Cb 0.53 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.84 3fz5 h ARG 64 CO 0.00 0.68 0.11 0.22 -1.51 0.00 0.00 179.97 179.47 3fz5 h ASP 65 N 1.06 0.32 -0.63 -3.80 3.58 -0.49 -1.56 116.42 114.90 3fz5 h ASP 65 Ca 0.30 -0.14 0.03 0.00 0.42 0.00 0.00 57.03 57.64 3fz5 h ASP 65 Cb -0.09 -0.08 -0.04 0.00 1.72 0.00 0.00 39.33 40.83 3fz5 h ASP 65 CO -0.07 0.37 0.38 -0.50 -2.88 0.00 0.00 179.24 176.53 3fz5 h TRP 66 N 0.25 0.70 -0.70 0.28 6.55 -0.78 -0.64 115.95 121.61 3fz5 h TRP 66 Ca 0.08 0.02 -0.06 0.00 0.95 0.00 0.00 58.89 59.88 3fz5 h TRP 66 Cb 0.14 -0.23 -0.03 0.00 -0.86 0.00 0.00 29.16 28.19 3fz5 h TRP 66 CO -0.02 0.39 0.19 0.00 -1.05 0.00 0.00 178.44 177.95 3fz5 h ALA 67 N 1.29 1.02 0.16 1.49 0.00 -1.28 -0.08 119.26 121.86 3fz5 h ALA 67 Ca 0.26 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3fz5 h ALA 67 Cb 0.06 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.58 3fz5 h ALA 67 CO -0.12 0.65 -0.07 -0.09 0.00 0.00 0.00 179.25 179.61 3fz5 h ARG 68 N 1.05 -0.20 -0.15 0.00 2.43 -0.87 -1.91 114.38 114.72 3fz5 h ARG 68 Ca 0.22 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.39 3fz5 h ARG 68 Cb 0.33 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.92 3fz5 h ARG 68 CO -0.00 -0.11 0.02 0.82 -1.51 0.00 0.00 179.97 179.18 3fz5 h ILE 69 N -0.24 1.23 -0.07 1.20 2.04 -0.95 -1.87 117.51 118.85 3fz5 h ILE 69 Ca -0.02 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 3fz5 h ILE 69 Cb 0.18 1.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.70 3fz5 h ILE 69 CO 0.04 0.22 0.02 0.00 0.00 0.00 0.00 178.15 178.42 3fz5 h ALA 70 N 0.79 1.90 0.01 1.87 0.00 -1.01 -2.70 119.26 120.13 3fz5 h ALA 70 Ca 0.04 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.76 3fz5 h ALA 70 Cb 0.32 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.09 3fz5 h ALA 70 CO 0.00 0.08 -0.63 -0.09 0.00 0.00 0.00 179.25 178.62 3fz5 h ARG 71 N 0.10 0.41 -0.16 0.00 2.43 -1.05 0.34 114.38 116.46 3fz5 h ARG 71 Ca 0.03 -0.45 -0.03 0.00 -0.81 0.00 0.00 59.98 58.72 3fz5 h ARG 71 Cb 0.04 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.71 3fz5 h ARG 71 CO -0.00 1.12 -0.02 0.37 -1.51 0.00 0.00 179.97 179.93 3fz5 h GLN 72 N -0.12 0.22 -0.07 0.20 4.15 -1.05 -2.97 115.11 115.48 3fz5 h GLN 72 Ca -0.08 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.31 3fz5 h GLN 72 Cb 1.35 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 29.00 3fz5 h GLN 72 CO 0.12 0.26 0.00 0.54 -1.93 0.00 0.00 178.83 177.83 3fz5 n ARG 73 N -4.38 1.50 -3.33 1.69 1.74 -1.04 -4.98 116.66 107.85 3fz5 n ARG 73 Ca -0.01 -1.59 -0.18 0.00 -0.77 0.00 0.00 57.85 55.30 3fz5 n ARG 73 Cb 0.18 -1.33 0.06 0.00 -1.02 0.00 0.00 32.46 30.35 3fz5 n ARG 73 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fz5 n GLY 74 N 0.96 -0.22 3.82 -0.13 0.00 -0.88 -5.01 105.19 103.72 3fz5 n GLY 74 Ca 0.11 0.05 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 3fz5 n GLY 74 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fz5 s LEU 75 N -5.89 4.02 -0.04 0.99 1.43 0.12 -5.03 118.68 114.27 3fz5 s LEU 75 Ca 0.39 0.14 -0.30 0.00 -1.03 0.00 0.00 54.13 53.34 3fz5 s LEU 75 Cb -0.17 -2.52 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 3fz5 s LEU 75 CO 0.57 0.22 1.27 -0.89 0.23 0.00 0.00 176.35 177.75 3fz5 s THR 76 N -1.34 4.09 -0.31 5.49 2.01 -1.26 -4.61 115.64 119.71 3fz5 s THR 76 Ca 0.28 1.43 -0.02 0.00 0.31 0.00 0.00 61.69 63.68 3fz5 s THR 76 Cb -0.12 -3.92 0.12 0.00 0.01 0.00 0.00 72.50 68.59 3fz5 s THR 76 CO 0.20 -0.01 0.17 0.12 -0.69 0.00 0.00 174.62 174.42 3fz5 s PHE 77 N 2.34 0.40 -0.39 4.92 5.36 -1.26 -4.84 117.98 124.52 3fz5 s PHE 77 Ca 0.58 -1.11 0.01 0.00 -0.96 0.00 0.00 56.93 55.45 3fz5 s PHE 77 Cb -0.27 -0.86 0.14 0.00 -0.34 0.00 0.00 43.02 41.69 3fz5 s PHE 77 CO 0.23 -0.84 0.22 0.50 -1.46 0.00 0.00 175.22 173.87 3fz5 s ARG 78 N 1.72 0.86 0.73 10.12 3.52 0.63 -5.02 118.95 131.52 3fz5 s ARG 78 Ca 0.13 -1.60 -0.12 0.00 -0.13 0.00 0.00 55.73 54.00 3fz5 s ARG 78 Cb -0.18 -1.74 0.04 0.00 -1.56 0.00 0.00 34.95 31.50 3fz5 s ARG 78 CO -0.22 -1.19 1.10 -1.25 -0.81 0.00 0.00 175.30 172.94 3fz5 s PRO 79 N 0.79 2.42 0.83 5.12 0.04 -1.26 -1.49 135.00 141.44 3fz5 s PRO 79 Ca 0.18 1.27 -0.12 0.00 0.04 0.00 0.00 61.00 62.37 3fz5 s PRO 79 Cb -0.24 -1.91 0.09 0.00 0.04 0.00 0.00 34.50 32.49 3fz5 s PRO 79 CO 0.00 -1.53 1.18 -1.25 0.04 0.00 0.00 177.00 175.44 3fz5 s PRO 80 N -4.58 1.57 0.18 0.56 0.04 -1.25 -4.73 135.00 126.78 3fz5 s PRO 80 Ca 0.64 1.64 -0.13 0.00 0.04 0.00 0.00 61.00 63.18 3fz5 s PRO 80 Cb -0.19 -1.78 0.08 0.00 0.04 0.00 0.00 34.50 32.65 3fz5 s PRO 80 CO 0.50 -2.24 1.81 0.00 0.04 0.00 0.00 177.00 177.12 3fz5 h ALA 81 N -1.13 0.72 -0.53 8.56 0.00 -1.98 -2.64 119.26 122.27 3fz5 h ALA 81 Ca -0.45 -0.07 -0.47 0.00 0.00 0.00 0.00 54.91 53.92 3fz5 h ALA 81 Cb 1.28 -0.23 -0.17 0.00 0.00 0.00 0.00 17.79 18.67 3fz5 h ALA 81 CO 0.46 0.20 0.39 -0.40 0.00 0.00 0.00 179.25 179.90 3fz5 n ASP 82 N -4.65 6.47 -4.79 0.00 5.75 -1.26 -4.97 116.55 113.11 3fz5 n ASP 82 Ca 0.03 -3.18 -0.36 0.00 -0.01 0.00 0.00 54.79 51.27 3fz5 n ASP 82 Cb 0.05 -1.20 -0.04 0.00 -1.03 0.00 0.00 41.12 38.90 3fz5 n ASP 82 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 3fz5 s HIS 83 N -1.73 3.21 -0.04 2.11 2.46 -1.00 -4.25 115.29 116.05 3fz5 s HIS 83 Ca 0.55 1.63 -0.12 0.00 0.47 0.00 0.00 55.06 57.58 3fz5 s HIS 83 Cb 0.36 -3.10 -0.05 0.00 -0.13 0.00 0.00 32.58 29.66 3fz5 s HIS 83 CO -0.18 -0.64 0.32 -1.25 -2.47 0.00 0.00 174.74 170.52 3fz5 s PRO 84 N -2.70 3.77 0.64 2.88 0.04 -1.26 -5.08 135.00 133.29 3fz5 s PRO 84 Ca 0.60 0.24 -0.14 0.00 0.04 0.00 0.00 61.00 61.74 3fz5 s PRO 84 Cb -0.20 -3.21 -0.01 0.00 0.04 0.00 0.00 34.50 31.12 3fz5 s PRO 84 CO 0.25 0.71 1.07 -1.01 0.04 0.00 0.00 177.00 178.07 3fz5 s HIS 85 N -1.05 2.89 -0.75 0.56 3.76 -1.26 -4.98 115.29 114.46 3fz5 s HIS 85 Ca 0.21 1.51 -0.20 0.00 -0.15 0.00 0.00 55.06 56.43 3fz5 s HIS 85 Cb -0.15 -3.03 0.10 0.00 1.11 0.00 0.00 32.58 30.61 3fz5 s HIS 85 CO 0.10 -1.33 0.97 0.08 -0.85 0.00 0.00 174.74 173.71 3fz5 s VAL 86 N -2.56 4.59 0.00 -0.90 1.01 -1.26 -4.68 120.40 116.60 3fz5 s VAL 86 Ca 0.63 -0.96 0.00 0.00 0.00 0.00 0.00 61.98 61.65 3fz5 s VAL 86 Cb -0.17 -4.68 0.00 0.00 0.00 0.00 0.00 36.38 31.54 3fz5 s VAL 86 CO 0.43 -1.40 1.15 0.00 0.00 0.00 0.00 175.10 175.27 3fz5 n ALA 87 N 6.95 2.87 -0.01 5.51 0.00 -1.26 -3.89 120.51 130.68 3fz5 n ALA 87 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.38 3fz5 n ALA 87 Cb 0.46 -1.18 -0.05 0.00 0.00 0.00 0.00 19.45 18.68 3fz5 n ALA 87 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3fz5 h LEU 88 N 2.52 0.14 -0.22 0.00 5.85 -1.90 -0.01 115.31 121.68 3fz5 h LEU 88 Ca 0.00 -0.05 0.04 0.00 0.84 0.00 0.00 57.88 58.71 3fz5 h LEU 88 Cb 0.71 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.67 3fz5 h LEU 88 CO 0.00 0.15 -0.03 0.00 -0.34 0.00 0.00 178.44 178.22 3fz5 h ALA 89 N 1.00 0.17 -0.61 1.25 0.00 -1.76 0.71 119.26 120.01 3fz5 h ALA 89 Ca 0.04 0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 3fz5 h ALA 89 Cb 0.03 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3fz5 h ALA 89 CO -0.01 -0.46 0.01 0.00 0.00 0.00 0.00 179.25 178.79 3fz5 h ALA 90 N 1.21 0.82 -0.33 0.00 0.00 -1.34 -0.99 119.26 118.63 3fz5 h ALA 90 Ca 0.11 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 3fz5 h ALA 90 Cb 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3fz5 h ALA 90 CO -0.21 0.66 0.06 1.15 0.00 0.00 0.00 179.25 180.90 3fz5 h THR 91 N 0.97 1.23 -0.85 0.00 2.02 -0.73 -1.28 112.91 114.27 3fz5 h THR 91 Ca 0.17 -0.82 0.01 0.00 0.77 0.00 0.00 66.41 66.55 3fz5 h THR 91 Cb 0.55 1.13 -0.04 0.00 -1.74 0.00 0.00 68.15 68.05 3fz5 h THR 91 CO 0.03 0.27 0.56 0.03 0.37 0.00 0.00 175.52 176.78 3fz5 h ARG 92 N 0.38 1.10 -0.45 6.66 3.08 -0.71 -2.22 114.38 122.22 3fz5 h ARG 92 Ca 0.10 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 3fz5 h ARG 92 Cb 0.35 -0.25 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 3fz5 h ARG 92 CO 0.01 0.73 0.12 0.00 -1.07 0.00 0.00 179.97 179.75 3fz5 h ALA 93 N 1.32 1.36 -0.52 0.04 0.00 -0.94 -2.18 119.26 118.35 3fz5 h ALA 93 Ca 0.32 -0.17 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3fz5 h ALA 93 Cb -0.10 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.47 3fz5 h ALA 93 CO -0.08 0.46 0.30 0.35 0.00 0.00 0.00 179.25 180.28 3fz5 h PHE 94 N 0.65 0.55 0.00 0.00 3.57 -0.60 -1.94 116.94 119.18 3fz5 h PHE 94 Ca 0.15 0.02 -0.15 0.00 3.53 0.00 0.00 57.97 61.52 3fz5 h PHE 94 Cb 0.23 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.78 3fz5 h PHE 94 CO 0.01 0.30 -0.71 1.88 -2.23 0.00 0.00 178.31 177.57 3fz5 h TYR 95 N 0.59 0.00 -0.55 0.41 0.05 -1.39 -0.33 116.97 115.74 3fz5 h TYR 95 Ca 0.22 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.97 3fz5 h TYR 95 Cb 0.06 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.77 3fz5 h TYR 95 CO -0.08 0.70 0.25 2.35 -1.05 0.00 0.00 178.16 180.33 3fz5 h TRP 96 N 0.00 0.80 -0.09 4.88 7.01 -1.22 -2.10 115.95 125.23 3fz5 h TRP 96 Ca -0.01 -0.05 -0.05 0.00 2.11 0.00 0.00 58.89 60.90 3fz5 h TRP 96 Cb 1.54 -0.25 -0.00 0.00 -2.10 0.00 0.00 29.16 28.35 3fz5 h TRP 96 CO 0.00 0.63 -0.12 0.82 -2.79 0.00 0.00 178.44 176.98 3fz5 h ILE 97 N 0.74 1.38 -0.51 2.65 2.04 -1.23 -3.14 117.51 119.43 3fz5 h ILE 97 Ca 0.19 -1.33 0.10 0.00 1.00 0.00 0.00 64.86 64.82 3fz5 h ILE 97 Cb 0.14 2.04 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 3fz5 h ILE 97 CO -0.02 0.38 0.35 -0.08 0.00 0.00 0.00 178.15 178.78 3fz5 h GLU 98 N -0.18 0.24 -0.59 2.37 4.81 -1.03 0.46 114.58 120.66 3fz5 h GLU 98 Ca 0.01 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.31 3fz5 h GLU 98 Cb 0.67 -0.05 -0.06 0.00 0.63 0.00 0.00 28.75 29.93 3fz5 h GLU 98 CO 0.03 0.16 0.24 0.00 -0.73 0.00 0.00 179.01 178.71 3fz5 h ALA 99 N 1.74 0.76 0.20 2.92 0.00 -1.32 -3.10 119.26 120.47 3fz5 h ALA 99 Ca 0.24 0.06 -0.33 0.00 0.00 0.00 0.00 54.91 54.88 3fz5 h ALA 99 Cb 0.61 0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.44 3fz5 h ALA 99 CO -0.05 -0.15 -1.60 1.96 0.00 0.00 0.00 179.25 179.40 3fz5 h GLN 100 N 0.45 0.42 -1.50 0.00 4.20 -0.99 -3.46 115.11 114.23 3fz5 h GLN 100 Ca 0.29 -0.72 0.01 0.00 0.06 0.00 0.00 58.65 58.28 3fz5 h GLN 100 Cb 0.31 0.27 -0.24 0.00 0.30 0.00 0.00 27.48 28.13 3fz5 h GLN 100 CO -0.26 1.35 -0.31 0.45 -0.67 0.00 0.00 178.83 179.38 3fz5 s SER 101 N -7.35 -0.83 0.16 1.46 0.15 0.14 -5.04 113.70 102.38 3fz5 s SER 101 Ca -0.14 0.82 -0.15 0.00 0.70 0.00 0.00 55.95 57.17 3fz5 s SER 101 Cb 0.05 1.85 0.03 0.00 -1.71 0.00 0.00 66.02 66.23 3fz5 s SER 101 CO 0.87 -0.26 1.81 -0.65 1.20 0.00 0.00 173.24 176.21 3fz5 h PRO 102 N 8.06 0.59 -0.71 5.44 0.11 -1.78 -1.07 132.00 142.65 3fz5 h PRO 102 Ca -0.21 -0.04 0.10 0.00 0.11 0.00 0.00 66.00 65.95 3fz5 h PRO 102 Cb 1.15 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 32.05 3fz5 h PRO 102 CO 0.23 0.41 0.35 -0.44 -0.21 0.00 0.00 178.00 178.34 3fz5 h ASP 103 N 0.60 0.44 -0.24 -2.05 3.32 -1.95 0.66 116.42 117.20 3fz5 h ASP 103 Ca 0.16 0.06 -0.04 0.00 0.02 0.00 0.00 57.03 57.23 3fz5 h ASP 103 Cb -0.04 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.48 3fz5 h ASP 103 CO -0.03 0.25 0.03 0.00 -1.72 0.00 0.00 179.24 177.77 3fz5 h ALA 104 N 1.43 1.44 -0.50 3.45 0.00 -1.85 -2.66 119.26 120.57 3fz5 h ALA 104 Ca 0.35 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 3fz5 h ALA 104 Cb 0.38 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 3fz5 h ALA 104 CO -0.28 0.40 -0.01 0.00 0.00 0.00 0.00 179.25 179.37 3fz5 h ALA 105 N 1.55 0.67 -0.30 0.00 0.00 0.43 -0.44 119.26 121.18 3fz5 h ALA 105 Ca 0.11 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 3fz5 h ALA 105 Cb 0.27 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3fz5 h ALA 105 CO 0.00 0.49 0.10 1.15 0.00 0.00 0.00 179.25 180.99 3fz5 h THR 106 N 0.75 1.20 -0.53 0.00 2.02 -1.28 0.11 112.91 115.17 3fz5 h THR 106 Ca 0.14 -0.64 0.08 0.00 0.77 0.00 0.00 66.41 66.77 3fz5 h THR 106 Cb 0.53 1.05 -0.07 0.00 -1.74 0.00 0.00 68.15 67.91 3fz5 h THR 106 CO 0.03 0.22 0.16 0.00 0.37 0.00 0.00 175.52 176.29 3fz5 h ALA 107 N 0.94 0.64 -0.34 6.16 0.00 -1.29 0.18 119.26 125.54 3fz5 h ALA 107 Ca 0.10 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 3fz5 h ALA 107 Cb 0.24 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3fz5 h ALA 107 CO -0.00 -0.25 0.18 0.35 0.00 0.00 0.00 179.25 179.53 3fz5 h PHE 108 N 0.32 0.47 -0.47 0.00 3.57 -0.80 -1.73 116.94 118.30 3fz5 h PHE 108 Ca 0.26 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.73 3fz5 h PHE 108 Cb 0.33 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 3fz5 h PHE 108 CO -0.19 0.39 0.20 0.00 -2.23 0.00 0.00 178.31 176.47 3fz5 h ALA 109 N 1.05 0.61 -0.66 2.41 0.00 -0.19 -0.95 119.26 121.52 3fz5 h ALA 109 Ca 0.12 -0.14 0.11 0.00 0.00 0.00 0.00 54.91 55.00 3fz5 h ALA 109 Cb 0.07 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 17.60 3fz5 h ALA 109 CO -0.02 0.20 0.26 1.96 0.00 0.00 0.00 179.25 181.65 3fz5 h GLN 110 N 0.61 0.43 -0.48 0.00 1.08 -0.56 -2.12 115.11 114.07 3fz5 h GLN 110 Ca 0.16 -0.03 -0.08 0.00 -1.45 0.00 0.00 58.65 57.25 3fz5 h GLN 110 Cb 0.17 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.49 3fz5 h GLN 110 CO -0.02 0.29 -0.01 -0.09 -0.95 0.00 0.00 178.83 178.05 3fz5 h ARG 111 N 0.45 0.86 -0.60 1.46 9.65 -0.73 -2.64 114.38 122.82 3fz5 h ARG 111 Ca 0.34 -0.28 -0.05 0.00 -1.10 0.00 0.00 59.98 58.90 3fz5 h ARG 111 Cb 0.44 -0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.92 3fz5 h ARG 111 CO -0.33 0.91 0.19 0.28 2.80 0.00 0.00 179.97 183.82 3fz5 h VAL 112 N 0.72 1.23 -0.05 0.20 2.07 -0.76 0.30 116.25 119.96 3fz5 h VAL 112 Ca 0.14 -0.78 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 3fz5 h VAL 112 Cb 0.53 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 3fz5 h VAL 112 CO 0.03 0.30 -0.01 -0.26 0.02 0.00 0.00 177.57 177.65 3fz5 h PHE 113 N 0.88 0.11 -0.54 1.57 0.04 -1.34 -1.96 116.94 115.71 3fz5 h PHE 113 Ca 0.20 -0.02 0.05 0.00 2.80 0.00 0.00 57.97 61.00 3fz5 h PHE 113 Cb 0.25 -0.03 -0.05 0.00 2.20 0.00 0.00 35.95 38.32 3fz5 h PHE 113 CO 0.02 0.41 0.27 -0.44 -0.60 0.00 0.00 178.31 177.96 3fz5 h ASP 114 N -0.22 0.38 -0.13 2.17 3.32 -1.19 -2.33 116.42 118.41 3fz5 h ASP 114 Ca 0.01 0.03 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 3fz5 h ASP 114 Cb 0.37 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.89 3fz5 h ASP 114 CO 0.00 0.26 -0.35 -0.07 -1.72 0.00 0.00 179.24 177.36 3fz5 h LEU 115 N 0.52 0.54 -0.75 1.55 3.38 -0.97 -2.98 115.31 116.59 3fz5 h LEU 115 Ca 0.24 -0.59 -0.07 0.00 0.09 0.00 0.00 57.88 57.56 3fz5 h LEU 115 Cb 0.16 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 3fz5 h LEU 115 CO -0.17 1.03 0.19 0.22 0.09 0.00 0.00 178.44 179.79 3fz5 h TYR 116 N 0.08 1.18 -0.35 1.13 3.20 -1.37 0.19 116.97 121.03 3fz5 h TYR 116 Ca -0.01 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 61.73 3fz5 h TYR 116 Cb 0.97 -0.34 0.00 0.00 1.54 0.00 0.00 36.73 38.90 3fz5 h TYR 116 CO 0.11 0.95 0.00 1.19 -1.64 0.00 0.00 178.16 178.77 3fz5 n PHE 117 N -4.24 1.24 -1.55 -3.82 3.72 -0.88 -2.73 117.46 109.20 3fz5 n PHE 117 Ca 0.05 -0.43 0.05 0.00 -0.05 0.00 0.00 57.45 57.08 3fz5 n PHE 117 Cb 0.25 -0.34 0.08 0.00 -0.94 0.00 0.00 39.48 38.53 3fz5 n PHE 117 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3fz5 n SER 118 N 0.39 1.29 -3.47 4.37 3.41 -1.04 -0.27 113.62 118.30 3fz5 n SER 118 Ca 0.17 -2.64 -0.21 0.00 -0.26 0.00 0.00 58.87 55.93 3fz5 n SER 118 Cb 0.81 -0.34 0.08 0.00 -0.26 0.00 0.00 64.21 64.50 3fz5 n SER 118 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3fz5 n ASP 119 N -0.74 -4.57 0.00 4.04 2.03 -0.56 -4.92 116.55 111.84 3fz5 n ASP 119 Ca 0.09 -0.56 0.00 0.00 0.52 0.00 0.00 54.79 54.84 3fz5 n ASP 119 Cb 0.69 -4.98 0.00 0.00 -0.72 0.00 0.00 41.12 36.11 3fz5 n ASP 119 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3fz5 n ARG 120 N -4.57 0.18 -3.67 -0.67 1.74 0.66 -4.98 116.66 105.35 3fz5 n ARG 120 Ca -0.11 -0.71 -0.09 0.00 -0.77 0.00 0.00 57.85 56.18 3fz5 n ARG 120 Cb 0.60 -0.93 -0.09 0.00 -1.02 0.00 0.00 32.46 31.02 3fz5 n ARG 120 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 3fz5 s LEU 121 N -0.26 -0.55 -0.59 0.55 2.96 -1.24 -4.90 118.68 114.66 3fz5 s LEU 121 Ca 0.00 1.02 -0.25 0.00 -0.22 0.00 0.00 54.13 54.67 3fz5 s LEU 121 Cb 0.00 1.43 0.04 0.00 0.50 0.00 0.00 46.19 48.16 3fz5 s LEU 121 CO 0.00 -0.22 1.05 -0.62 -1.32 0.00 0.00 176.35 175.24 3fz5 s ASP 122 N 2.30 6.34 0.00 3.68 -1.08 -1.26 -4.62 116.67 122.03 3fz5 s ASP 122 Ca -0.04 -0.28 0.29 0.00 -0.52 0.00 0.00 52.55 51.99 3fz5 s ASP 122 Cb -0.11 -2.48 1.19 0.00 -1.46 0.00 0.00 42.92 40.06 3fz5 s ASP 122 CO -0.13 -1.38 1.87 0.35 0.52 0.00 0.00 175.17 176.39 3fz5 n THR 123 N 6.33 0.00 0.28 1.71 -2.24 -1.26 -2.25 114.28 116.86 3fz5 n THR 123 Ca 0.03 -0.01 0.13 0.00 -2.27 0.00 0.00 64.05 61.93 3fz5 n THR 123 Cb 0.48 -0.32 0.27 0.00 -2.10 0.00 0.00 70.33 68.66 3fz5 n THR 123 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fz5 h ALA 124 N 3.19 1.00 -2.54 6.98 0.00 -1.91 -2.69 119.26 123.28 3fz5 h ALA 124 Ca 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.26 3fz5 h ALA 124 Cb 0.43 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.06 3fz5 h ALA 124 CO 0.00 0.00 -0.19 0.45 0.00 0.00 0.00 179.25 179.51 3fz5 s SER 125 N -5.90 6.24 0.17 0.00 0.15 -0.95 -4.45 113.70 108.95 3fz5 s SER 125 Ca 0.07 -0.12 -0.19 0.00 0.70 0.00 0.00 55.95 56.41 3fz5 s SER 125 Cb 0.06 -2.23 0.09 0.00 -1.71 0.00 0.00 66.02 62.24 3fz5 s SER 125 CO 0.64 -0.39 1.65 -0.65 1.20 0.00 0.00 173.24 175.69 3fz5 h PRO 126 N 8.44 -0.09 -0.84 5.44 0.11 -1.88 -1.84 132.00 141.34 3fz5 h PRO 126 Ca -0.29 0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.79 3fz5 h PRO 126 Cb 1.14 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 32.23 3fz5 h PRO 126 CO 0.72 -0.06 0.39 1.49 -0.21 0.00 0.00 178.00 180.33 3fz5 h GLU 127 N -0.09 1.21 -0.29 1.05 4.57 -1.94 -0.09 114.58 118.99 3fz5 h GLU 127 Ca 0.19 -0.18 -0.06 0.00 -1.18 0.00 0.00 59.36 58.13 3fz5 h GLU 127 Cb 0.38 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.74 3fz5 h GLU 127 CO -0.44 0.94 -0.04 0.00 -1.18 0.00 0.00 179.01 178.29 3fz5 h ALA 128 N 1.23 0.40 -0.40 2.92 0.00 -1.79 -2.99 119.26 118.62 3fz5 h ALA 128 Ca 0.29 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 3fz5 h ALA 128 Cb 0.13 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3fz5 h ALA 128 CO -0.03 0.19 -0.14 0.28 0.00 0.00 0.00 179.25 179.54 3fz5 h VAL 129 N 0.32 1.26 0.00 0.00 2.07 -1.21 -2.90 116.25 115.79 3fz5 h VAL 129 Ca 0.08 -1.20 0.00 0.00 0.82 0.00 0.00 66.70 66.40 3fz5 h VAL 129 Cb 0.50 1.11 0.00 0.00 -1.52 0.00 0.00 31.29 31.37 3fz5 h VAL 129 CO 0.02 0.41 0.00 0.77 0.02 0.00 0.00 177.57 178.79 3fz5 h SER 130 N 0.66 0.00 0.62 0.57 4.64 -0.86 -0.23 113.55 118.95 3fz5 h SER 130 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3fz5 h SER 130 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 3fz5 h SER 130 CO 0.04 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.54 3fz5 n ARG 131 N -2.34 0.32 0.00 4.77 1.74 -1.10 -2.58 116.66 117.47 3fz5 n ARG 131 Ca -0.01 0.02 0.13 0.00 -0.77 0.00 0.00 57.85 57.22 3fz5 n ARG 131 Cb 0.07 -1.50 0.35 0.00 -1.02 0.00 0.00 32.46 30.36 3fz5 n ARG 131 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3fz5 n LEU 132 N -1.33 0.37 -0.20 0.55 4.32 -0.10 -4.44 117.00 116.17 3fz5 n LEU 132 Ca 0.12 0.13 -0.10 0.00 -0.02 0.00 0.00 56.01 56.15 3fz5 n LEU 132 Cb 0.25 -0.32 -0.08 0.00 -1.62 0.00 0.00 43.42 41.66 3fz5 n LEU 132 CO 0.23 0.09 0.49 1.23 -1.22 0.00 0.00 177.39 178.21 3fz5 h GLY 133 N 5.00 -1.27 1.48 -0.72 0.00 -1.65 -2.98 103.07 102.93 3fz5 h GLY 133 Ca 0.00 0.81 0.05 0.00 0.00 0.00 0.00 47.33 48.19 3fz5 h GLY 133 CO 0.00 -0.25 0.25 -2.55 0.00 0.00 0.00 176.54 173.99 3fz5 h PRO 134 N -0.17 0.29 -0.01 4.80 0.11 -1.46 0.12 132.00 135.69 3fz5 h PRO 134 Ca 0.08 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 66.10 3fz5 h PRO 134 Cb 0.39 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 3fz5 h PRO 134 CO -0.57 0.19 -0.36 0.93 -0.21 0.00 0.00 178.00 177.99 3fz5 h GLU 135 N 0.30 0.03 -0.26 1.05 3.07 -1.82 -0.18 114.58 116.77 3fz5 h GLU 135 Ca 0.16 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.01 3fz5 h GLU 135 Cb 0.24 -0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.15 3fz5 h GLU 135 CO -0.03 0.39 0.00 1.55 -1.40 0.00 0.00 179.01 179.51 3fz5 n VAL 136 N -4.11 0.34 -2.45 3.13 3.14 -0.49 -4.95 118.33 112.94 3fz5 n VAL 136 Ca -0.02 -0.48 -0.03 0.00 -2.96 0.00 0.00 64.34 60.86 3fz5 n VAL 136 Cb 0.40 0.50 0.01 0.00 -1.06 0.00 0.00 33.84 33.69 3fz5 n VAL 136 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3fz5 n GLY 137 N 1.22 0.60 3.17 7.55 0.00 -0.08 -4.98 105.19 112.68 3fz5 n GLY 137 Ca 0.16 -0.63 -0.19 0.00 0.00 0.00 0.00 46.02 45.37 3fz5 n GLY 137 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fz5 s LEU 138 N -1.47 2.26 0.15 0.99 1.43 0.30 -4.93 118.68 117.41 3fz5 s LEU 138 Ca 0.05 -0.59 -0.30 0.00 -1.03 0.00 0.00 54.13 52.26 3fz5 s LEU 138 Cb -0.02 -0.52 -0.07 0.00 0.03 0.00 0.00 46.19 45.60 3fz5 s LEU 138 CO 0.06 -0.06 1.16 -0.70 0.23 0.00 0.00 176.35 177.04 3fz5 s GLU 139 N -1.65 4.51 0.19 1.70 2.56 -1.26 -1.42 118.70 123.33 3fz5 s GLU 139 Ca -0.02 1.79 -0.09 0.00 0.00 0.00 0.00 54.97 56.65 3fz5 s GLU 139 Cb -0.10 -3.28 0.10 0.00 2.00 0.00 0.00 34.13 32.86 3fz5 s GLU 139 CO 0.02 -0.07 1.72 -1.35 -0.56 0.00 0.00 175.26 175.01 3fz5 h PRO 140 N 5.60 1.07 -0.91 4.30 0.11 -1.94 0.23 132.00 140.46 3fz5 h PRO 140 Ca -0.44 -0.24 0.05 0.00 0.11 0.00 0.00 66.00 65.48 3fz5 h PRO 140 Cb 1.21 -0.15 -0.06 0.00 0.11 0.00 0.00 31.00 32.12 3fz5 h PRO 140 CO 0.75 0.94 0.60 1.49 -0.21 0.00 0.00 178.00 181.57 3fz5 h GLU 141 N 1.00 1.06 -0.07 1.05 4.81 -1.92 -0.29 114.58 120.22 3fz5 h GLU 141 Ca 0.22 -0.06 -0.18 0.00 -0.13 0.00 0.00 59.36 59.20 3fz5 h GLU 141 Cb 0.33 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 3fz5 h GLU 141 CO -0.00 0.70 -0.74 0.00 -0.73 0.00 0.00 179.01 178.24 3fz5 h ALA 142 N 1.49 0.60 -0.30 2.92 0.00 -1.73 -2.63 119.26 119.60 3fz5 h ALA 142 Ca 0.38 -0.61 -0.16 0.00 0.00 0.00 0.00 54.91 54.52 3fz5 h ALA 142 Cb 0.10 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3fz5 h ALA 142 CO -0.13 0.77 -0.44 1.25 0.00 0.00 0.00 179.25 180.70 3fz5 h LEU 143 N 0.26 0.90 0.30 0.00 6.46 -0.67 -2.45 115.31 120.12 3fz5 h LEU 143 Ca -0.03 -0.51 -0.00 0.00 -0.12 0.00 0.00 57.88 57.22 3fz5 h LEU 143 Cb 1.31 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 40.97 3fz5 h LEU 143 CO 0.13 1.23 -0.23 -0.07 -0.62 0.00 0.00 178.44 178.88 3fz5 h LEU 144 N 0.60 -0.61 -0.95 2.25 3.38 -1.01 -1.92 115.31 117.05 3fz5 h LEU 144 Ca 0.03 0.05 -0.09 0.00 0.09 0.00 0.00 57.88 57.96 3fz5 h LEU 144 Cb 1.04 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 3fz5 h LEU 144 CO 0.10 -0.36 -0.21 0.00 0.09 0.00 0.00 178.44 178.06 3fz5 h ALA 145 N 0.10 1.11 0.14 1.53 0.00 -1.58 -2.70 119.26 117.88 3fz5 h ALA 145 Ca -0.02 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 3fz5 h ALA 145 Cb 0.47 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.13 3fz5 h ALA 145 CO -0.01 0.55 -0.07 0.78 0.00 0.00 0.00 179.25 180.50 3fz5 h GLY 146 N 0.99 -0.20 1.78 0.00 0.00 -1.23 -2.67 103.07 101.75 3fz5 h GLY 146 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.48 3fz5 h GLY 146 CO 0.04 -0.07 0.00 0.29 0.00 0.00 0.00 176.54 176.80 3fz5 n ILE 147 N -5.14 0.47 1.19 2.60 -6.64 -0.74 -2.47 119.36 108.63 3fz5 n ILE 147 Ca -0.09 0.12 0.12 0.00 -1.77 0.00 0.00 62.75 61.14 3fz5 n ILE 147 Cb 0.13 -0.77 0.26 0.00 -1.44 0.00 0.00 39.64 37.82 3fz5 n ILE 147 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 3fz5 n ALA 148 N -1.39 3.08 -2.33 -1.28 0.00 -1.02 -4.67 120.51 112.90 3fz5 n ALA 148 Ca 0.08 -0.51 -0.42 0.00 0.00 0.00 0.00 53.44 52.58 3fz5 n ALA 148 Cb 0.20 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.62 3fz5 n ALA 148 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3fz5 s ASP 149 N -2.36 7.04 0.25 0.00 2.15 -1.03 -4.96 116.67 117.76 3fz5 s ASP 149 Ca 0.25 2.10 -0.03 0.00 0.43 0.00 0.00 52.55 55.30 3fz5 s ASP 149 Cb 0.19 -2.58 0.45 0.00 -0.30 0.00 0.00 42.92 40.68 3fz5 s ASP 149 CO 0.48 -0.48 1.79 -0.65 -0.17 0.00 0.00 175.17 176.13 3fz5 h PRO 150 N 6.57 0.68 -0.77 4.34 0.11 -1.91 -2.03 132.00 138.99 3fz5 h PRO 150 Ca -0.42 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.66 3fz5 h PRO 150 Cb 1.21 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 3fz5 h PRO 150 CO 0.81 0.45 0.51 0.00 -0.21 0.00 0.00 178.00 179.56 3fz5 h ALA 151 N 1.50 0.98 -0.21 -0.75 0.00 -1.96 -0.00 119.26 118.82 3fz5 h ALA 151 Ca 0.42 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.22 3fz5 h ALA 151 Cb 0.49 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3fz5 h ALA 151 CO -0.30 0.37 -0.12 1.25 0.00 0.00 0.00 179.25 180.45 3fz5 h LEU 152 N 1.03 0.47 -0.19 0.00 5.85 -1.79 -0.65 115.31 120.02 3fz5 h LEU 152 Ca 0.29 -0.42 0.04 0.00 0.84 0.00 0.00 57.88 58.62 3fz5 h LEU 152 Cb -0.09 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 40.74 3fz5 h LEU 152 CO -0.07 0.79 -0.49 0.11 -0.34 0.00 0.00 178.44 178.44 3fz5 h LYS 153 N 0.15 -0.49 -0.30 1.25 1.57 -1.12 -0.81 116.57 116.82 3fz5 h LYS 153 Ca 0.04 0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.89 3fz5 h LYS 153 Cb 0.62 0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.99 3fz5 h LYS 153 CO 0.03 -0.33 -0.34 0.93 -0.57 0.00 0.00 179.45 179.18 3fz5 h GLU 154 N -0.51 -0.20 -0.36 3.15 5.08 -0.90 -2.58 114.58 118.27 3fz5 h GLU 154 Ca 0.06 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.51 3fz5 h GLU 154 Cb 0.65 0.04 -0.09 0.00 0.50 0.00 0.00 28.75 29.86 3fz5 h GLU 154 CO -0.46 -0.13 -0.35 1.15 -1.00 0.00 0.00 179.01 178.21 3fz5 h THR 155 N -0.21 0.20 0.22 1.13 2.02 -0.78 -1.56 112.91 113.94 3fz5 h THR 155 Ca 0.05 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.23 3fz5 h THR 155 Cb 0.34 0.20 -0.02 0.00 -1.74 0.00 0.00 68.15 66.93 3fz5 h THR 155 CO -0.39 0.00 -0.36 0.58 0.37 0.00 0.00 175.52 175.72 3fz5 h VAL 156 N -0.30 0.00 -1.33 3.16 2.07 -0.97 0.13 116.25 119.01 3fz5 h VAL 156 Ca 0.15 0.00 0.40 0.00 0.82 0.00 0.00 66.70 68.07 3fz5 h VAL 156 Cb 0.56 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 30.23 3fz5 h VAL 156 CO -0.52 0.00 0.89 -0.09 0.02 0.00 0.00 177.57 177.87 3fz5 h ARG 157 N -0.61 0.12 0.00 1.57 2.43 -1.27 0.51 114.38 117.13 3fz5 h ARG 157 Ca -0.02 -0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 58.98 3fz5 h ARG 157 Cb 0.56 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 3fz5 h ARG 157 CO -0.12 0.08 -0.76 0.87 -1.51 0.00 0.00 179.97 178.53 3fz5 h LYS 158 N 0.13 0.00 0.23 0.20 1.57 -0.10 -0.83 116.57 117.77 3fz5 h LYS 158 Ca 0.74 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.52 3fz5 h LYS 158 Cb 2.45 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.75 3fz5 h LYS 158 CO -0.26 0.76 -0.17 0.82 -0.57 0.00 0.00 179.45 180.03 3fz5 h ILE 159 N 0.00 0.63 -0.12 1.86 2.04 0.26 -0.47 117.51 121.70 3fz5 h ILE 159 Ca -0.01 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.76 3fz5 h ILE 159 Cb 1.52 0.63 -0.01 0.00 -0.74 0.00 0.00 36.82 38.21 3fz5 h ILE 159 CO 0.10 0.00 -0.32 1.23 0.00 0.00 0.00 178.15 179.15 3fz5 h GLY 160 N -0.41 0.26 1.40 5.37 0.00 -1.48 -1.89 103.07 106.33 3fz5 h GLY 160 Ca -0.01 -0.22 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 3fz5 h GLY 160 CO -0.01 0.20 -0.02 0.83 0.00 0.00 0.00 176.54 177.54 3fz5 h GLU 161 N 0.21 0.73 0.62 4.80 5.08 -1.09 -2.53 114.58 122.40 3fz5 h GLU 161 Ca 0.03 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.16 3fz5 h GLU 161 Cb 0.68 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.85 3fz5 h GLU 161 CO 0.05 0.76 -0.30 0.22 -1.00 0.00 0.00 179.01 178.74 3fz5 h ASP 162 N 0.68 -0.70 -0.86 1.42 -0.00 -0.71 -3.00 116.42 113.24 3fz5 h ASP 162 Ca 0.13 -0.02 0.20 0.00 -0.00 0.00 0.00 57.03 57.35 3fz5 h ASP 162 Cb 0.45 0.18 -0.12 0.00 -0.00 0.00 0.00 39.33 39.84 3fz5 h ASP 162 CO 0.02 -0.34 0.34 0.00 -0.00 0.00 0.00 179.24 179.25 3fz5 h ALA 163 N -0.94 1.31 -0.26 -0.78 0.00 -1.38 -0.85 119.26 116.36 3fz5 h ALA 163 Ca -0.08 0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3fz5 h ALA 163 Cb 0.68 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3fz5 h ALA 163 CO 0.14 -0.34 0.16 0.28 0.00 0.00 0.00 179.25 179.49 3fz5 h VAL 164 N 0.37 1.04 0.00 0.00 2.07 -1.51 0.14 116.25 118.36 3fz5 h VAL 164 Ca 0.52 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.93 3fz5 h VAL 164 Cb 0.97 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 3fz5 h VAL 164 CO -0.53 0.06 0.00 0.00 0.02 0.00 0.00 177.57 177.12 3fz5 n ALA 165 N -2.18 2.07 -0.50 1.67 0.00 -0.48 -2.87 120.51 118.22 3fz5 n ALA 165 Ca -0.02 -0.01 0.09 0.00 0.00 0.00 0.00 53.44 53.50 3fz5 n ALA 165 Cb 0.04 -1.43 0.29 0.00 0.00 0.00 0.00 19.45 18.35 3fz5 n ALA 165 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3fz5 n ARG 166 N -2.09 3.22 0.00 0.00 0.63 -0.45 -4.95 116.66 113.03 3fz5 n ARG 166 Ca 0.05 -2.63 0.00 0.00 -0.92 0.00 0.00 57.85 54.34 3fz5 n ARG 166 Cb 0.34 -1.67 0.00 0.00 0.45 0.00 0.00 32.46 31.59 3fz5 n ARG 166 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3fz5 n GLY 167 N 0.92 0.61 3.73 5.14 0.00 -1.05 -5.01 105.19 109.52 3fz5 n GLY 167 Ca 0.22 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.82 3fz5 n GLY 167 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fz5 s ILE 168 N -2.00 4.44 0.20 -0.61 -1.09 0.46 -5.00 121.20 117.60 3fz5 s ILE 168 Ca 0.00 2.02 -0.10 0.00 -2.23 0.00 0.00 60.65 60.33 3fz5 s ILE 168 Cb 0.00 -4.29 -0.01 0.00 -1.58 0.00 0.00 42.46 36.59 3fz5 s ILE 168 CO 0.00 0.30 0.35 0.72 -1.23 0.00 0.00 174.94 175.09 3fz5 s PHE 169 N 0.04 0.40 0.00 3.97 -0.12 -1.26 -3.76 117.98 117.25 3fz5 s PHE 169 Ca 0.48 -0.75 0.00 0.00 -0.05 0.00 0.00 56.93 56.60 3fz5 s PHE 169 Cb -0.24 0.02 0.00 0.00 -0.63 0.00 0.00 43.02 42.17 3fz5 s PHE 169 CO 0.30 -0.82 0.00 0.41 -0.05 0.00 0.00 175.22 175.07 3fz5 n GLY 170 N -0.28 -0.79 3.59 1.99 0.00 -1.26 -4.65 105.19 103.78 3fz5 n GLY 170 Ca -0.05 -1.05 -0.00 0.00 0.00 0.00 0.00 46.02 44.91 3fz5 n GLY 170 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3fz5 s SER 171 N -4.00 -1.01 0.33 1.61 0.15 -1.26 -4.54 113.70 104.98 3fz5 s SER 171 Ca 0.00 1.39 -0.11 0.00 0.70 0.00 0.00 55.95 57.93 3fz5 s SER 171 Cb 0.00 2.15 -0.07 0.00 -1.71 0.00 0.00 66.02 66.39 3fz5 s SER 171 CO 0.00 -0.19 0.68 -2.16 1.20 0.00 0.00 173.24 172.77 3fz5 s PRO 172 N 2.79 3.84 -0.12 5.44 0.04 -1.26 -4.53 135.00 141.20 3fz5 s PRO 172 Ca -0.05 0.44 -0.02 0.00 0.04 0.00 0.00 61.00 61.40 3fz5 s PRO 172 Cb -0.11 -2.49 0.04 0.00 0.04 0.00 0.00 34.50 31.99 3fz5 s PRO 172 CO -0.19 0.13 0.02 0.12 0.04 0.00 0.00 177.00 177.13 3fz5 s PHE 173 N -2.09 0.76 -0.07 0.56 5.36 0.42 -0.96 117.98 121.96 3fz5 s PHE 173 Ca 0.50 -0.42 -0.03 0.00 -0.96 0.00 0.00 56.93 56.02 3fz5 s PHE 173 Cb -0.10 -0.87 -0.04 0.00 -0.34 0.00 0.00 43.02 41.66 3fz5 s PHE 173 CO 0.24 -0.44 0.07 -0.06 -1.46 0.00 0.00 175.22 173.57 3fz5 s PHE 174 N 1.94 3.34 -0.08 10.12 0.08 0.10 -0.65 117.98 132.82 3fz5 s PHE 174 Ca 0.03 0.30 0.03 0.00 0.12 0.00 0.00 56.93 57.41 3fz5 s PHE 174 Cb -0.14 -1.82 0.01 0.00 -0.57 0.00 0.00 43.02 40.49 3fz5 s PHE 174 CO -0.06 0.58 -0.19 -0.51 -0.10 0.00 0.00 175.22 174.94 3fz5 s LEU 175 N -1.19 1.89 -0.05 -0.37 1.43 -0.39 -0.62 118.68 119.39 3fz5 s LEU 175 Ca 0.17 -0.44 -0.02 0.00 -1.03 0.00 0.00 54.13 52.81 3fz5 s LEU 175 Cb -0.12 -1.14 0.03 0.00 0.03 0.00 0.00 46.19 45.00 3fz5 s LEU 175 CO 0.06 0.11 0.09 0.54 0.23 0.00 0.00 176.35 177.38 3fz5 s VAL 176 N 0.45 -0.10 -1.53 -1.59 0.11 -0.68 0.12 120.40 117.18 3fz5 s VAL 176 Ca -0.16 0.28 -0.15 0.00 -2.93 0.00 0.00 61.98 59.02 3fz5 s VAL 176 Cb -0.17 -0.17 0.12 0.00 -1.53 0.00 0.00 36.38 34.64 3fz5 s VAL 176 CO 0.06 0.11 0.72 0.47 -3.33 0.00 0.00 175.10 173.14 3fz5 n ASP 177 N 4.60 -3.66 0.00 3.54 8.00 -1.26 0.01 116.55 127.78 3fz5 n ASP 177 Ca -0.19 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.54 3fz5 n ASP 177 Cb 0.50 -2.99 0.00 0.00 -0.02 0.00 0.00 41.12 38.61 3fz5 n ASP 177 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3fz5 n ASP 178 N -2.55 -1.81 -4.66 -2.24 8.00 -1.26 -4.99 116.55 107.04 3fz5 n ASP 178 Ca 0.05 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.15 3fz5 n ASP 178 Cb 0.51 -1.41 -0.06 0.00 -0.02 0.00 0.00 41.12 40.14 3fz5 n ASP 178 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3fz5 s GLU 179 N -0.63 4.20 0.00 -1.24 2.56 0.10 -5.05 118.70 118.65 3fz5 s GLU 179 Ca 0.00 0.56 -0.25 0.00 0.00 0.00 0.00 54.97 55.28 3fz5 s GLU 179 Cb 0.00 -3.58 -0.05 0.00 2.00 0.00 0.00 34.13 32.51 3fz5 s GLU 179 CO 0.00 -0.22 0.78 -1.25 -0.56 0.00 0.00 175.26 174.00 3fz5 s PRO 180 N 1.86 4.49 -0.23 4.30 0.04 -1.26 -1.69 135.00 142.50 3fz5 s PRO 180 Ca 0.27 1.06 -0.02 0.00 0.04 0.00 0.00 61.00 62.35 3fz5 s PRO 180 Cb -0.16 -3.40 0.07 0.00 0.04 0.00 0.00 34.50 31.05 3fz5 s PRO 180 CO 0.10 0.17 0.04 -0.06 0.04 0.00 0.00 177.00 177.29 3fz5 s PHE 181 N 0.36 1.42 -0.25 0.56 0.08 0.21 -5.02 117.98 115.33 3fz5 s PHE 181 Ca 0.40 -1.24 -0.15 0.00 0.12 0.00 0.00 56.93 56.07 3fz5 s PHE 181 Cb -0.20 -1.30 -0.04 0.00 -0.57 0.00 0.00 43.02 40.92 3fz5 s PHE 181 CO 0.22 -0.71 0.35 -0.46 -0.10 0.00 0.00 175.22 174.52 3fz5 s TRP 182 N 1.72 3.28 0.00 0.36 -0.00 -1.26 -0.72 118.94 122.32 3fz5 s TRP 182 Ca 0.01 0.43 0.00 0.00 -0.00 0.00 0.00 56.10 56.54 3fz5 s TRP 182 Cb -0.17 -2.53 0.00 0.00 -0.00 0.00 0.00 33.47 30.77 3fz5 s TRP 182 CO -0.13 -0.15 0.00 0.41 -0.00 0.00 0.00 176.95 177.08 3fz5 n GLY 183 N 4.50 2.99 0.26 5.86 0.00 -0.14 -4.61 105.19 114.05 3fz5 n GLY 183 Ca -0.09 -1.79 -0.04 0.00 0.00 0.00 0.00 46.02 44.10 3fz5 n GLY 183 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 3fz5 h TRP 184 N 0.00 0.67 0.00 1.61 7.01 -1.86 -2.58 115.95 120.80 3fz5 h TRP 184 Ca 0.00 -0.12 0.00 0.00 2.11 0.00 0.00 58.89 60.88 3fz5 h TRP 184 Cb 0.00 -0.17 0.00 0.00 -2.10 0.00 0.00 29.16 26.89 3fz5 h TRP 184 CO 0.00 0.74 0.00 -0.40 -2.79 0.00 0.00 178.44 175.99 3fz5 n ASP 185 N -4.16 0.00 -3.81 2.65 5.68 -1.26 -4.64 116.55 111.01 3fz5 n ASP 185 Ca 0.01 -1.58 -0.34 0.00 -0.50 0.00 0.00 54.79 52.38 3fz5 n ASP 185 Cb 0.37 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.29 3fz5 n ASP 185 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3fz5 n ARG 186 N -0.68 3.03 -2.79 0.11 5.12 -0.98 -5.17 116.66 115.31 3fz5 n ARG 186 Ca 0.08 -4.58 -0.09 0.00 -1.93 0.00 0.00 57.85 51.34 3fz5 n ARG 186 Cb 0.04 -2.37 0.00 0.00 -1.16 0.00 0.00 32.46 28.97 3fz5 n ARG 186 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 3fz5 n GLU 188 N 1.48 -0.54 0.00 5.56 1.02 -1.26 -4.93 120.64 121.96 3fz5 n GLU 188 Ca 0.26 0.28 0.00 0.00 -0.02 0.00 0.00 57.16 57.68 3fz5 n GLU 188 Cb 0.37 -0.74 0.00 0.00 -0.02 0.00 0.00 31.44 31.06 3fz5 n GLU 188 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3fz5 n ALA 191 N -1.06 0.00 0.14 0.62 0.00 -1.26 -4.69 120.51 114.26 3fz5 n ALA 191 Ca -0.10 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.33 3fz5 n ALA 191 Cb 0.24 0.00 0.18 0.00 0.00 0.00 0.00 19.45 19.87 3fz5 n ALA 191 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3fz5 h GLU 192 N 0.00 0.03 -0.45 0.00 4.81 -1.99 -2.14 114.58 114.84 3fz5 h GLU 192 Ca 0.00 -0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.29 3fz5 h GLU 192 Cb 0.00 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.31 3fz5 h GLU 192 CO 0.00 0.61 0.03 2.35 -0.73 0.00 0.00 179.01 181.27 3fz5 h TRP 193 N 0.02 0.02 -0.38 0.92 2.91 -1.98 -0.92 115.95 116.55 3fz5 h TRP 193 Ca -0.01 0.03 -0.08 0.00 1.13 0.00 0.00 58.89 59.97 3fz5 h TRP 193 Cb 1.06 0.06 -0.01 0.00 -0.51 0.00 0.00 29.16 29.75 3fz5 h TRP 193 CO 0.00 -0.07 -0.07 0.82 -1.03 0.00 0.00 178.44 178.10 3fz5 h ILE 194 N 0.14 1.27 0.45 2.65 2.04 -1.80 0.26 117.51 122.53 3fz5 h ILE 194 Ca 0.22 -1.13 -0.02 0.00 1.00 0.00 0.00 64.86 64.93 3fz5 h ILE 194 Cb 0.32 1.24 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 3fz5 h ILE 194 CO -0.35 0.38 -0.21 0.03 0.00 0.00 0.00 178.15 177.99 3fz5 h ARG 195 N 0.52 -0.58 0.00 2.37 3.08 -1.17 -2.92 114.38 115.68 3fz5 h ARG 195 Ca 0.10 0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.19 3fz5 h ARG 195 Cb 0.57 0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.75 3fz5 h ARG 195 CO 0.03 -0.33 -0.01 1.79 -1.07 0.00 0.00 179.97 180.38 3fz5 h THR 196 N -0.70 0.03 -0.66 2.04 1.35 -1.20 -3.47 112.91 110.30 3fz5 h THR 196 Ca -0.06 -0.53 -0.16 0.00 -0.55 0.00 0.00 66.41 65.11 3fz5 h THR 196 Cb 0.51 1.51 -0.04 0.00 -1.73 0.00 0.00 68.15 68.40 3fz5 h THR 196 CO 0.10 0.01 -0.17 0.61 -0.25 0.00 0.00 175.52 175.82 3fz5 n GLY 197 N 0.02 0.62 0.00 5.82 0.00 0.77 -4.91 105.19 107.50 3fz5 n GLY 197 Ca 0.00 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.38 3fz5 n GLY 197 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fz5 n GLY 198 N -1.64 2.48 0.00 -0.02 0.00 -0.23 -4.99 105.19 100.80 3fz5 n GLY 198 Ca -0.08 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.04 3fz5 n GLY 198 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65