#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3iy6 s MET 2 N 0.00 0.58 -0.07 3.23 1.75 -1.26 -3.52 119.30 120.02 3iy6 s MET 2 Ca 0.00 -0.34 0.01 0.00 -1.25 0.00 0.00 55.69 54.11 3iy6 s MET 2 Cb 0.00 0.25 0.02 0.00 2.84 0.00 0.00 34.83 37.94 3iy6 s MET 2 CO 0.00 -0.15 -0.09 0.99 -0.65 0.00 0.00 175.02 175.12 3iy6 s THR 3 N -1.49 0.91 -0.11 10.11 2.01 -0.92 -4.68 115.64 121.47 3iy6 s THR 3 Ca -0.13 -0.32 0.03 0.00 0.31 0.00 0.00 61.69 61.58 3iy6 s THR 3 Cb -0.06 -0.88 0.00 0.00 0.01 0.00 0.00 72.50 71.57 3iy6 s THR 3 CO 0.02 0.32 -0.23 -1.58 -0.69 0.00 0.00 174.62 172.46 3iy6 s GLN 4 N 0.96 3.05 -0.00 4.92 0.74 -1.26 -1.57 119.66 126.50 3iy6 s GLN 4 Ca -0.10 -0.87 0.01 0.00 0.05 0.00 0.00 55.36 54.46 3iy6 s GLN 4 Cb -0.15 -2.35 -0.00 0.00 1.10 0.00 0.00 33.01 31.62 3iy6 s GLN 4 CO 0.00 0.13 -0.03 -1.50 -0.55 0.00 0.00 175.29 173.35 3iy6 s ILE 5 N 0.46 0.24 0.67 -2.34 1.10 -1.00 -4.59 121.20 115.73 3iy6 s ILE 5 Ca -0.16 -0.13 -0.03 0.00 -0.51 0.00 0.00 60.65 59.82 3iy6 s ILE 5 Cb -0.17 -0.21 0.07 0.00 0.15 0.00 0.00 42.46 42.30 3iy6 s ILE 5 CO 0.06 0.07 0.94 -2.16 -2.11 0.00 0.00 174.94 171.74 3iy6 s PRO 6 N -0.07 2.13 -0.09 3.50 0.04 -1.26 -2.44 135.00 136.81 3iy6 s PRO 6 Ca 0.01 -0.61 -0.26 0.00 0.04 0.00 0.00 61.00 60.18 3iy6 s PRO 6 Cb -0.01 -2.29 -0.26 0.00 0.04 0.00 0.00 34.50 31.97 3iy6 s PRO 6 CO -0.00 -1.16 0.88 0.00 0.04 0.00 0.00 177.00 176.76 3iy6 h ALA 7 N -0.41 -0.01 -3.34 8.56 0.00 -1.82 -3.40 119.26 118.84 3iy6 h ALA 7 Ca -0.42 -0.52 -0.65 0.00 0.00 0.00 0.00 54.91 53.32 3iy6 h ALA 7 Cb 1.30 0.02 -0.17 0.00 0.00 0.00 0.00 17.79 18.94 3iy6 h ALA 7 CO 0.52 0.08 -0.78 0.45 0.00 0.00 0.00 179.25 179.53 3iy6 s SER 8 N -6.36 3.92 -0.35 0.00 0.15 -1.26 -0.81 113.70 108.99 3iy6 s SER 8 Ca -0.17 -0.63 0.02 0.00 0.70 0.00 0.00 55.95 55.86 3iy6 s SER 8 Cb -0.01 -0.55 0.15 0.00 -1.71 0.00 0.00 66.02 63.90 3iy6 s SER 8 CO 0.73 0.14 0.32 -0.32 1.20 0.00 0.00 173.24 175.31 3iy6 s MET 9 N -2.51 0.56 -0.07 5.44 1.75 -0.09 -4.89 119.30 119.48 3iy6 s MET 9 Ca 0.21 -0.86 -0.30 0.00 -1.25 0.00 0.00 55.69 53.50 3iy6 s MET 9 Cb -0.09 -0.86 -0.02 0.00 2.84 0.00 0.00 34.83 36.70 3iy6 s MET 9 CO 0.12 -1.17 1.00 -1.54 -0.65 0.00 0.00 175.02 172.78 3iy6 s SER 10 N 1.50 7.28 0.01 1.11 1.04 -1.26 -1.99 113.70 121.40 3iy6 s SER 10 Ca 0.16 1.57 -0.00 0.00 0.48 0.00 0.00 55.95 58.16 3iy6 s SER 10 Cb -0.17 -2.56 -0.01 0.00 0.10 0.00 0.00 66.02 63.38 3iy6 s SER 10 CO -0.08 -0.39 -0.01 0.27 0.98 0.00 0.00 173.24 174.01 3iy6 s ILE 11 N 1.70 0.09 0.26 -1.02 -4.36 -0.60 -4.93 121.20 112.34 3iy6 s ILE 11 Ca 0.50 -0.72 -0.02 0.00 -0.26 0.00 0.00 60.65 60.14 3iy6 s ILE 11 Cb -0.19 -0.22 -0.04 0.00 1.25 0.00 0.00 42.46 43.25 3iy6 s ILE 11 CO 0.21 -0.39 0.49 -0.44 0.24 0.00 0.00 174.94 175.04 3iy6 s SER 12 N -1.17 6.40 0.34 4.36 0.01 -1.26 0.37 113.70 122.75 3iy6 s SER 12 Ca -0.13 0.55 -0.29 0.00 1.31 0.00 0.00 55.95 57.39 3iy6 s SER 12 Cb -0.08 -2.07 -0.11 0.00 0.21 0.00 0.00 66.02 63.97 3iy6 s SER 12 CO -0.01 -0.15 1.49 -0.69 0.41 0.00 0.00 173.24 174.30 3iy6 s VAL 13 N -2.03 2.18 0.00 3.43 1.01 -1.26 -1.14 120.40 122.59 3iy6 s VAL 13 Ca 0.41 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.56 3iy6 s VAL 13 Cb -0.11 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.17 3iy6 s VAL 13 CO 0.30 0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.05 3iy6 n GLY 14 N 1.12 2.97 3.53 4.51 0.00 0.36 -4.88 105.19 112.80 3iy6 n GLY 14 Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 3iy6 n GLY 14 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3iy6 s ASP 15 N 0.60 1.26 0.16 1.61 1.11 -0.29 -3.99 116.67 117.13 3iy6 s ASP 15 Ca 0.00 1.35 0.07 0.00 0.18 0.00 0.00 52.55 54.14 3iy6 s ASP 15 Cb 0.00 -2.10 -0.04 0.00 1.07 0.00 0.00 42.92 41.85 3iy6 s ASP 15 CO 0.00 -4.00 0.02 -0.60 1.18 0.00 0.00 175.17 171.77 3iy6 s ARG 16 N -4.63 2.50 0.05 8.23 3.52 -1.24 -0.39 118.95 126.98 3iy6 s ARG 16 Ca 0.68 -1.03 -0.02 0.00 -0.13 0.00 0.00 55.73 55.23 3iy6 s ARG 16 Cb -0.23 -2.43 -0.03 0.00 -1.56 0.00 0.00 34.95 30.70 3iy6 s ARG 16 CO 0.63 0.47 0.00 0.54 -0.81 0.00 0.00 175.30 176.13 3iy6 s VAL 17 N -1.67 0.18 -0.03 7.11 0.11 -0.34 -4.98 120.40 120.79 3iy6 s VAL 17 Ca 0.28 -1.51 -0.00 0.00 -2.93 0.00 0.00 61.98 57.81 3iy6 s VAL 17 Cb -0.10 -1.21 0.03 0.00 -1.53 0.00 0.00 36.38 33.58 3iy6 s VAL 17 CO 0.19 -0.84 0.02 -0.89 -3.33 0.00 0.00 175.10 170.26 3iy6 s THR 18 N -3.32 0.04 -0.05 5.04 2.01 -1.26 -1.57 115.64 116.53 3iy6 s THR 18 Ca 0.01 0.20 0.06 0.00 0.31 0.00 0.00 61.69 62.27 3iy6 s THR 18 Cb 0.03 -0.18 -0.01 0.00 0.01 0.00 0.00 72.50 72.36 3iy6 s THR 18 CO -0.08 0.13 -0.22 0.00 -0.69 0.00 0.00 174.62 173.76 3iy6 s MET 19 N 1.27 2.22 0.19 4.92 0.23 -0.07 -4.78 119.30 123.27 3iy6 s MET 19 Ca -0.06 -0.80 0.08 0.00 -1.03 0.00 0.00 55.69 53.88 3iy6 s MET 19 Cb -0.13 -1.92 -0.04 0.00 -1.53 0.00 0.00 34.83 31.21 3iy6 s MET 19 CO -0.03 0.35 -0.15 -0.80 -2.03 0.00 0.00 175.02 172.36 3iy6 s ASN 20 N -0.13 2.55 0.04 -1.18 -0.87 -1.02 0.09 114.94 114.42 3iy6 s ASN 20 Ca -0.02 -0.96 0.01 0.00 -1.57 0.00 0.00 52.86 50.32 3iy6 s ASN 20 Cb -0.12 -0.14 -0.03 0.00 -0.02 0.00 0.00 41.25 40.94 3iy6 s ASN 20 CO 0.03 -0.13 -0.05 0.00 -2.57 0.00 0.00 177.10 174.38 3iy6 s LYS 22 N -2.30 1.03 0.13 0.00 1.02 -0.61 -0.76 119.74 118.24 3iy6 s LYS 22 Ca -0.06 -0.52 0.07 0.00 0.02 0.00 0.00 55.97 55.48 3iy6 s LYS 22 Cb -0.04 -1.00 -0.04 0.00 -0.52 0.00 0.00 37.83 36.22 3iy6 s LYS 22 CO -0.03 0.27 -0.06 0.00 -0.92 0.00 0.00 175.35 174.62 3iy6 s ALA 23 N -0.42 3.08 0.26 5.17 0.00 0.84 -2.16 121.76 128.53 3iy6 s ALA 23 Ca 0.04 -1.28 0.06 0.00 0.00 0.00 0.00 51.96 50.79 3iy6 s ALA 23 Cb -0.06 -0.95 0.34 0.00 0.00 0.00 0.00 23.12 22.45 3iy6 s ALA 23 CO -0.00 0.59 1.61 0.77 0.00 0.00 0.00 175.76 178.73 3iy6 h SER 24 N 3.26 0.21 -2.82 0.00 0.02 -1.90 -3.45 113.55 108.87 3iy6 h SER 24 Ca -0.48 -0.11 -0.14 0.00 -0.84 0.00 0.00 61.79 60.22 3iy6 h SER 24 Cb 1.18 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 63.62 3iy6 h SER 24 CO 0.55 0.72 -0.13 0.00 -1.14 0.00 0.00 176.83 176.83 3iy6 n GLN 25 N -3.91 0.13 -2.60 3.45 6.02 -1.26 -5.03 117.38 114.18 3iy6 n GLN 25 Ca -0.02 -0.99 -0.41 0.00 -0.01 0.00 0.00 57.00 55.57 3iy6 n GLN 25 Cb 0.57 0.82 -0.04 0.00 1.02 0.00 0.00 30.24 32.61 3iy6 n GLN 25 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 3iy6 s ASN 26 N -1.70 7.36 -0.01 1.08 0.01 -1.26 -4.71 114.94 115.72 3iy6 s ASN 26 Ca 0.12 1.96 0.01 0.00 -0.71 0.00 0.00 52.86 54.24 3iy6 s ASN 26 Cb 0.01 -2.60 0.02 0.00 0.41 0.00 0.00 41.25 39.09 3iy6 s ASN 26 CO 0.08 -0.16 0.77 1.33 -1.51 0.00 0.00 177.10 177.61 3iy6 n VAL 27 N 2.60 0.21 0.00 1.60 0.24 -1.22 -5.08 118.33 116.68 3iy6 n VAL 27 Ca 0.03 -0.24 0.00 0.00 -2.04 0.00 0.00 64.34 62.09 3iy6 n VAL 27 Cb 0.47 0.69 0.00 0.00 -1.47 0.00 0.00 33.84 33.53 3iy6 n VAL 27 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16 3iy6 n ASP 28 N -0.14 0.00 -0.15 -1.34 8.00 -1.26 -2.13 116.55 119.53 3iy6 n ASP 28 Ca 0.01 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.53 3iy6 n ASP 28 Cb 0.56 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.69 3iy6 n ASP 28 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3iy6 n SER 29 N 10.66 1.00 -4.02 -2.24 7.64 -1.26 -4.43 113.62 120.98 3iy6 n SER 29 Ca 0.00 -1.99 -0.43 0.00 1.01 0.00 0.00 58.87 57.46 3iy6 n SER 29 Cb 0.00 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 3iy6 n SER 29 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3iy6 n ASN 30 N -0.45 4.95 -3.87 6.43 0.23 -0.90 -1.63 115.26 120.02 3iy6 n ASN 30 Ca 0.04 -3.04 -0.19 0.00 -0.53 0.00 0.00 54.58 50.86 3iy6 n ASN 30 Cb 0.53 -1.54 -0.16 0.00 -2.08 0.00 0.00 39.78 36.53 3iy6 n ASN 30 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 3iy6 s VAL 31 N 1.20 0.41 0.43 3.53 1.01 -1.26 -1.21 120.40 124.51 3iy6 s VAL 31 Ca 0.42 -0.06 0.06 0.00 0.00 0.00 0.00 61.98 62.40 3iy6 s VAL 31 Cb 0.07 -0.45 -0.06 0.00 0.00 0.00 0.00 36.38 35.95 3iy6 s VAL 31 CO -0.00 0.19 0.08 1.51 0.00 0.00 0.00 175.10 176.87 3iy6 s ASP 32 N 0.89 4.11 -0.04 3.32 1.47 0.56 -0.84 116.67 126.15 3iy6 s ASP 32 Ca -0.11 -1.33 0.02 0.00 1.18 0.00 0.00 52.55 52.31 3iy6 s ASP 32 Cb -0.14 -0.23 0.02 0.00 -0.34 0.00 0.00 42.92 42.23 3iy6 s ASP 32 CO -0.00 -0.58 -0.07 0.26 0.68 0.00 0.00 175.17 175.46 3iy6 s TRP 33 N -2.71 0.91 0.12 2.11 0.52 -0.26 -1.13 118.94 118.50 3iy6 s TRP 33 Ca 0.32 -0.27 0.11 0.00 0.02 0.00 0.00 56.10 56.28 3iy6 s TRP 33 Cb 0.06 -0.73 -0.04 0.00 -1.15 0.00 0.00 33.47 31.62 3iy6 s TRP 33 CO 0.17 -0.18 -0.27 0.71 0.02 0.00 0.00 176.95 177.40 3iy6 s TYR 34 N 0.68 2.32 -0.16 -1.98 2.02 0.69 -1.38 117.35 119.54 3iy6 s TYR 34 Ca -0.10 -0.38 0.01 0.00 -0.37 0.00 0.00 57.07 56.23 3iy6 s TYR 34 Cb -0.13 -1.26 0.00 0.00 -0.40 0.00 0.00 41.96 40.17 3iy6 s TYR 34 CO 0.01 0.33 -0.17 -1.14 -1.57 0.00 0.00 175.55 173.01 3iy6 s GLN 35 N -2.02 3.14 -0.47 -0.62 0.74 -0.22 -1.01 119.66 119.20 3iy6 s GLN 35 Ca 0.14 -0.78 -0.04 0.00 0.05 0.00 0.00 55.36 54.72 3iy6 s GLN 35 Cb -0.10 -2.59 0.12 0.00 1.10 0.00 0.00 33.01 31.55 3iy6 s GLN 35 CO 0.06 -0.04 0.29 -1.14 -0.55 0.00 0.00 175.29 173.91 3iy6 s GLN 36 N 0.93 2.23 0.67 1.67 0.74 0.17 -1.04 119.66 125.02 3iy6 s GLN 36 Ca -0.03 -1.96 -0.16 0.00 0.05 0.00 0.00 55.36 53.25 3iy6 s GLN 36 Cb -0.15 -3.69 0.01 0.00 1.10 0.00 0.00 33.01 30.28 3iy6 s GLN 36 CO -0.03 -1.12 1.19 0.15 -0.55 0.00 0.00 175.29 174.93 3iy6 s LYS 37 N 0.93 2.55 0.27 1.67 1.02 -1.26 -2.29 119.74 122.61 3iy6 s LYS 37 Ca 0.10 1.72 -0.30 0.00 0.02 0.00 0.00 55.97 57.50 3iy6 s LYS 37 Cb -0.23 -1.89 -0.11 0.00 -0.52 0.00 0.00 37.83 35.08 3iy6 s LYS 37 CO -0.03 -1.51 1.62 0.95 -0.92 0.00 0.00 175.35 175.45 3iy6 s THR 38 N -1.90 2.11 -0.44 2.17 -4.23 -1.26 -2.64 115.64 109.44 3iy6 s THR 38 Ca 0.74 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 61.34 3iy6 s THR 38 Cb -0.28 -3.06 0.00 0.00 1.34 0.00 0.00 72.50 70.50 3iy6 s THR 38 CO 0.40 0.01 0.00 0.61 -0.54 0.00 0.00 174.62 175.10 3iy6 n GLY 39 N 2.65 0.30 3.53 3.99 0.00 -1.26 -5.01 105.19 109.39 3iy6 n GLY 39 Ca 0.10 -0.72 -0.10 0.00 0.00 0.00 0.00 46.02 45.30 3iy6 n GLY 39 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3iy6 s GLN 40 N -3.82 1.60 0.71 1.61 -0.21 -1.08 -5.16 119.66 113.31 3iy6 s GLN 40 Ca 0.00 -1.40 -0.11 0.00 0.02 0.00 0.00 55.36 53.87 3iy6 s GLN 40 Cb 0.00 0.45 0.02 0.00 1.00 0.00 0.00 33.01 34.47 3iy6 s GLN 40 CO 0.00 -0.65 1.10 -1.12 -2.12 0.00 0.00 175.29 172.49 3iy6 s SER 41 N -3.08 5.38 0.86 5.90 0.01 -1.26 -4.66 113.70 116.85 3iy6 s SER 41 Ca 0.26 1.15 -0.12 0.00 1.31 0.00 0.00 55.95 58.55 3iy6 s SER 41 Cb 0.00 -1.94 0.11 0.00 0.21 0.00 0.00 66.02 64.40 3iy6 s SER 41 CO 0.12 -1.39 1.10 -2.84 0.41 0.00 0.00 173.24 170.64 3iy6 s PRO 42 N -5.34 1.53 0.03 12.44 0.02 -1.26 -4.42 135.00 138.00 3iy6 s PRO 42 Ca 0.58 0.66 -0.03 0.00 0.02 0.00 0.00 61.00 62.23 3iy6 s PRO 42 Cb -0.11 -1.85 -0.02 0.00 0.02 0.00 0.00 34.50 32.54 3iy6 s PRO 42 CO 0.52 -2.01 0.04 0.54 -0.33 0.00 0.00 177.00 175.76 3iy6 s ASN 43 N -3.70 0.23 0.26 2.53 6.03 -0.21 -4.94 114.94 115.15 3iy6 s ASN 43 Ca 0.62 -0.57 -0.21 0.00 -1.03 0.00 0.00 52.86 51.67 3iy6 s ASN 43 Cb -0.16 0.19 -0.09 0.00 -3.03 0.00 0.00 41.25 38.16 3iy6 s ASN 43 CO 0.55 -0.45 0.78 -0.22 -2.03 0.00 0.00 177.10 175.73 3iy6 s LEU 44 N -2.01 4.31 0.12 3.54 2.96 -1.26 -1.05 118.68 125.29 3iy6 s LEU 44 Ca -0.07 1.51 0.00 0.00 -0.22 0.00 0.00 54.13 55.35 3iy6 s LEU 44 Cb -0.03 -3.74 0.00 0.00 0.50 0.00 0.00 46.19 42.93 3iy6 s LEU 44 CO -0.04 -0.01 0.00 0.18 -1.32 0.00 0.00 176.35 175.16 3iy6 n LEU 45 N 0.59 0.97 -4.11 -0.68 4.77 -0.48 -4.85 117.00 113.21 3iy6 n LEU 45 Ca -0.01 0.17 -0.20 0.00 -0.03 0.00 0.00 56.01 55.94 3iy6 n LEU 45 Cb 0.51 -0.26 -0.14 0.00 -2.33 0.00 0.00 43.42 41.20 3iy6 n LEU 45 CO 0.43 -0.75 -0.46 -0.63 -1.33 0.00 0.00 177.39 174.65 3iy6 s ILE 46 N -2.00 1.02 0.03 -0.08 1.09 -1.22 0.17 121.20 120.22 3iy6 s ILE 46 Ca 0.00 -0.79 0.02 0.00 -1.10 0.00 0.00 60.65 58.78 3iy6 s ILE 46 Cb 0.00 -0.90 -0.02 0.00 -1.06 0.00 0.00 42.46 40.48 3iy6 s ILE 46 CO 0.00 0.11 -0.08 -0.72 -0.10 0.00 0.00 174.94 174.15 3iy6 s TYR 47 N -0.62 0.65 0.00 3.97 1.13 0.22 -1.10 117.35 121.60 3iy6 s TYR 47 Ca 0.03 -0.42 0.00 0.00 -1.41 0.00 0.00 57.07 55.26 3iy6 s TYR 47 Cb -0.07 -0.39 0.00 0.00 -1.10 0.00 0.00 41.96 40.40 3iy6 s TYR 47 CO 0.00 -0.07 0.00 1.17 -2.51 0.00 0.00 175.55 174.15 3iy6 n LYS 48 N 1.73 0.00 0.00 -3.49 4.81 -1.19 -1.87 118.16 118.15 3iy6 n LYS 48 Ca -0.21 0.25 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 3iy6 n LYS 48 Cb 0.55 -2.69 0.00 0.00 0.02 0.00 0.00 35.03 32.91 3iy6 n LYS 48 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3iy6 n ALA 49 N -0.22 0.00 -1.19 3.14 0.00 -0.02 -4.28 120.51 117.94 3iy6 n ALA 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3iy6 n ALA 49 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 3iy6 n ALA 49 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3iy6 n SER 50 N 1.34 0.00 -4.79 0.00 7.64 -1.23 -3.15 113.62 113.43 3iy6 n SER 50 Ca 0.00 -1.00 -0.36 0.00 1.01 0.00 0.00 58.87 58.52 3iy6 n SER 50 Cb 0.00 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.13 3iy6 n SER 50 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3iy6 s ASN 51 N 0.00 6.32 0.17 6.43 0.01 -0.78 -4.45 114.94 122.64 3iy6 s ASN 51 Ca 0.00 0.38 -0.27 0.00 -0.71 0.00 0.00 52.86 52.26 3iy6 s ASN 51 Cb 0.00 -2.09 -0.08 0.00 0.41 0.00 0.00 41.25 39.49 3iy6 s ASN 51 CO 0.00 0.27 0.82 -0.13 -1.51 0.00 0.00 177.10 176.55 3iy6 s ARG 52 N -0.25 4.64 0.54 -0.60 0.52 -1.26 -0.61 118.95 121.92 3iy6 s ARG 52 Ca 0.12 1.24 -0.16 0.00 -0.52 0.00 0.00 55.73 56.41 3iy6 s ARG 52 Cb -0.12 -3.28 -0.07 0.00 0.52 0.00 0.00 34.95 32.01 3iy6 s ARG 52 CO 0.01 0.52 1.00 1.21 0.02 0.00 0.00 175.30 178.07 3iy6 s ASN 53 N -1.02 6.44 0.28 0.23 3.04 0.13 -4.89 114.94 119.15 3iy6 s ASN 53 Ca 0.38 1.58 -0.29 0.00 0.04 0.00 0.00 52.86 54.57 3iy6 s ASN 53 Cb -0.24 -2.51 -0.13 0.00 -1.54 0.00 0.00 41.25 36.83 3iy6 s ASN 53 CO 0.27 -0.71 1.20 0.41 -3.04 0.00 0.00 177.10 175.23 3iy6 n THR 54 N -1.82 1.66 0.00 -5.21 -1.04 -1.26 -1.94 114.28 104.67 3iy6 n THR 54 Ca 0.07 -0.41 0.00 0.00 -2.04 0.00 0.00 64.05 61.66 3iy6 n THR 54 Cb 0.54 -1.28 0.00 0.00 -1.82 0.00 0.00 70.33 67.77 3iy6 n THR 54 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3iy6 n GLY 55 N 1.35 3.13 3.73 3.41 0.00 -1.26 -5.02 105.19 110.54 3iy6 n GLY 55 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 3iy6 n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3iy6 s VAL 56 N -1.93 4.54 0.54 1.61 1.01 -0.82 -5.02 120.40 120.33 3iy6 s VAL 56 Ca 0.00 2.07 -0.18 0.00 0.00 0.00 0.00 61.98 63.87 3iy6 s VAL 56 Cb 0.00 -4.32 -0.06 0.00 0.00 0.00 0.00 36.38 32.00 3iy6 s VAL 56 CO 0.00 0.30 1.05 -2.16 0.00 0.00 0.00 175.10 174.29 3iy6 s PRO 57 N 0.11 3.56 0.00 2.72 0.04 -1.26 -4.89 135.00 135.28 3iy6 s PRO 57 Ca 0.48 1.28 0.06 0.00 0.04 0.00 0.00 61.00 62.86 3iy6 s PRO 57 Cb -0.23 -2.06 0.38 0.00 0.04 0.00 0.00 34.50 32.62 3iy6 s PRO 57 CO 0.30 -0.62 0.84 -0.40 0.04 0.00 0.00 177.00 177.16 3iy6 n ASP 58 N -1.50 0.00 0.10 6.66 5.75 -1.26 -2.52 116.55 123.78 3iy6 n ASP 58 Ca 0.09 -0.81 0.11 0.00 -0.01 0.00 0.00 54.79 54.18 3iy6 n ASP 58 Cb 0.53 0.00 0.45 0.00 -1.03 0.00 0.00 41.12 41.07 3iy6 n ASP 58 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 3iy6 n ARG 59 N -0.70 0.16 -3.92 0.11 1.85 -1.26 -4.59 116.66 108.32 3iy6 n ARG 59 Ca 0.05 0.34 -0.36 0.00 -1.00 0.00 0.00 57.85 56.88 3iy6 n ARG 59 Cb 0.02 -1.78 -0.08 0.00 -1.05 0.00 0.00 32.46 29.58 3iy6 n ARG 59 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3iy6 s PHE 60 N -3.21 3.43 0.02 2.89 0.40 -1.05 -1.22 117.98 119.24 3iy6 s PHE 60 Ca 0.06 0.35 -0.09 0.00 -0.60 0.00 0.00 56.93 56.66 3iy6 s PHE 60 Cb 0.10 -2.01 0.00 0.00 0.51 0.00 0.00 43.02 41.63 3iy6 s PHE 60 CO 0.41 0.48 0.17 0.95 0.70 0.00 0.00 175.22 177.93 3iy6 s THR 61 N -0.37 0.10 0.17 0.64 -4.23 -0.53 -4.94 115.64 106.48 3iy6 s THR 61 Ca 0.11 -0.81 0.08 0.00 -1.18 0.00 0.00 61.69 59.88 3iy6 s THR 61 Cb -0.12 -0.71 -0.04 0.00 1.34 0.00 0.00 72.50 72.98 3iy6 s THR 61 CO 0.01 -0.45 -0.16 -0.83 -0.54 0.00 0.00 174.62 172.66 3iy6 s GLY 62 N -1.77 1.33 0.33 3.99 0.00 -1.26 -1.17 107.32 108.77 3iy6 s GLY 62 Ca -0.09 -1.50 -0.18 0.00 0.00 0.00 0.00 44.72 42.95 3iy6 s GLY 62 CO -0.01 -1.57 0.81 -1.35 0.00 0.00 0.00 173.10 170.99 3iy6 s SER 63 N -2.82 -0.06 0.00 1.64 1.04 -0.70 -4.44 113.70 108.36 3iy6 s SER 63 Ca 0.16 -0.93 0.00 0.00 0.48 0.00 0.00 55.95 55.66 3iy6 s SER 63 Cb -0.04 0.77 0.00 0.00 0.10 0.00 0.00 66.02 66.85 3iy6 s SER 63 CO 0.06 -1.49 0.00 0.61 0.98 0.00 0.00 173.24 173.39 3iy6 n GLY 64 N -0.53 3.98 3.07 7.32 0.00 -1.26 -0.43 105.19 117.35 3iy6 n GLY 64 Ca -0.07 -1.15 -0.12 0.00 0.00 0.00 0.00 46.02 44.69 3iy6 n GLY 64 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3iy6 s SER 65 N 0.00 -0.07 0.00 1.61 1.04 0.10 -4.93 113.70 111.45 3iy6 s SER 65 Ca 0.00 0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.49 3iy6 s SER 65 Cb 0.00 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.39 3iy6 s SER 65 CO 0.00 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 174.62 3iy6 n GLY 66 N 2.22 0.36 0.00 7.32 0.00 -1.26 -1.62 105.19 112.21 3iy6 n GLY 66 Ca -0.18 0.68 0.00 0.00 0.00 0.00 0.00 46.02 46.53 3iy6 n GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3iy6 n THR 67 N 0.00 0.00 -5.15 2.61 -2.24 -1.26 -3.44 114.28 104.80 3iy6 n THR 67 Ca 0.00 -0.31 -0.31 0.00 -2.27 0.00 0.00 64.05 61.16 3iy6 n THR 67 Cb 0.00 1.31 -0.17 0.00 -2.10 0.00 0.00 70.33 69.37 3iy6 n THR 67 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3iy6 s ASP 68 N -0.12 2.97 0.06 3.42 1.11 -0.64 -0.11 116.67 123.35 3iy6 s ASP 68 Ca 0.00 -0.54 0.04 0.00 0.18 0.00 0.00 52.55 52.24 3iy6 s ASP 68 Cb 0.00 -1.36 -0.03 0.00 1.07 0.00 0.00 42.92 42.61 3iy6 s ASP 68 CO 0.00 0.15 -0.13 -0.36 1.18 0.00 0.00 175.17 176.01 3iy6 s PHE 69 N 0.38 1.09 0.00 4.23 0.40 0.06 -0.72 117.98 123.42 3iy6 s PHE 69 Ca -0.18 -0.44 0.02 0.00 -0.60 0.00 0.00 56.93 55.73 3iy6 s PHE 69 Cb -0.18 -0.63 -0.01 0.00 0.51 0.00 0.00 43.02 42.72 3iy6 s PHE 69 CO 0.08 0.02 -0.08 0.99 0.70 0.00 0.00 175.22 176.94 3iy6 s THR 70 N -1.18 0.62 -0.12 0.64 2.01 0.43 -0.34 115.64 117.71 3iy6 s THR 70 Ca -0.03 -0.46 -0.03 0.00 0.31 0.00 0.00 61.69 61.48 3iy6 s THR 70 Cb -0.09 -0.54 -0.03 0.00 0.01 0.00 0.00 72.50 71.84 3iy6 s THR 70 CO 0.02 0.09 -0.00 0.12 -0.69 0.00 0.00 174.62 174.15 3iy6 s PHE 71 N -0.37 3.14 -0.04 4.92 5.36 0.11 -1.71 117.98 129.38 3iy6 s PHE 71 Ca 0.01 0.06 0.04 0.00 -0.96 0.00 0.00 56.93 56.08 3iy6 s PHE 71 Cb -0.04 -1.87 -0.00 0.00 -0.34 0.00 0.00 43.02 40.77 3iy6 s PHE 71 CO -0.00 0.30 -0.17 -0.08 -1.46 0.00 0.00 175.22 173.81 3iy6 s THR 72 N -0.40 1.38 -0.22 0.12 -1.32 -0.32 -0.89 115.64 113.99 3iy6 s THR 72 Ca 0.08 -0.70 0.00 0.00 -1.21 0.00 0.00 61.69 59.86 3iy6 s THR 72 Cb -0.12 -1.19 0.03 0.00 -1.51 0.00 0.00 72.50 69.71 3iy6 s THR 72 CO 0.02 0.40 -0.12 -0.63 -2.21 0.00 0.00 174.62 172.08 3iy6 s ILE 73 N 0.00 2.47 0.07 5.08 1.01 -0.61 -1.45 121.20 127.77 3iy6 s ILE 73 Ca -0.03 -1.08 -0.17 0.00 0.00 0.00 0.00 60.65 59.37 3iy6 s ILE 73 Cb -0.11 -2.21 -0.13 0.00 0.01 0.00 0.00 42.46 40.03 3iy6 s ILE 73 CO 0.02 0.29 1.35 0.77 0.00 0.00 0.00 174.94 177.37 3iy6 h SER 74 N 7.95 0.59 -3.29 3.58 4.64 -1.45 -0.89 113.55 124.67 3iy6 h SER 74 Ca -0.36 -0.51 -0.53 0.00 -0.47 0.00 0.00 61.79 59.92 3iy6 h SER 74 Cb 1.11 -0.17 -0.40 0.00 -0.31 0.00 0.00 62.40 62.64 3iy6 h SER 74 CO 0.58 0.98 -0.77 0.20 -0.87 0.00 0.00 176.83 176.96 3iy6 s ASN 75 N -6.42 3.06 0.02 4.97 0.02 -1.25 -3.70 114.94 111.65 3iy6 s ASN 75 Ca -0.13 -0.90 -0.30 0.00 -1.02 0.00 0.00 52.86 50.50 3iy6 s ASN 75 Cb 0.07 -0.65 -0.04 0.00 0.02 0.00 0.00 41.25 40.64 3iy6 s ASN 75 CO 0.80 -0.31 1.11 -0.32 0.02 0.00 0.00 177.10 178.40 3iy6 s MET 76 N 1.81 4.47 0.41 -0.60 -2.45 0.48 -4.77 119.30 118.64 3iy6 s MET 76 Ca -0.01 1.61 0.08 0.00 -1.25 0.00 0.00 55.69 56.12 3iy6 s MET 76 Cb -0.17 -3.42 -0.04 0.00 1.25 0.00 0.00 34.83 32.45 3iy6 s MET 76 CO -0.09 -0.20 0.27 -0.65 1.05 0.00 0.00 175.02 175.40 3iy6 s GLN 77 N 1.20 2.39 0.22 4.11 -1.52 -1.26 -0.49 119.66 124.30 3iy6 s GLN 77 Ca 0.55 -1.67 -0.09 0.00 -1.95 0.00 0.00 55.36 52.21 3iy6 s GLN 77 Cb -0.25 -2.19 0.18 0.00 -0.22 0.00 0.00 33.01 30.53 3iy6 s GLN 77 CO 0.27 -0.13 1.87 0.00 -0.25 0.00 0.00 175.29 177.05 3iy6 h ALA 78 N 1.25 1.04 0.00 6.09 0.00 -2.00 -2.33 119.26 123.31 3iy6 h ALA 78 Ca -0.42 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.40 3iy6 h ALA 78 Cb 1.26 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3iy6 h ALA 78 CO 0.63 0.50 0.00 1.05 0.00 0.00 0.00 179.25 181.43 3iy6 h GLU 79 N 1.12 0.00 0.00 0.00 4.11 -2.02 -3.08 114.58 114.71 3iy6 h GLU 79 Ca 0.30 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.73 3iy6 h GLU 79 Cb -0.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.19 3iy6 h GLU 79 CO -0.06 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.77 3iy6 n ASP 80 N -2.47 0.00 -4.79 3.06 8.00 -0.88 -4.85 116.55 114.62 3iy6 n ASP 80 Ca -0.01 -1.37 -0.36 0.00 0.71 0.00 0.00 54.79 53.76 3iy6 n ASP 80 Cb 0.10 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.14 3iy6 n ASP 80 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 3iy6 s LEU 81 N -1.51 4.16 0.00 0.64 0.05 -1.17 -4.90 118.68 115.96 3iy6 s LEU 81 Ca 0.22 1.83 0.00 0.00 0.05 0.00 0.00 54.13 56.23 3iy6 s LEU 81 Cb 0.10 -4.23 0.00 0.00 -2.05 0.00 0.00 46.19 40.02 3iy6 s LEU 81 CO 0.17 -0.26 0.00 0.00 -0.55 0.00 0.00 176.35 175.72 3iy6 n ALA 82 N 0.03 0.00 -2.92 1.48 0.00 -1.16 -4.53 120.51 113.41 3iy6 n ALA 82 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.15 3iy6 n ALA 82 Cb 0.51 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.84 3iy6 n ALA 82 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3iy6 s VAL 83 N -2.86 3.93 0.13 0.00 1.01 -0.97 -1.17 120.40 120.48 3iy6 s VAL 83 Ca 0.00 -0.35 0.03 0.00 0.00 0.00 0.00 61.98 61.66 3iy6 s VAL 83 Cb 0.00 -2.72 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 3iy6 s VAL 83 CO 0.00 0.50 0.19 -0.31 0.00 0.00 0.00 175.10 175.48 3iy6 s TYR 84 N 0.25 3.31 -0.01 5.22 1.51 -0.70 -0.66 117.35 126.27 3iy6 s TYR 84 Ca -0.02 0.07 0.00 0.00 -1.01 0.00 0.00 57.07 56.11 3iy6 s TYR 84 Cb -0.14 -1.61 0.01 0.00 -0.11 0.00 0.00 41.96 40.11 3iy6 s TYR 84 CO 0.03 0.53 0.00 0.71 -1.11 0.00 0.00 175.55 175.71 3iy6 s TYR 85 N -1.67 0.05 0.36 2.71 2.02 -0.18 -1.63 117.35 119.01 3iy6 s TYR 85 Ca 0.32 0.02 0.05 0.00 -0.37 0.00 0.00 57.07 57.10 3iy6 s TYR 85 Cb -0.11 -0.09 -0.01 0.00 -0.40 0.00 0.00 41.96 41.35 3iy6 s TYR 85 CO 0.25 -0.03 0.52 0.00 -1.57 0.00 0.00 175.55 174.73 3iy6 s MET 87 N -4.26 0.81 0.25 0.00 1.75 -0.28 -0.71 119.30 116.85 3iy6 s MET 87 Ca 0.45 0.48 0.07 0.00 -1.25 0.00 0.00 55.69 55.45 3iy6 s MET 87 Cb -0.10 0.38 -0.04 0.00 2.84 0.00 0.00 34.83 37.92 3iy6 s MET 87 CO 0.33 -0.18 0.16 1.14 -0.65 0.00 0.00 175.02 175.82 3iy6 s GLN 88 N -0.43 2.81 -0.30 4.11 -2.07 -0.83 -0.32 119.66 122.63 3iy6 s GLN 88 Ca -0.06 -1.12 0.18 0.00 -1.82 0.00 0.00 55.36 52.54 3iy6 s GLN 88 Cb -0.03 -2.49 0.46 0.00 -1.09 0.00 0.00 33.01 29.86 3iy6 s GLN 88 CO 0.04 0.39 1.24 0.43 -1.32 0.00 0.00 175.29 176.08 3iy6 n SER 89 N -1.13 0.36 -0.06 12.60 7.64 -0.35 -3.62 113.62 129.06 3iy6 n SER 89 Ca -0.08 -2.21 -0.13 0.00 1.01 0.00 0.00 58.87 57.47 3iy6 n SER 89 Cb 0.58 -0.01 -0.06 0.00 -1.01 0.00 0.00 64.21 63.70 3iy6 n SER 89 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3iy6 h THR 90 N 4.49 1.32 -2.30 0.44 1.03 -1.88 -3.48 112.91 112.53 3iy6 h THR 90 Ca -0.24 -1.20 0.16 0.00 -0.01 0.00 0.00 66.41 65.12 3iy6 h THR 90 Cb 1.27 1.72 -0.10 0.00 -1.07 0.00 0.00 68.15 69.97 3iy6 h THR 90 CO 0.09 0.36 0.50 -0.44 -0.01 0.00 0.00 175.52 176.02 3iy6 s SER 91 N -6.10 -0.24 0.27 0.00 0.01 -1.26 -5.10 113.70 101.28 3iy6 s SER 91 Ca -0.14 -0.27 -0.07 0.00 1.31 0.00 0.00 55.95 56.79 3iy6 s SER 91 Cb 0.06 0.45 -0.06 0.00 0.21 0.00 0.00 66.02 66.68 3iy6 s SER 91 CO 0.75 -0.80 0.55 -0.31 0.41 0.00 0.00 173.24 173.85 3iy6 s TYR 92 N -3.21 3.46 0.48 2.43 1.51 -1.26 -4.00 117.35 116.75 3iy6 s TYR 92 Ca 0.10 0.73 -0.17 0.00 -1.01 0.00 0.00 57.07 56.72 3iy6 s TYR 92 Cb -0.01 -2.16 -0.09 0.00 -0.11 0.00 0.00 41.96 39.59 3iy6 s TYR 92 CO -0.02 0.20 0.95 -1.25 -1.11 0.00 0.00 175.55 174.32 3iy6 s PRO 93 N -3.30 4.00 0.41 -1.71 0.04 -1.26 -5.12 135.00 128.07 3iy6 s PRO 93 Ca 0.45 0.94 -0.23 0.00 0.04 0.00 0.00 61.00 62.20 3iy6 s PRO 93 Cb -0.11 -2.18 -0.09 0.00 0.04 0.00 0.00 34.50 32.16 3iy6 s PRO 93 CO 0.27 -0.17 1.04 -0.51 0.04 0.00 0.00 177.00 177.67 3iy6 s LEU 94 N -3.78 4.09 0.01 -3.56 2.01 -1.26 -4.95 118.68 111.24 3iy6 s LEU 94 Ca 0.59 2.00 0.00 0.00 0.01 0.00 0.00 54.13 56.73 3iy6 s LEU 94 Cb -0.10 -4.25 -0.01 0.00 0.01 0.00 0.00 46.19 41.84 3iy6 s LEU 94 CO 0.26 -0.52 -0.02 -0.89 1.01 0.00 0.00 176.35 176.19 3iy6 s THR 95 N -1.73 0.09 0.20 5.49 2.01 -1.24 -5.02 115.64 115.43 3iy6 s THR 95 Ca 0.59 -0.50 0.07 0.00 0.31 0.00 0.00 61.69 62.17 3iy6 s THR 95 Cb -0.20 -0.17 -0.04 0.00 0.01 0.00 0.00 72.50 72.10 3iy6 s THR 95 CO 0.26 -0.26 0.05 -0.36 -0.69 0.00 0.00 174.62 173.61 3iy6 s PHE 96 N -0.78 2.90 0.55 4.92 0.08 -1.26 -1.97 117.98 122.43 3iy6 s PHE 96 Ca -0.08 -0.13 -0.07 0.00 0.12 0.00 0.00 56.93 56.77 3iy6 s PHE 96 Cb -0.05 -1.37 -0.02 0.00 -0.57 0.00 0.00 43.02 41.00 3iy6 s PHE 96 CO -0.00 0.54 0.88 0.20 -0.10 0.00 0.00 175.22 176.73 3iy6 s GLY 97 N -3.21 1.57 0.37 4.36 0.00 0.11 -4.62 107.32 105.90 3iy6 s GLY 97 Ca 0.29 -0.49 0.27 0.00 0.00 0.00 0.00 44.72 44.80 3iy6 s GLY 97 CO 0.20 -0.25 1.81 1.48 0.00 0.00 0.00 173.10 176.34 3iy6 h SER 98 N -0.05 0.00 -3.67 1.64 4.64 -1.89 -3.42 113.55 110.81 3iy6 h SER 98 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3iy6 h SER 98 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3iy6 h SER 98 CO 0.62 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.19 3iy6 n GLY 99 N -0.44 2.46 2.79 -0.77 0.00 -1.26 -5.05 105.19 102.92 3iy6 n GLY 99 Ca 0.00 -1.69 -0.27 0.00 0.00 0.00 0.00 46.02 44.06 3iy6 n GLY 99 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3iy6 s THR 100 N -1.73 0.72 -0.19 2.61 2.01 -0.65 -4.64 115.64 113.77 3iy6 s THR 100 Ca 0.00 -0.55 -0.26 0.00 0.31 0.00 0.00 61.69 61.20 3iy6 s THR 100 Cb 0.00 -1.09 -0.01 0.00 0.01 0.00 0.00 72.50 71.41 3iy6 s THR 100 CO 0.00 -0.07 0.87 -0.75 -0.69 0.00 0.00 174.62 173.98 3iy6 s LYS 101 N 1.78 4.27 -0.25 4.92 2.20 0.01 -1.72 119.74 130.95 3iy6 s LYS 101 Ca -0.00 1.07 -0.13 0.00 -0.36 0.00 0.00 55.97 56.54 3iy6 s LYS 101 Cb -0.16 -3.60 -0.04 0.00 -1.51 0.00 0.00 37.83 32.52 3iy6 s LYS 101 CO -0.07 -0.41 0.29 -1.17 -0.36 0.00 0.00 175.35 173.62 3iy6 s LEU 102 N 2.44 4.08 -0.03 5.43 2.96 -0.31 -0.92 118.68 132.34 3iy6 s LEU 102 Ca 0.39 0.24 0.07 0.00 -0.22 0.00 0.00 54.13 54.60 3iy6 s LEU 102 Cb -0.16 -2.30 -0.02 0.00 0.50 0.00 0.00 46.19 44.21 3iy6 s LEU 102 CO 0.11 -0.07 -0.24 -1.83 -1.32 0.00 0.00 176.35 173.00 3iy6 s GLU 103 N 1.57 2.20 -0.16 1.98 -1.05 -0.84 -2.97 118.70 119.43 3iy6 s GLU 103 Ca 0.12 -0.88 -0.27 0.00 -0.15 0.00 0.00 54.97 53.79 3iy6 s GLU 103 Cb -0.15 -2.11 -0.01 0.00 -0.44 0.00 0.00 34.13 31.42 3iy6 s GLU 103 CO 0.08 0.57 0.92 0.42 0.95 0.00 0.00 175.26 178.20 3iy6 s ILE 104 N -0.62 4.82 -0.03 1.83 -1.09 -1.26 -1.56 121.20 123.28 3iy6 s ILE 104 Ca 0.10 1.83 -0.30 0.00 -2.23 0.00 0.00 60.65 60.05 3iy6 s ILE 104 Cb -0.10 -4.22 -0.03 0.00 -1.58 0.00 0.00 42.46 36.53 3iy6 s ILE 104 CO -0.01 -0.01 1.05 -0.75 -1.23 0.00 0.00 174.94 173.99 3iy6 s LYS 105 N 2.27 4.47 0.37 2.79 2.20 0.16 -4.89 119.74 127.11 3iy6 s LYS 105 Ca 0.42 1.49 0.04 0.00 -0.36 0.00 0.00 55.97 57.57 3iy6 s LYS 105 Cb -0.17 -3.48 -0.03 0.00 -1.51 0.00 0.00 37.83 32.64 3iy6 s LYS 105 CO 0.13 -0.22 0.15 0.50 -0.36 0.00 0.00 175.35 175.55 3iy6 s ARG 106 N 1.50 1.82 0.00 4.03 3.52 -1.26 -4.35 118.95 124.21 3iy6 s ARG 106 Ca 0.52 -2.08 0.26 0.00 -0.13 0.00 0.00 55.73 54.30 3iy6 s ARG 106 Cb -0.22 -0.41 1.55 0.00 -1.56 0.00 0.00 34.95 34.31 3iy6 s ARG 106 CO 0.24 -0.47 1.90 0.00 -0.81 0.00 0.00 175.30 176.16