#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cy4 n ASP 32 N 0.00 2.46 -4.42 0.00 5.75 -1.26 -4.84 116.55 114.23 2cy4 n ASP 32 Ca 0.00 -2.18 -0.33 0.00 -0.01 0.00 0.00 54.79 52.27 2cy4 n ASP 32 Cb 0.00 0.25 -0.14 0.00 -1.03 0.00 0.00 41.12 40.21 2cy4 n ASP 32 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2cy4 s VAL 33 N -2.04 3.24 0.14 2.12 1.01 -1.26 -3.64 120.40 119.98 2cy4 s VAL 33 Ca 0.02 -0.61 0.01 0.00 0.00 0.00 0.00 61.98 61.40 2cy4 s VAL 33 Cb 0.00 -2.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.98 2cy4 s VAL 33 CO 0.01 0.53 -0.01 -0.94 0.00 0.00 0.00 175.10 174.70 2cy4 s SER 34 N 0.11 0.98 -0.15 3.32 1.04 0.14 -4.98 113.70 114.16 2cy4 s SER 34 Ca -0.05 -1.13 -0.13 0.00 0.48 0.00 0.00 55.95 55.12 2cy4 s SER 34 Cb -0.14 0.15 0.04 0.00 0.10 0.00 0.00 66.02 66.16 2cy4 s SER 34 CO 0.04 -0.58 0.39 -1.58 0.98 0.00 0.00 173.24 172.49 2cy4 s GLN 35 N -3.92 0.45 0.04 4.02 0.74 -1.26 -0.94 119.66 118.80 2cy4 s GLN 35 Ca 0.20 0.54 0.04 0.00 0.05 0.00 0.00 55.36 56.19 2cy4 s GLN 35 Cb 0.06 0.22 -0.02 0.00 1.10 0.00 0.00 33.01 34.37 2cy4 s GLN 35 CO 0.01 -0.05 -0.12 0.71 -0.55 0.00 0.00 175.29 175.28 2cy4 s TYR 36 N 0.21 1.08 -0.19 1.67 1.51 0.52 -4.94 117.35 117.21 2cy4 s TYR 36 Ca -0.00 -0.38 -0.23 0.00 -1.01 0.00 0.00 57.07 55.45 2cy4 s TYR 36 Cb -0.03 -0.64 -0.02 0.00 -0.11 0.00 0.00 41.96 41.17 2cy4 s TYR 36 CO 0.00 0.02 0.73 -1.01 -1.11 0.00 0.00 175.55 174.19 2cy4 s HIS 37 N -0.98 3.39 0.28 2.71 3.76 -1.26 0.41 115.29 123.60 2cy4 s HIS 37 Ca -0.01 1.09 0.02 0.00 -0.15 0.00 0.00 55.06 56.01 2cy4 s HIS 37 Cb -0.08 -2.91 -0.05 0.00 1.11 0.00 0.00 32.58 30.64 2cy4 s HIS 37 CO 0.01 -0.22 0.09 0.14 -0.85 0.00 0.00 174.74 173.91 2cy4 s VAL 38 N 2.08 0.75 -0.26 -0.90 -7.23 -1.26 -4.67 120.40 108.91 2cy4 s VAL 38 Ca 0.33 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.46 2cy4 s VAL 38 Cb -0.16 -2.68 0.00 0.00 0.56 0.00 0.00 36.38 34.10 2cy4 s VAL 38 CO 0.11 0.00 0.01 0.20 -0.31 0.00 0.00 175.10 175.11 2cy4 s ASN 39 N -3.37 4.68 0.00 4.85 0.01 -0.88 -4.39 114.94 115.85 2cy4 s ASN 39 Ca 0.37 -0.60 -0.30 0.00 -0.71 0.00 0.00 52.86 51.62 2cy4 s ASN 39 Cb 0.08 -1.79 -0.05 0.00 0.41 0.00 0.00 41.25 39.90 2cy4 s ASN 39 CO 0.14 -0.11 1.22 -2.28 -1.51 0.00 0.00 177.10 174.56 2cy4 s HIS 40 N 1.46 3.28 -0.26 2.20 5.65 0.19 -0.12 115.29 127.70 2cy4 s HIS 40 Ca 0.03 1.22 -0.12 0.00 0.25 0.00 0.00 55.06 56.44 2cy4 s HIS 40 Cb -0.16 -3.44 -0.15 0.00 -1.18 0.00 0.00 32.58 27.65 2cy4 s HIS 40 CO -0.01 -1.39 -0.21 1.28 -0.65 0.00 0.00 174.74 173.76 2cy4 n LEU 41 N 4.61 2.15 -3.51 8.88 4.77 0.55 -1.14 117.00 133.31 2cy4 n LEU 41 Ca 0.10 0.27 -0.15 0.00 -0.03 0.00 0.00 56.01 56.20 2cy4 n LEU 41 Cb 0.46 -0.87 -0.05 0.00 -2.33 0.00 0.00 43.42 40.63 2cy4 n LEU 41 CO 0.56 0.60 0.51 0.68 -1.33 0.00 0.00 177.39 178.41 2cy4 s VAL 42 N -2.49 0.00 -0.09 4.08 -7.23 -1.17 -4.25 120.40 109.25 2cy4 s VAL 42 Ca -0.36 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 59.81 2cy4 s VAL 42 Cb 0.12 -1.00 0.02 0.00 0.56 0.00 0.00 36.38 36.08 2cy4 s VAL 42 CO 0.54 0.00 -0.08 -0.89 -0.31 0.00 0.00 175.10 174.36 2cy4 s THR 43 N -1.90 1.00 0.04 5.32 2.01 -1.26 -1.34 115.64 119.50 2cy4 s THR 43 Ca -0.05 -0.31 -0.02 0.00 0.31 0.00 0.00 61.69 61.62 2cy4 s THR 43 Cb -0.00 -0.99 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 2cy4 s THR 43 CO 0.02 0.35 0.00 0.72 -0.69 0.00 0.00 174.62 175.02 2cy4 s PHE 44 N 1.40 0.37 0.36 4.92 -0.12 -0.60 -4.98 117.98 119.33 2cy4 s PHE 44 Ca -0.01 -0.78 -0.15 0.00 -0.05 0.00 0.00 56.93 55.94 2cy4 s PHE 44 Cb -0.13 -0.27 -0.09 0.00 -0.63 0.00 0.00 43.02 41.90 2cy4 s PHE 44 CO -0.05 -0.33 0.78 0.00 -0.05 0.00 0.00 175.22 175.58 2cy4 s LEU 46 N -3.19 6.06 0.00 0.00 1.43 -0.46 -4.87 118.68 117.66 2cy4 s LEU 46 Ca 0.55 -2.15 0.00 0.00 -1.03 0.00 0.00 54.13 51.50 2cy4 s LEU 46 Cb -0.10 -2.26 0.00 0.00 0.03 0.00 0.00 46.19 43.86 2cy4 s LEU 46 CO 0.20 -0.83 0.00 0.61 0.23 0.00 0.00 176.35 176.56 2cy4 n GLY 47 N 4.74 -1.37 0.00 -3.19 0.00 -1.26 -4.29 105.19 99.82 2cy4 n GLY 47 Ca 0.06 -1.57 0.09 0.00 0.00 0.00 0.00 46.02 44.60 2cy4 n GLY 47 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cy4 n GLU 48 N -0.54 0.56 -3.27 1.61 1.02 -1.26 -4.70 120.64 114.06 2cy4 n GLU 48 Ca 0.00 -0.03 -0.25 0.00 -0.02 0.00 0.00 57.16 56.86 2cy4 n GLU 48 Cb 0.00 -1.43 -0.08 0.00 -0.02 0.00 0.00 31.44 29.91 2cy4 n GLU 48 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2cy4 n GLU 49 N -1.59 1.04 0.00 3.49 1.02 -1.26 -4.85 120.64 118.49 2cy4 n GLU 49 Ca 0.02 -3.53 0.00 0.00 -0.02 0.00 0.00 57.16 53.63 2cy4 n GLU 49 Cb 0.34 -1.48 0.00 0.00 -0.02 0.00 0.00 31.44 30.28 2cy4 n GLU 49 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2cy4 n ASP 50 N 1.45 1.80 0.00 1.62 5.68 -1.26 -5.04 116.55 120.81 2cy4 n ASP 50 Ca 0.24 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.53 2cy4 n ASP 50 Cb 0.50 0.07 0.00 0.00 -1.14 0.00 0.00 41.12 40.55 2cy4 n ASP 50 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2cy4 n GLY 51 N 2.05 0.89 3.38 6.12 0.00 -1.26 -5.04 105.19 111.32 2cy4 n GLY 51 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 2cy4 n GLY 51 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2cy4 s VAL 52 N -2.00 4.83 -0.03 1.61 1.01 -1.26 -4.82 120.40 119.73 2cy4 s VAL 52 Ca 0.00 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.04 2cy4 s VAL 52 Cb 0.00 -4.48 -0.04 0.00 0.00 0.00 0.00 36.38 31.86 2cy4 s VAL 52 CO 0.00 -1.10 0.01 1.41 0.00 0.00 0.00 175.10 175.42 2cy4 n HIS 53 N 6.31 0.00 -4.45 5.22 8.25 -1.26 -4.95 115.22 124.35 2cy4 n HIS 53 Ca -0.09 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.07 2cy4 n HIS 53 Cb 0.43 -0.16 -0.06 0.00 1.12 0.00 0.00 29.99 31.31 2cy4 n HIS 53 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 2cy4 s THR 54 N -2.08 1.56 0.12 1.59 -4.23 -1.26 -5.01 115.64 106.33 2cy4 s THR 54 Ca -0.02 -1.84 -0.15 0.00 -1.18 0.00 0.00 61.69 58.51 2cy4 s THR 54 Cb 0.01 -2.40 -0.03 0.00 1.34 0.00 0.00 72.50 71.42 2cy4 s THR 54 CO 0.13 0.00 1.56 0.58 -0.54 0.00 0.00 174.62 176.35 2cy4 h VAL 55 N 1.28 1.26 -0.93 2.29 2.07 -1.99 -1.35 116.25 118.89 2cy4 h VAL 55 Ca -0.42 -1.02 -0.01 0.00 0.82 0.00 0.00 66.70 66.07 2cy4 h VAL 55 Cb 1.29 1.17 -0.04 0.00 -1.52 0.00 0.00 31.29 32.19 2cy4 h VAL 55 CO 0.71 0.34 0.56 -0.33 0.02 0.00 0.00 177.57 178.86 2cy4 h GLU 56 N 0.49 1.26 -0.64 1.57 3.07 -1.99 -0.18 114.58 118.17 2cy4 h GLU 56 Ca 0.11 -0.12 -0.02 0.00 -0.50 0.00 0.00 59.36 58.83 2cy4 h GLU 56 Cb 0.49 -0.26 -0.03 0.00 -0.84 0.00 0.00 28.75 28.10 2cy4 h GLU 56 CO 0.02 0.89 0.31 -0.44 -1.40 0.00 0.00 179.01 178.39 2cy4 h ASP 57 N 1.28 0.84 -0.35 1.42 3.32 -1.85 0.16 116.42 121.24 2cy4 h ASP 57 Ca 0.33 -0.13 0.01 0.00 0.02 0.00 0.00 57.03 57.27 2cy4 h ASP 57 Cb -0.05 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.26 2cy4 h ASP 57 CO -0.06 0.73 0.21 0.00 -1.72 0.00 0.00 179.24 178.40 2cy4 h ALA 58 N 1.14 0.44 -0.78 3.45 0.00 -0.58 -0.55 119.26 122.38 2cy4 h ALA 58 Ca 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 2cy4 h ALA 58 Cb 0.12 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2cy4 h ALA 58 CO -0.03 -0.14 0.46 0.77 0.00 0.00 0.00 179.25 180.32 2cy4 h SER 59 N 0.43 0.94 -0.26 0.00 0.02 -0.89 -2.05 113.55 111.74 2cy4 h SER 59 Ca 0.14 -0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 61.02 2cy4 h SER 59 Cb -0.01 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 2cy4 h SER 59 CO -0.06 0.73 0.15 -0.09 -1.14 0.00 0.00 176.83 176.42 2cy4 h ARG 60 N 1.06 0.35 -0.74 3.45 2.43 -0.66 -1.57 114.38 118.70 2cy4 h ARG 60 Ca 0.28 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.43 2cy4 h ARG 60 Cb -0.03 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.41 2cy4 h ARG 60 CO -0.05 0.29 0.49 -0.22 -1.51 0.00 0.00 179.97 178.97 2cy4 h LYS 61 N 0.31 0.94 -0.36 0.20 3.64 -0.90 0.30 116.57 120.71 2cy4 h LYS 61 Ca 0.09 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2cy4 h LYS 61 Cb 0.04 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 2cy4 h LYS 61 CO -0.02 0.62 0.14 1.25 -2.27 0.00 0.00 179.45 179.17 2cy4 h LEU 62 N 0.97 0.50 -0.44 5.20 5.85 -0.97 -2.92 115.31 123.50 2cy4 h LEU 62 Ca 0.28 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.85 2cy4 h LEU 62 Cb -0.05 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 40.82 2cy4 h LEU 62 CO -0.07 0.54 0.25 0.00 -0.34 0.00 0.00 178.44 178.82 2cy4 h ALA 63 N 0.98 0.56 0.00 1.25 0.00 -0.36 0.73 119.26 122.42 2cy4 h ALA 63 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2cy4 h ALA 63 Cb 0.20 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2cy4 h ALA 63 CO -0.01 -0.08 0.00 0.28 0.00 0.00 0.00 179.25 179.44 2cy4 n VAL 64 N -4.86 0.09 0.00 0.00 0.31 0.01 -1.41 118.33 112.47 2cy4 n VAL 64 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 2cy4 n VAL 64 Cb 0.08 -0.38 0.00 0.00 -0.91 0.00 0.00 33.84 32.63 2cy4 n VAL 64 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2cy4 n ASP 66 N 0.74 0.00 0.22 4.52 2.03 0.25 -1.58 116.55 122.72 2cy4 n ASP 66 Ca 0.00 0.00 0.15 0.00 0.52 0.00 0.00 54.79 55.46 2cy4 n ASP 66 Cb 0.06 0.00 0.75 0.00 -0.72 0.00 0.00 41.12 41.20 2cy4 n ASP 66 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2cy4 h SER 67 N 0.00 0.00 -0.55 1.67 4.64 -1.50 -1.11 113.55 116.71 2cy4 h SER 67 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2cy4 h SER 67 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2cy4 h SER 67 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2cy4 n GLN 68 N -2.59 2.32 -2.34 4.77 6.02 -0.62 -4.91 117.38 120.03 2cy4 n GLN 68 Ca -0.01 -2.04 -0.18 0.00 -0.01 0.00 0.00 57.00 54.76 2cy4 n GLN 68 Cb 0.13 -1.45 -0.01 0.00 1.02 0.00 0.00 30.24 29.93 2cy4 n GLN 68 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cy4 n GLY 69 N 1.41 -0.37 0.99 1.08 0.00 -0.42 -4.90 105.19 102.97 2cy4 n GLY 69 Ca 0.19 -0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.19 2cy4 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cy4 n ARG 70 N -2.76 2.67 -4.06 1.61 1.74 -1.26 -4.91 116.66 109.70 2cy4 n ARG 70 Ca -0.22 -2.30 -0.32 0.00 -0.77 0.00 0.00 57.85 54.24 2cy4 n ARG 70 Cb 0.67 -1.42 -0.16 0.00 -1.02 0.00 0.00 32.46 30.53 2cy4 n ARG 70 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2cy4 s VAL 71 N -1.04 1.92 -0.19 1.55 1.01 -1.26 -4.88 120.40 117.50 2cy4 s VAL 71 Ca 0.35 -1.15 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 2cy4 s VAL 71 Cb 0.19 -1.91 0.05 0.00 0.00 0.00 0.00 36.38 34.71 2cy4 s VAL 71 CO 0.25 0.24 -0.03 0.26 0.00 0.00 0.00 175.10 175.82 2cy4 s TRP 72 N 1.28 1.75 -0.12 5.22 0.23 -1.26 -4.96 118.94 121.08 2cy4 s TRP 72 Ca -0.01 -1.23 -0.35 0.00 -2.03 0.00 0.00 56.10 52.47 2cy4 s TRP 72 Cb -0.16 -1.32 -0.13 0.00 0.03 0.00 0.00 33.47 31.89 2cy4 s TRP 72 CO -0.09 -0.66 1.85 0.00 0.96 0.00 0.00 176.95 179.01 2cy4 n ALA 73 N 4.85 0.67 -3.49 0.98 0.00 -1.26 -4.78 120.51 117.48 2cy4 n ALA 73 Ca -0.11 0.31 -0.34 0.00 0.00 0.00 0.00 53.44 53.30 2cy4 n ALA 73 Cb 0.46 -2.44 -0.15 0.00 0.00 0.00 0.00 19.45 17.33 2cy4 n ALA 73 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2cy4 s GLN 74 N 3.89 3.27 0.89 0.00 0.74 -0.29 -4.91 119.66 123.23 2cy4 s GLN 74 Ca 0.94 -0.71 -0.11 0.00 0.05 0.00 0.00 55.36 55.52 2cy4 s GLN 74 Cb -0.77 -2.73 0.12 0.00 1.10 0.00 0.00 33.01 30.73 2cy4 s GLN 74 CO 0.54 -0.04 1.09 -2.00 -0.55 0.00 0.00 175.29 174.33 2cy4 s GLU 75 N 0.99 1.32 -0.10 1.67 2.12 -1.26 0.57 118.70 124.02 2cy4 s GLU 75 Ca -0.01 1.00 0.03 0.00 0.36 0.00 0.00 54.97 56.35 2cy4 s GLU 75 Cb -0.15 -1.80 0.00 0.00 0.26 0.00 0.00 34.13 32.45 2cy4 s GLU 75 CO -0.02 -2.25 -0.21 -0.51 -0.54 0.00 0.00 175.26 171.74 2cy4 s LEU 77 N -6.27 1.98 -0.23 2.70 1.02 -0.12 -4.63 118.68 113.13 2cy4 s LEU 77 Ca 0.64 -0.51 -0.01 0.00 0.02 0.00 0.00 54.13 54.27 2cy4 s LEU 77 Cb -0.19 -1.28 0.02 0.00 0.02 0.00 0.00 46.19 44.77 2cy4 s LEU 77 CO 0.57 0.11 -0.09 -0.22 0.02 0.00 0.00 176.35 176.75 2cy4 s LEU 78 N 0.52 2.94 -0.11 1.79 0.20 0.17 -1.18 118.68 123.00 2cy4 s LEU 78 Ca -0.16 -0.78 -0.00 0.00 0.69 0.00 0.00 54.13 53.88 2cy4 s LEU 78 Cb -0.17 -1.63 -0.02 0.00 -0.43 0.00 0.00 46.19 43.94 2cy4 s LEU 78 CO 0.06 -0.09 -0.09 -0.60 -0.29 0.00 0.00 176.35 175.34 2cy4 s ARG 79 N 1.33 3.18 -0.16 1.98 3.52 0.26 -0.36 118.95 128.70 2cy4 s ARG 79 Ca 0.01 -0.60 0.01 0.00 -0.13 0.00 0.00 55.73 55.03 2cy4 s ARG 79 Cb -0.16 -2.67 0.01 0.00 -1.56 0.00 0.00 34.95 30.57 2cy4 s ARG 79 CO -0.06 0.40 -0.19 0.08 -0.81 0.00 0.00 175.30 174.73 2cy4 s VAL 80 N -0.12 2.31 0.38 7.11 1.01 -0.11 0.09 120.40 131.07 2cy4 s VAL 80 Ca 0.01 -0.88 0.04 0.00 0.00 0.00 0.00 61.98 61.14 2cy4 s VAL 80 Cb -0.13 -1.96 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 2cy4 s VAL 80 CO 0.03 0.53 0.09 -0.94 0.00 0.00 0.00 175.10 174.81 2cy4 s SER 81 N 0.94 2.72 0.60 3.32 1.04 -0.16 -0.68 113.70 121.48 2cy4 s SER 81 Ca -0.03 -1.54 0.35 0.00 0.48 0.00 0.00 55.95 55.20 2cy4 s SER 81 Cb -0.15 0.25 1.92 0.00 0.10 0.00 0.00 66.02 68.14 2cy4 s SER 81 CO -0.04 -0.78 2.23 -0.65 0.98 0.00 0.00 173.24 174.98 2cy4 h PRO 82 N 1.89 0.00 0.00 4.02 0.11 -1.88 -3.21 132.00 132.92 2cy4 h PRO 82 Ca -0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.73 2cy4 h PRO 82 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2cy4 h PRO 82 CO 0.64 0.03 -0.78 -1.13 -0.21 0.00 0.00 178.00 176.55 2cy4 n SER 83 N -3.47 1.94 -3.74 -2.05 3.41 -1.26 -4.77 113.62 103.67 2cy4 n SER 83 Ca -0.02 -0.32 -0.09 0.00 -0.26 0.00 0.00 58.87 58.18 2cy4 n SER 83 Cb 0.13 1.14 -0.03 0.00 -0.26 0.00 0.00 64.21 65.19 2cy4 n SER 83 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cy4 s GLN 84 N -1.99 1.52 -0.14 4.33 -2.07 -1.22 -1.40 119.66 118.69 2cy4 s GLN 84 Ca -0.00 -0.86 -0.01 0.00 -1.82 0.00 0.00 55.36 52.67 2cy4 s GLN 84 Cb 0.04 0.56 -0.02 0.00 -1.09 0.00 0.00 33.01 32.51 2cy4 s GLN 84 CO 0.25 -0.67 -0.11 0.08 -1.32 0.00 0.00 175.29 173.52 2cy4 s VAL 85 N -3.88 3.16 0.01 3.63 1.01 -0.52 -0.99 120.40 122.83 2cy4 s VAL 85 Ca 0.09 -0.62 0.08 0.00 0.00 0.00 0.00 61.98 61.54 2cy4 s VAL 85 Cb -0.03 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.99 2cy4 s VAL 85 CO -0.00 0.51 -0.25 -0.89 0.00 0.00 0.00 175.10 174.47 2cy4 s THR 86 N 0.43 2.03 -0.15 3.92 2.01 0.11 -0.37 115.64 123.63 2cy4 s THR 86 Ca -0.09 -1.23 -0.03 0.00 0.31 0.00 0.00 61.69 60.66 2cy4 s THR 86 Cb -0.16 -1.72 -0.02 0.00 0.01 0.00 0.00 72.50 70.62 2cy4 s THR 86 CO 0.05 0.45 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.61 2cy4 s LEU 87 N -0.92 3.10 0.15 4.42 1.43 0.39 -0.58 118.68 126.66 2cy4 s LEU 87 Ca 0.10 -0.20 0.02 0.00 -1.03 0.00 0.00 54.13 53.03 2cy4 s LEU 87 Cb -0.10 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 2cy4 s LEU 87 CO 0.01 0.16 -0.04 -0.76 0.23 0.00 0.00 176.35 175.94 2cy4 s LEU 88 N 0.44 2.31 -0.08 1.79 1.02 -0.33 0.10 118.68 123.93 2cy4 s LEU 88 Ca -0.05 -1.10 -0.25 0.00 0.02 0.00 0.00 54.13 52.76 2cy4 s LEU 88 Cb -0.15 -0.12 -0.03 0.00 0.02 0.00 0.00 46.19 45.91 2cy4 s LEU 88 CO 0.03 -0.49 0.77 -0.62 0.02 0.00 0.00 176.35 176.06 2cy4 s ASP 89 N -3.14 7.03 0.25 2.29 -1.08 -1.09 -0.95 116.67 119.98 2cy4 s ASP 89 Ca 0.19 1.24 -0.05 0.00 -0.52 0.00 0.00 52.55 53.41 2cy4 s ASP 89 Cb 0.05 -2.44 0.28 0.00 -1.46 0.00 0.00 42.92 39.35 2cy4 s ASP 89 CO 0.01 -0.20 1.87 -0.65 0.52 0.00 0.00 175.17 176.72 2cy4 h PRO 90 N 6.91 1.17 0.00 4.34 0.11 -1.94 0.24 132.00 142.83 2cy4 h PRO 90 Ca -0.38 -0.14 0.00 0.00 0.11 0.00 0.00 66.00 65.59 2cy4 h PRO 90 Cb 1.19 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.07 2cy4 h PRO 90 CO 0.77 0.86 0.00 0.28 -0.21 0.00 0.00 178.00 179.70 2cy4 n VAL 91 N -4.34 0.00 -0.18 3.15 0.31 -1.26 -4.31 118.33 111.70 2cy4 n VAL 91 Ca 0.09 0.47 -0.02 0.00 -0.01 0.00 0.00 64.34 64.87 2cy4 n VAL 91 Cb 0.10 -1.11 0.08 0.00 -0.91 0.00 0.00 33.84 32.00 2cy4 n VAL 91 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2cy4 h SER 92 N 0.00 0.13 0.00 4.52 4.64 -1.99 -3.46 113.55 117.39 2cy4 h SER 92 Ca 0.00 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.40 2cy4 h SER 92 Cb 0.00 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 2cy4 h SER 92 CO 0.00 0.09 0.00 0.29 -0.87 0.00 0.00 176.83 176.34 2cy4 n LYS 93 N -5.04 0.00 -4.35 4.77 4.01 0.83 -4.99 118.16 113.38 2cy4 n LYS 93 Ca 0.07 0.31 -0.34 0.00 -0.51 0.00 0.00 58.31 57.83 2cy4 n LYS 93 Cb 0.24 -2.70 -0.10 0.00 -0.51 0.00 0.00 35.03 31.96 2cy4 n LYS 93 CO 0.00 0.00 0.00 -1.21 -1.11 0.00 0.00 177.40 175.08 2cy4 s GLU 94 N -1.52 3.28 0.22 1.97 2.02 -1.25 -4.74 118.70 118.67 2cy4 s GLU 94 Ca 0.00 -0.44 -0.30 0.00 0.02 0.00 0.00 54.97 54.25 2cy4 s GLU 94 Cb 0.00 -2.87 -0.16 0.00 0.10 0.00 0.00 34.13 31.21 2cy4 s GLU 94 CO 0.00 0.52 0.95 0.39 0.02 0.00 0.00 175.26 177.14 2cy4 n GLU 95 N 2.70 0.90 -0.02 1.61 1.02 -1.26 -2.67 120.64 122.93 2cy4 n GLU 95 Ca -0.18 0.32 -0.01 0.00 -0.02 0.00 0.00 57.16 57.27 2cy4 n GLU 95 Cb 0.53 -1.65 -0.04 0.00 -0.02 0.00 0.00 31.44 30.27 2cy4 n GLU 95 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2cy4 n LEU 96 N 1.67 0.00 -3.55 -4.62 4.77 0.12 -4.90 117.00 110.49 2cy4 n LEU 96 Ca 0.14 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.96 2cy4 n LEU 96 Cb 0.27 0.09 -0.06 0.00 -2.33 0.00 0.00 43.42 41.39 2cy4 n LEU 96 CO 0.59 0.09 0.54 -0.70 -1.33 0.00 0.00 177.39 176.58 2cy4 s GLU 97 N -2.17 0.90 -0.04 3.23 2.56 -1.00 -5.00 118.70 117.18 2cy4 s GLU 97 Ca -0.02 0.28 -0.01 0.00 0.00 0.00 0.00 54.97 55.22 2cy4 s GLU 97 Cb 0.02 0.43 0.03 0.00 2.00 0.00 0.00 34.13 36.61 2cy4 s GLU 97 CO 0.20 -0.27 0.07 0.45 -0.56 0.00 0.00 175.26 175.15 2cy4 s SER 98 N -1.03 -0.00 -0.27 -1.70 0.15 -1.26 -0.47 113.70 109.12 2cy4 s SER 98 Ca -0.07 0.14 0.03 0.00 0.70 0.00 0.00 55.95 56.74 2cy4 s SER 98 Cb -0.01 0.03 0.07 0.00 -1.71 0.00 0.00 66.02 64.41 2cy4 s SER 98 CO 0.07 -0.13 -0.07 -0.31 1.20 0.00 0.00 173.24 173.99 2cy4 s TYR 99 N 1.05 3.30 0.71 3.44 1.51 0.50 -4.98 117.35 122.88 2cy4 s TYR 99 Ca -0.08 -2.42 -0.16 0.00 -1.01 0.00 0.00 57.07 53.39 2cy4 s TYR 99 Cb -0.12 -2.10 0.01 0.00 -0.11 0.00 0.00 41.96 39.64 2cy4 s TYR 99 CO -0.04 -0.89 1.08 -0.35 -1.11 0.00 0.00 175.55 174.24 2cy4 n PRO 100 N 4.41 0.63 0.29 -1.71 -0.04 -1.26 -1.44 135.00 135.89 2cy4 n PRO 100 Ca -0.10 0.27 0.16 0.00 -0.04 0.00 0.00 63.50 63.79 2cy4 n PRO 100 Cb 0.42 -2.32 0.90 0.00 -0.04 0.00 0.00 33.50 32.46 2cy4 n PRO 100 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 2cy4 h LEU 101 N -0.11 0.00 -0.06 1.53 3.38 -1.59 -0.64 115.31 117.82 2cy4 h LEU 101 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2cy4 h LEU 101 Cb 1.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.08 2cy4 h LEU 101 CO 0.48 0.04 0.00 -0.90 0.09 0.00 0.00 178.44 178.16 2cy4 n ASP 102 N -3.60 0.13 -0.52 -0.43 5.75 -1.26 -2.17 116.55 114.45 2cy4 n ASP 102 Ca -0.02 0.52 0.14 0.00 -0.01 0.00 0.00 54.79 55.41 2cy4 n ASP 102 Cb 0.15 -0.55 0.46 0.00 -1.03 0.00 0.00 41.12 40.14 2cy4 n ASP 102 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2cy4 n ALA 103 N -1.55 2.60 -2.68 2.12 0.00 -0.25 -4.84 120.51 115.92 2cy4 n ALA 103 Ca 0.05 -0.47 -0.38 0.00 0.00 0.00 0.00 53.44 52.64 2cy4 n ALA 103 Cb 0.27 -1.12 -0.08 0.00 0.00 0.00 0.00 19.45 18.53 2cy4 n ALA 103 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2cy4 s ILE 104 N -2.04 5.24 -0.16 0.00 1.01 -0.92 -0.70 121.20 123.63 2cy4 s ILE 104 Ca 0.36 0.58 -0.19 0.00 0.00 0.00 0.00 60.65 61.40 2cy4 s ILE 104 Cb 0.21 -3.67 -0.23 0.00 0.01 0.00 0.00 42.46 38.78 2cy4 s ILE 104 CO 0.35 0.29 0.39 0.58 0.00 0.00 0.00 174.94 176.54 2cy4 h VAL 105 N 4.99 1.01 -2.74 2.92 2.07 -0.57 -3.49 116.25 120.44 2cy4 h VAL 105 Ca -0.37 -2.28 0.08 0.00 0.82 0.00 0.00 66.70 64.95 2cy4 h VAL 105 Cb 1.16 2.52 -0.09 0.00 -1.52 0.00 0.00 31.29 33.37 2cy4 h VAL 105 CO 0.71 0.53 0.32 0.00 0.02 0.00 0.00 177.57 179.15 2cy4 s ARG 106 N -2.40 1.40 -0.15 1.57 1.70 -1.09 -4.99 118.95 114.99 2cy4 s ARG 106 Ca -0.24 -0.70 -0.07 0.00 -0.47 0.00 0.00 55.73 54.24 2cy4 s ARG 106 Cb 0.05 0.52 0.06 0.00 -0.57 0.00 0.00 34.95 35.01 2cy4 s ARG 106 CO 0.67 -0.63 0.34 0.00 -1.08 0.00 0.00 175.30 174.60 2cy4 s ASP 108 N 1.68 0.32 -0.25 0.00 1.11 -0.35 -4.96 116.67 114.22 2cy4 s ASP 108 Ca -0.07 -0.83 -0.08 0.00 0.18 0.00 0.00 52.55 51.74 2cy4 s ASP 108 Cb -0.10 0.26 -0.04 0.00 1.07 0.00 0.00 42.92 44.11 2cy4 s ASP 108 CO -0.11 -0.65 0.10 0.00 1.18 0.00 0.00 175.17 175.69 2cy4 s ALA 109 N -3.84 3.28 0.00 5.23 0.00 -1.26 -0.03 121.76 125.14 2cy4 s ALA 109 Ca 0.06 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 50.93 2cy4 s ALA 109 Cb 0.06 -2.17 0.00 0.00 0.00 0.00 0.00 23.12 21.01 2cy4 s ALA 109 CO -0.10 -0.44 0.00 0.28 0.00 0.00 0.00 175.76 175.49 2cy4 n VAL 110 N 4.84 0.00 -3.72 0.00 0.31 0.33 -4.89 118.33 115.20 2cy4 n VAL 110 Ca -0.16 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.04 2cy4 n VAL 110 Cb 0.52 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.35 2cy4 n VAL 110 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2cy4 s PRO 112 N 1.24 0.59 0.28 5.55 0.04 -1.26 0.53 135.00 141.98 2cy4 s PRO 112 Ca 0.00 0.40 -0.30 0.00 0.04 0.00 0.00 61.00 61.14 2cy4 s PRO 112 Cb 0.00 0.28 -0.12 0.00 0.04 0.00 0.00 34.50 34.70 2cy4 s PRO 112 CO 0.00 -0.11 1.48 0.54 0.04 0.00 0.00 177.00 178.96 2cy4 n ARG 113 N 2.34 2.38 0.00 4.56 1.74 -1.26 -1.77 116.66 124.65 2cy4 n ARG 113 Ca -0.16 0.84 0.00 0.00 -0.77 0.00 0.00 57.85 57.77 2cy4 n ARG 113 Cb 0.57 -2.55 0.00 0.00 -1.02 0.00 0.00 32.46 29.45 2cy4 n ARG 113 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2cy4 n GLY 114 N 1.92 2.69 4.01 -0.13 0.00 -1.26 -5.05 105.19 107.37 2cy4 n GLY 114 Ca 0.09 -0.79 -0.18 0.00 0.00 0.00 0.00 46.02 45.14 2cy4 n GLY 114 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2cy4 s ARG 115 N 0.00 2.62 0.00 1.61 0.52 -0.73 -5.06 118.95 117.92 2cy4 s ARG 115 Ca 0.00 -1.41 0.00 0.00 -0.52 0.00 0.00 55.73 53.80 2cy4 s ARG 115 Cb 0.00 -2.70 0.00 0.00 0.52 0.00 0.00 34.95 32.77 2cy4 s ARG 115 CO 0.00 -0.48 0.00 -1.13 0.02 0.00 0.00 175.30 173.71 2cy4 n SER 116 N -1.98 3.05 -4.62 0.23 3.41 -1.26 -4.82 113.62 107.63 2cy4 n SER 116 Ca 0.10 -0.02 -0.34 0.00 -0.26 0.00 0.00 58.87 58.35 2cy4 n SER 116 Cb 0.60 0.65 -0.10 0.00 -0.26 0.00 0.00 64.21 65.10 2cy4 n SER 116 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2cy4 s ARG 117 N -1.26 3.88 0.66 4.33 0.52 -1.26 -5.08 118.95 120.74 2cy4 s ARG 117 Ca 0.00 -0.37 -0.18 0.00 -0.52 0.00 0.00 55.73 54.67 2cy4 s ARG 117 Cb 0.00 -3.15 -0.01 0.00 0.52 0.00 0.00 34.95 32.31 2cy4 s ARG 117 CO 0.00 0.30 1.23 0.43 0.02 0.00 0.00 175.30 177.28 2cy4 n SER 118 N 3.43 1.77 -4.65 0.23 7.64 -1.26 -4.84 113.62 115.95 2cy4 n SER 118 Ca -0.17 0.80 -0.31 0.00 1.01 0.00 0.00 58.87 60.20 2cy4 n SER 118 Cb 0.52 -1.53 -0.09 0.00 -1.01 0.00 0.00 64.21 62.11 2cy4 n SER 118 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2cy4 s LEU 119 N -4.11 3.33 -0.20 -3.43 1.43 0.19 -4.28 118.68 111.61 2cy4 s LEU 119 Ca 0.81 -0.18 -0.21 0.00 -1.03 0.00 0.00 54.13 53.53 2cy4 s LEU 119 Cb -0.38 -2.02 -0.03 0.00 0.03 0.00 0.00 46.19 43.80 2cy4 s LEU 119 CO 0.42 0.22 0.62 -0.22 0.23 0.00 0.00 176.35 177.62 2cy4 s LEU 120 N -1.97 4.14 -0.16 1.79 2.96 0.26 -0.51 118.68 125.18 2cy4 s LEU 120 Ca 0.22 0.81 -0.05 0.00 -0.22 0.00 0.00 54.13 54.89 2cy4 s LEU 120 Cb -0.11 -2.87 -0.03 0.00 0.50 0.00 0.00 46.19 43.67 2cy4 s LEU 120 CO 0.14 -0.27 0.01 -0.22 -1.32 0.00 0.00 176.35 174.68 2cy4 s LEU 121 N 1.93 3.50 -0.06 -0.68 2.96 0.95 -1.23 118.68 126.06 2cy4 s LEU 121 Ca 0.28 -0.03 0.02 0.00 -0.22 0.00 0.00 54.13 54.18 2cy4 s LEU 121 Cb -0.16 -1.86 0.02 0.00 0.50 0.00 0.00 46.19 44.69 2cy4 s LEU 121 CO 0.10 0.18 -0.10 -0.22 -1.32 0.00 0.00 176.35 174.99 2cy4 s LEU 122 N 0.31 1.55 -0.11 -0.68 0.20 -0.61 -1.21 118.68 118.13 2cy4 s LEU 122 Ca -0.00 -0.25 0.02 0.00 0.69 0.00 0.00 54.13 54.58 2cy4 s LEU 122 Cb -0.13 -0.72 -0.01 0.00 -0.43 0.00 0.00 46.19 44.90 2cy4 s LEU 122 CO 0.02 0.01 -0.17 -0.69 -0.29 0.00 0.00 176.35 175.22 2cy4 s VAL 123 N 0.74 2.67 0.14 1.68 1.01 -0.24 -0.29 120.40 126.11 2cy4 s VAL 123 Ca -0.13 -0.80 0.00 0.00 0.00 0.00 0.00 61.98 61.05 2cy4 s VAL 123 Cb -0.15 -2.08 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 2cy4 s VAL 123 CO 0.03 0.54 0.01 0.00 0.00 0.00 0.00 175.10 175.68 2cy4 s GLN 125 N -3.95 0.52 0.49 0.00 2.00 0.12 0.04 119.66 118.88 2cy4 s GLN 125 Ca 0.21 -1.13 -0.23 0.00 -2.00 0.00 0.00 55.36 52.21 2cy4 s GLN 125 Cb 0.07 -1.41 -0.07 0.00 0.80 0.00 0.00 33.01 32.40 2cy4 s GLN 125 CO 0.01 -1.13 1.35 -1.21 -0.50 0.00 0.00 175.29 173.81 2cy4 s GLU 126 N 1.36 3.46 0.12 1.67 2.02 -1.26 -4.70 118.70 121.38 2cy4 s GLU 126 Ca 0.15 2.24 -0.22 0.00 0.02 0.00 0.00 54.97 57.15 2cy4 s GLU 126 Cb -0.21 -2.45 -0.06 0.00 0.10 0.00 0.00 34.13 31.51 2cy4 s GLU 126 CO -0.13 -0.93 1.69 -1.35 0.02 0.00 0.00 175.26 174.56 2cy4 h PRO 127 N 1.92 -0.13 0.00 0.39 0.11 -1.98 -2.57 132.00 129.74 2cy4 h PRO 127 Ca -0.51 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2cy4 h PRO 127 Cb 1.28 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.42 2cy4 h PRO 127 CO 0.59 -0.08 0.02 1.05 -0.21 0.00 0.00 178.00 179.37 2cy4 h GLU 128 N -0.13 0.00 -6.21 1.05 4.11 -2.01 -3.44 114.58 107.94 2cy4 h GLU 128 Ca 0.06 0.00 -0.57 0.00 0.07 0.00 0.00 59.36 58.92 2cy4 h GLU 128 Cb 0.22 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 2cy4 h GLU 128 CO -0.15 0.00 -0.18 1.03 0.07 0.00 0.00 179.01 179.78 2cy4 s ARG 129 N -4.10 3.84 0.23 1.06 0.52 -0.97 -5.00 118.95 114.53 2cy4 s ARG 129 Ca -0.05 0.29 0.08 0.00 -0.52 0.00 0.00 55.73 55.53 2cy4 s ARG 129 Cb 0.12 -2.94 0.22 0.00 0.52 0.00 0.00 34.95 32.86 2cy4 s ARG 129 CO 0.39 0.51 1.53 0.00 0.02 0.00 0.00 175.30 177.74 2cy4 h ALA 130 N 3.55 0.81 -2.53 2.13 0.00 -1.86 -3.46 119.26 117.90 2cy4 h ALA 130 Ca -0.49 -0.62 -0.41 0.00 0.00 0.00 0.00 54.91 53.39 2cy4 h ALA 130 Cb 1.19 -0.10 -0.16 0.00 0.00 0.00 0.00 17.79 18.72 2cy4 h ALA 130 CO 0.67 0.84 -0.74 -0.65 0.00 0.00 0.00 179.25 179.36 2cy4 s GLN 131 N -3.48 1.14 0.73 0.00 -0.21 -1.26 -5.14 119.66 111.45 2cy4 s GLN 131 Ca -0.02 -1.41 -0.11 0.00 0.02 0.00 0.00 55.36 53.85 2cy4 s GLN 131 Cb 0.12 -0.93 0.04 0.00 1.00 0.00 0.00 33.01 33.24 2cy4 s GLN 131 CO 0.79 0.16 1.10 -1.25 -2.12 0.00 0.00 175.29 173.96 2cy4 s PRO 132 N -3.24 2.52 0.14 2.91 0.04 -1.26 -4.65 135.00 131.45 2cy4 s PRO 132 Ca 0.15 0.24 0.09 0.00 0.04 0.00 0.00 61.00 61.52 2cy4 s PRO 132 Cb -0.02 -2.04 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 2cy4 s PRO 132 CO 0.04 -1.20 -0.20 -0.51 0.04 0.00 0.00 177.00 175.16 2cy4 s ASP 133 N -4.44 2.70 -0.11 6.66 1.01 0.11 -1.35 116.67 121.24 2cy4 s ASP 133 Ca 0.59 -0.78 -0.02 0.00 0.71 0.00 0.00 52.55 53.05 2cy4 s ASP 133 Cb -0.11 -0.16 -0.03 0.00 1.01 0.00 0.00 42.92 43.63 2cy4 s ASP 133 CO 0.50 0.03 -0.02 -0.69 0.21 0.00 0.00 175.17 175.19 2cy4 s VAL 134 N -1.59 4.11 -0.06 -1.27 1.01 0.80 -1.63 120.40 121.78 2cy4 s VAL 134 Ca 0.12 -0.30 0.03 0.00 0.00 0.00 0.00 61.98 61.82 2cy4 s VAL 134 Cb -0.08 -2.76 0.01 0.00 0.00 0.00 0.00 36.38 33.55 2cy4 s VAL 134 CO 0.06 0.56 -0.14 -1.00 0.00 0.00 0.00 175.10 174.57 2cy4 s HIS 135 N -0.35 1.59 -0.12 5.22 0.09 0.60 -1.55 115.29 120.77 2cy4 s HIS 135 Ca 0.06 -0.56 -0.00 0.00 -0.00 0.00 0.00 55.06 54.56 2cy4 s HIS 135 Cb -0.12 -1.13 -0.02 0.00 -0.00 0.00 0.00 32.58 31.31 2cy4 s HIS 135 CO 0.02 -0.26 -0.11 -0.06 -0.00 0.00 0.00 174.74 174.34 2cy4 s PHE 136 N 0.46 2.85 0.10 1.40 0.08 -0.45 -1.57 117.98 120.85 2cy4 s PHE 136 Ca -0.12 -0.45 0.07 0.00 0.12 0.00 0.00 56.93 56.55 2cy4 s PHE 136 Cb -0.15 -1.83 -0.03 0.00 -0.57 0.00 0.00 43.02 40.44 2cy4 s PHE 136 CO 0.04 -0.07 -0.17 -0.06 -0.10 0.00 0.00 175.22 174.86 2cy4 s PHE 137 N 0.10 1.49 -0.01 0.36 0.40 -0.37 -0.33 117.98 119.63 2cy4 s PHE 137 Ca -0.05 -0.47 -0.18 0.00 -0.60 0.00 0.00 56.93 55.63 2cy4 s PHE 137 Cb -0.14 -0.81 -0.06 0.00 0.51 0.00 0.00 43.02 42.52 2cy4 s PHE 137 CO 0.04 0.15 0.52 -0.65 0.70 0.00 0.00 175.22 175.97 2cy4 s GLN 138 N -2.08 4.19 0.09 0.44 -0.21 0.83 -0.57 119.66 122.35 2cy4 s GLN 138 Ca 0.04 0.59 0.27 0.00 0.02 0.00 0.00 55.36 56.29 2cy4 s GLN 138 Cb -0.09 -3.31 0.95 0.00 1.00 0.00 0.00 33.01 31.57 2cy4 s GLN 138 CO 0.03 0.47 1.78 0.41 -2.12 0.00 0.00 175.29 175.87 2cy4 n GLY 139 N 2.29 -1.55 7.00 3.09 0.00 -1.26 -2.06 105.19 112.70 2cy4 n GLY 139 Ca -0.10 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.82 2cy4 n GLY 139 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2cy4 n LEU 140 N -1.83 0.00 0.13 0.99 4.32 -1.26 -1.86 117.00 117.48 2cy4 n LEU 140 Ca 0.06 0.00 -0.13 0.00 -0.02 0.00 0.00 56.01 55.92 2cy4 n LEU 140 Cb 0.38 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 42.11 2cy4 n LEU 140 CO 0.30 0.00 0.81 0.25 -1.22 0.00 0.00 177.39 177.52 2cy4 h LEU 141 N 0.00 -0.22 -1.31 2.23 5.85 -1.96 -2.28 115.31 117.62 2cy4 h LEU 141 Ca 0.00 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 2cy4 h LEU 141 Cb 0.00 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 2cy4 h LEU 141 CO 0.00 -0.15 -0.30 -0.07 -0.34 0.00 0.00 178.44 177.58 2cy4 h LEU 142 N -0.25 0.07 0.00 2.25 3.38 -1.93 -3.48 115.31 115.35 2cy4 h LEU 142 Ca -0.02 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2cy4 h LEU 142 Cb 0.20 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2cy4 h LEU 142 CO 0.03 0.37 0.00 0.61 0.09 0.00 0.00 178.44 179.54 2cy4 n GLY 143 N -0.61 -0.11 0.32 0.83 0.00 -0.78 -4.46 105.19 100.38 2cy4 n GLY 143 Ca -0.02 -1.57 -0.04 0.00 0.00 0.00 0.00 46.02 44.39 2cy4 n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cy4 h ALA 144 N 0.00 1.06 -0.90 4.61 0.00 -1.81 -2.89 119.26 119.33 2cy4 h ALA 144 Ca 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.86 2cy4 h ALA 144 Cb 0.00 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 17.40 2cy4 h ALA 144 CO 0.00 0.49 0.58 0.93 0.00 0.00 0.00 179.25 181.25 2cy4 h GLU 145 N 1.13 1.13 -0.31 0.00 4.39 -1.92 0.20 114.58 119.20 2cy4 h GLU 145 Ca 0.30 -0.07 -0.05 0.00 0.34 0.00 0.00 59.36 59.88 2cy4 h GLU 145 Cb -0.09 -0.25 -0.01 0.00 -0.10 0.00 0.00 28.75 28.29 2cy4 h GLU 145 CO -0.06 0.74 -0.01 1.25 -1.16 0.00 0.00 179.01 179.78 2cy4 h LEU 146 N 1.16 0.55 -0.52 1.33 6.46 -1.76 -0.05 115.31 122.49 2cy4 h LEU 146 Ca 0.35 -0.31 -0.06 0.00 -0.12 0.00 0.00 57.88 57.73 2cy4 h LEU 146 Cb -0.05 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 39.71 2cy4 h LEU 146 CO -0.10 0.73 0.09 0.40 -0.62 0.00 0.00 178.44 178.94 2cy4 h ILE 147 N 0.35 1.25 -0.36 4.05 2.04 -1.26 -1.04 117.51 122.53 2cy4 h ILE 147 Ca 0.09 -0.93 0.04 0.00 1.00 0.00 0.00 64.86 65.05 2cy4 h ILE 147 Cb 0.45 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 2cy4 h ILE 147 CO 0.02 0.33 0.14 -0.09 0.00 0.00 0.00 178.15 178.55 2cy4 h ARG 148 N 0.73 0.29 -0.25 2.37 2.43 -0.36 0.12 114.38 119.71 2cy4 h ARG 148 Ca 0.16 -0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.33 2cy4 h ARG 148 Cb 0.39 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.86 2cy4 h ARG 148 CO 0.01 0.19 0.12 1.49 -1.51 0.00 0.00 179.97 180.27 2cy4 h GLU 149 N 0.29 0.26 -0.13 0.20 4.81 -0.86 0.47 114.58 119.61 2cy4 h GLU 149 Ca 0.16 -0.02 0.03 0.00 -0.13 0.00 0.00 59.36 59.41 2cy4 h GLU 149 Cb 0.13 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 2cy4 h GLU 149 CO -0.16 0.17 -0.08 0.22 -0.73 0.00 0.00 179.01 178.44 2cy4 h ASP 150 N 0.26 -0.25 -0.32 1.04 1.82 -0.57 0.10 116.42 118.50 2cy4 h ASP 150 Ca 0.10 0.06 -0.03 0.00 -0.39 0.00 0.00 57.03 56.78 2cy4 h ASP 150 Cb 0.03 0.14 -0.01 0.00 0.68 0.00 0.00 39.33 40.16 2cy4 h ASP 150 CO -0.07 -0.10 0.10 0.40 -1.61 0.00 0.00 179.24 177.96 2cy4 h ILE 151 N -0.07 1.20 -0.97 2.25 2.04 -0.43 -0.63 117.51 120.90 2cy4 h ILE 151 Ca 0.08 -0.66 0.05 0.00 1.00 0.00 0.00 64.86 65.33 2cy4 h ILE 151 Cb 0.19 1.02 -0.06 0.00 -0.74 0.00 0.00 36.82 37.23 2cy4 h ILE 151 CO -0.18 0.22 0.62 -0.61 0.00 0.00 0.00 178.15 178.21 2cy4 h GLN 152 N 0.37 1.14 -0.63 2.37 5.75 0.09 0.12 115.11 124.33 2cy4 h GLN 152 Ca 0.10 -0.07 -0.04 0.00 -0.15 0.00 0.00 58.65 58.50 2cy4 h GLN 152 Cb 0.24 -0.26 -0.03 0.00 1.07 0.00 0.00 27.48 28.51 2cy4 h GLN 152 CO -0.00 0.75 0.24 0.78 -2.65 0.00 0.00 178.83 177.95 2cy4 h GLY 153 N 1.17 1.01 1.04 2.39 0.00 -0.46 -0.83 103.07 107.41 2cy4 h GLY 153 Ca 0.40 -0.56 -0.03 0.00 0.00 0.00 0.00 47.33 47.13 2cy4 h GLY 153 CO -0.15 0.53 0.40 0.00 0.00 0.00 0.00 176.54 177.32 2cy4 h ALA 154 N 1.09 1.10 -0.58 3.60 0.00 -0.08 -2.06 119.26 122.33 2cy4 h ALA 154 Ca 0.21 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2cy4 h ALA 154 Cb 0.23 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 2cy4 h ALA 154 CO -0.01 0.67 0.34 -0.07 0.00 0.00 0.00 179.25 180.18 2cy4 h LEU 155 N 1.22 0.72 0.30 0.00 3.38 -0.20 -1.78 115.31 118.93 2cy4 h LEU 155 Ca 0.29 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 2cy4 h LEU 155 Cb 0.13 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.70 2cy4 h LEU 155 CO -0.04 0.58 -0.14 1.56 0.09 0.00 0.00 178.44 180.50 2cy4 h GLN 156 N 0.79 -0.38 -0.57 1.13 4.20 -1.03 -1.77 115.11 117.48 2cy4 h GLN 156 Ca 0.21 0.03 0.12 0.00 0.06 0.00 0.00 58.65 59.06 2cy4 h GLN 156 Cb 0.01 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.85 2cy4 h GLN 156 CO -0.04 -0.08 0.39 -0.97 -0.67 0.00 0.00 178.83 177.47 2cy4 h ASN 157 N -0.70 0.25 0.61 1.46 -0.73 -1.37 0.38 115.58 115.48 2cy4 h ASN 157 Ca -0.04 0.01 -0.11 0.00 1.87 0.00 0.00 56.30 58.03 2cy4 h ASN 157 Cb 0.48 -0.04 -0.02 0.00 0.27 0.00 0.00 38.32 39.01 2cy4 h ASN 157 CO 0.07 0.14 -0.52 0.22 -0.37 0.00 0.00 177.43 176.97 2cy4 h TYR 158 N 0.27 0.00 -0.03 0.67 3.20 -1.16 -3.52 116.97 116.41 2cy4 h TYR 158 Ca 0.27 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.14 2cy4 h TYR 158 Cb 0.69 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.96 2cy4 h TYR 158 CO -0.00 0.52 0.00 0.54 -1.64 0.00 0.00 178.16 177.58