#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuj n SER 2 N 0.00 -7.81 -4.72 1.61 7.64 -1.26 -5.03 113.62 104.05 2yuj n SER 2 Ca 0.00 1.02 -0.29 0.00 1.01 0.00 0.00 58.87 60.61 2yuj n SER 2 Cb 0.00 -5.23 -0.07 0.00 -1.01 0.00 0.00 64.21 57.90 2yuj n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yuj s SER 3 N -2.00 5.14 -0.46 6.43 0.01 -1.26 -5.07 113.70 116.49 2yuj s SER 3 Ca 0.11 -0.19 0.07 0.00 1.31 0.00 0.00 55.95 57.24 2yuj s SER 3 Cb -0.03 -1.25 0.28 0.00 0.21 0.00 0.00 66.02 65.23 2yuj s SER 3 CO 0.75 0.13 0.93 0.61 0.41 0.00 0.00 173.24 176.08 2yuj n GLY 4 N 0.21 0.66 3.78 3.44 0.00 -1.26 -5.15 105.19 106.88 2yuj n GLY 4 Ca -0.10 -0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.48 2yuj n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuj s SER 5 N -1.55 4.38 0.42 1.61 0.01 -1.26 -4.71 113.70 112.60 2yuj s SER 5 Ca 0.29 1.46 0.00 0.00 1.31 0.00 0.00 55.95 59.02 2yuj s SER 5 Cb 0.25 -2.20 0.00 0.00 0.21 0.00 0.00 66.02 64.28 2yuj s SER 5 CO -0.16 -2.06 0.00 -0.24 0.41 0.00 0.00 173.24 171.19 2yuj n SER 6 N -3.51 -8.75 0.00 2.44 2.88 -1.26 -4.74 113.62 100.69 2yuj n SER 6 Ca 0.07 0.81 0.00 0.00 -1.33 0.00 0.00 58.87 58.42 2yuj n SER 6 Cb 0.55 -4.59 0.00 0.00 -0.75 0.00 0.00 64.21 59.42 2yuj n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yuj n GLY 7 N -4.31 0.43 2.22 0.46 0.00 -1.26 -4.87 105.19 97.86 2yuj n GLY 7 Ca -0.01 0.59 -0.03 0.00 0.00 0.00 0.00 46.02 46.57 2yuj n GLY 7 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2yuj n ILE 8 N 0.00 -7.35 -1.57 -0.61 5.41 -1.26 -4.95 119.36 109.03 2yuj n ILE 8 Ca 0.00 0.74 -0.39 0.00 1.00 0.00 0.00 62.75 64.10 2yuj n ILE 8 Cb 0.00 -5.77 0.04 0.00 -0.71 0.00 0.00 39.64 33.20 2yuj n ILE 8 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2yuj n PRO 9 N -0.05 0.87 -2.56 0.38 -0.02 -1.26 -4.95 135.00 127.40 2yuj n PRO 9 Ca 0.04 0.33 -0.02 0.00 -2.02 0.00 0.00 63.50 61.83 2yuj n PRO 9 Cb 0.15 -2.00 0.09 0.00 -0.02 0.00 0.00 33.50 31.72 2yuj n PRO 9 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2yuj n ARG 10 N -0.48 1.34 -0.79 -0.52 0.63 -1.26 -4.92 116.66 110.64 2yuj n ARG 10 Ca 0.12 -1.93 -0.01 0.00 -0.92 0.00 0.00 57.85 55.11 2yuj n ARG 10 Cb 0.46 -0.21 0.19 0.00 0.45 0.00 0.00 32.46 33.35 2yuj n ARG 10 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 2yuj n VAL 11 N -1.08 2.41 -0.05 5.15 0.24 -1.26 -4.72 118.33 119.01 2yuj n VAL 11 Ca -0.10 -3.08 -0.13 0.00 -2.04 0.00 0.00 64.34 58.99 2yuj n VAL 11 Cb 0.85 -0.34 -0.07 0.00 -1.47 0.00 0.00 33.84 32.81 2yuj n VAL 11 CO 0.00 0.00 0.00 -0.26 -2.14 0.00 0.00 176.83 174.43 2yuj h PHE 12 N 1.08 0.39 -2.44 6.34 0.04 -2.03 -3.37 116.94 116.95 2yuj h PHE 12 Ca 0.13 -0.11 -0.71 0.00 2.80 0.00 0.00 57.97 60.08 2yuj h PHE 12 Cb 1.34 -0.08 -0.18 0.00 2.20 0.00 0.00 35.95 39.22 2yuj h PHE 12 CO 0.91 0.71 0.93 -0.65 -0.60 0.00 0.00 178.31 179.61 2yuj s GLN 13 N -4.34 3.74 0.00 1.51 -0.21 -1.26 -4.87 119.66 114.23 2yuj s GLN 13 Ca -0.14 -2.04 -0.14 0.00 0.02 0.00 0.00 55.36 53.05 2yuj s GLN 13 Cb 0.05 -4.92 -0.08 0.00 1.00 0.00 0.00 33.01 29.06 2yuj s GLN 13 CO 0.75 -1.74 0.89 -0.97 -2.12 0.00 0.00 175.29 172.10 2yuj h ASN 14 N 8.30 -0.44 -3.65 5.90 -1.24 -1.92 -3.50 115.58 119.03 2yuj h ASN 14 Ca 0.20 0.02 0.34 0.00 0.71 0.00 0.00 56.30 57.56 2yuj h ASN 14 Cb 0.98 0.11 -0.19 0.00 0.73 0.00 0.00 38.32 39.96 2yuj h ASN 14 CO 1.12 -0.22 -1.28 -1.14 -1.29 0.00 0.00 177.43 174.62 2yuj n ARG 15 N -3.90 -3.40 -2.54 6.67 0.63 -1.26 -4.80 116.66 108.05 2yuj n ARG 15 Ca -0.06 2.78 -0.40 0.00 -0.92 0.00 0.00 57.85 59.25 2yuj n ARG 15 Cb 0.20 -3.94 -0.05 0.00 0.45 0.00 0.00 32.46 29.13 2yuj n ARG 15 CO 0.00 0.00 0.00 0.12 -2.51 0.00 0.00 177.63 175.24 2yuj s PHE 16 N -4.38 3.67 -0.46 -0.14 5.36 -1.26 -4.96 117.98 115.81 2yuj s PHE 16 Ca 0.00 1.72 0.07 0.00 -0.96 0.00 0.00 56.93 57.76 2yuj s PHE 16 Cb 0.00 -3.22 0.18 0.00 -0.34 0.00 0.00 43.02 39.64 2yuj s PHE 16 CO 0.00 -0.35 0.65 -1.54 -1.46 0.00 0.00 175.22 172.52 2yuj s SER 17 N -0.75 -1.23 0.10 6.13 1.04 -1.20 -3.64 113.70 114.15 2yuj s SER 17 Ca 0.45 -1.33 -0.11 0.00 0.48 0.00 0.00 55.95 55.44 2yuj s SER 17 Cb -0.30 1.77 0.01 0.00 0.10 0.00 0.00 66.02 67.60 2yuj s SER 17 CO 0.38 -0.12 0.26 -0.89 0.98 0.00 0.00 173.24 173.84 2yuj s THR 18 N 1.33 0.12 -0.26 2.02 2.01 -0.32 -4.98 115.64 115.57 2yuj s THR 18 Ca 0.23 -1.02 -0.09 0.00 0.31 0.00 0.00 61.69 61.12 2yuj s THR 18 Cb -0.03 -1.32 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 2yuj s THR 18 CO -0.06 -0.54 0.12 -1.10 -0.69 0.00 0.00 174.62 172.35 2yuj s GLN 19 N -3.85 3.82 0.08 4.92 -0.21 -1.26 0.11 119.66 123.27 2yuj s GLN 19 Ca 0.05 -0.39 0.09 0.00 0.02 0.00 0.00 55.36 55.13 2yuj s GLN 19 Cb 0.04 -3.46 -0.03 0.00 1.00 0.00 0.00 33.01 30.56 2yuj s GLN 19 CO -0.11 -0.13 -0.24 0.71 -2.12 0.00 0.00 175.29 173.40 2yuj s TYR 20 N 1.53 2.08 0.99 0.91 2.02 -0.97 -4.81 117.35 119.10 2yuj s TYR 20 Ca 0.06 -0.39 -0.12 0.00 -0.37 0.00 0.00 57.07 56.25 2yuj s TYR 20 Cb -0.15 -1.19 0.18 0.00 -0.40 0.00 0.00 41.96 40.40 2yuj s TYR 20 CO 0.06 0.18 1.09 1.03 -1.57 0.00 0.00 175.55 176.35 2yuj s ARG 21 N -1.54 0.48 -0.18 -0.62 0.52 -1.26 -1.01 118.95 115.34 2yuj s ARG 21 Ca 0.10 0.53 -0.01 0.00 -0.52 0.00 0.00 55.73 55.83 2yuj s ARG 21 Cb -0.10 -1.74 0.05 0.00 0.52 0.00 0.00 34.95 33.68 2yuj s ARG 21 CO 0.03 -2.70 -0.01 0.00 0.02 0.00 0.00 175.30 172.64 2yuj s PHE 23 N 1.71 2.12 0.44 0.00 0.08 -0.55 -3.66 117.98 118.12 2yuj s PHE 23 Ca -0.01 -0.51 -0.13 0.00 0.12 0.00 0.00 56.93 56.39 2yuj s PHE 23 Cb -0.16 -1.08 -0.07 0.00 -0.57 0.00 0.00 43.02 41.13 2yuj s PHE 23 CO -0.07 0.50 0.86 0.45 -0.10 0.00 0.00 175.22 176.86 2yuj s SER 24 N -3.48 6.59 0.42 1.36 0.15 -1.26 -0.32 113.70 117.16 2yuj s SER 24 Ca 0.29 1.33 0.14 0.00 0.70 0.00 0.00 55.95 58.42 2yuj s SER 24 Cb -0.00 -2.41 0.91 0.00 -1.71 0.00 0.00 66.02 62.82 2yuj s SER 24 CO 0.13 -0.46 1.93 -0.37 1.20 0.00 0.00 173.24 175.67 2yuj h VAL 25 N 1.10 1.15 -0.15 4.45 -1.51 -1.79 -2.35 116.25 117.15 2yuj h VAL 25 Ca -0.47 -0.88 0.04 0.00 -1.23 0.00 0.00 66.70 64.16 2yuj h VAL 25 Cb 1.19 1.48 -0.01 0.00 -2.13 0.00 0.00 31.29 31.82 2yuj h VAL 25 CO 0.63 0.25 0.13 0.77 -1.23 0.00 0.00 177.57 178.12 2yuj h SER 26 N 0.00 0.00 -0.57 4.19 4.64 -1.93 -1.17 113.55 118.72 2yuj h SER 26 Ca -0.00 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.26 2yuj h SER 26 Cb 0.46 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.52 2yuj h SER 26 CO 0.03 0.00 0.15 0.24 -0.87 0.00 0.00 176.83 176.38 2yuj h MET 27 N 0.00 0.94 -0.70 4.77 2.07 -1.82 -2.58 114.93 117.62 2yuj h MET 27 Ca 0.07 -0.20 0.06 0.00 -2.07 0.00 0.00 59.70 57.55 2yuj h MET 27 Cb 0.33 -0.14 -0.04 0.00 -1.87 0.00 0.00 31.60 29.89 2yuj h MET 27 CO -0.00 0.84 0.46 1.25 1.07 0.00 0.00 176.91 180.53 2yuj h LEU 28 N 0.90 0.65 -0.32 1.22 5.85 -1.36 -3.48 115.31 118.78 2yuj h LEU 28 Ca 0.20 0.00 0.37 0.00 0.84 0.00 0.00 57.88 59.29 2yuj h LEU 28 Cb 0.32 -0.14 -0.11 0.00 0.37 0.00 0.00 40.66 41.10 2yuj h LEU 28 CO -0.00 0.43 -0.64 0.00 -0.34 0.00 0.00 178.44 177.89 2yuj n ALA 29 N -2.45 -3.63 0.00 1.25 0.00 -0.97 -5.08 120.51 109.63 2yuj n ALA 29 Ca 0.10 0.53 0.00 0.00 0.00 0.00 0.00 53.44 54.07 2yuj n ALA 29 Cb 0.21 -1.30 0.00 0.00 0.00 0.00 0.00 19.45 18.35 2yuj n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2yuj n GLY 30 N -4.19 4.68 0.38 0.00 0.00 -1.26 -4.96 105.19 99.84 2yuj n GLY 30 Ca -0.01 -0.82 0.14 0.00 0.00 0.00 0.00 46.02 45.33 2yuj n GLY 30 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2yuj h PRO 31 N 0.00 0.57 -5.03 1.61 0.11 -2.05 -3.38 132.00 123.83 2yuj h PRO 31 Ca 0.00 -0.03 -0.66 0.00 0.11 0.00 0.00 66.00 65.41 2yuj h PRO 31 Cb 0.00 -0.13 -0.32 0.00 0.11 0.00 0.00 31.00 30.66 2yuj h PRO 31 CO 0.00 0.38 -0.80 -0.80 -0.21 0.00 0.00 178.00 176.56 2yuj s ASN 32 N -5.80 3.63 0.35 -2.05 0.01 -1.26 -5.12 114.94 104.70 2yuj s ASN 32 Ca -0.09 -0.54 0.07 0.00 -0.71 0.00 0.00 52.86 51.59 2yuj s ASN 32 Cb 0.22 -1.59 -0.02 0.00 0.41 0.00 0.00 41.25 40.26 2yuj s ASN 32 CO 0.78 -0.01 0.32 -1.81 -1.51 0.00 0.00 177.10 174.88 2yuj s ASP 33 N 1.37 5.31 0.06 -1.22 1.11 -1.26 -5.12 116.67 116.91 2yuj s ASP 33 Ca 0.05 -0.51 0.04 0.00 0.18 0.00 0.00 52.55 52.31 2yuj s ASP 33 Cb -0.14 -0.92 -0.04 0.00 1.07 0.00 0.00 42.92 42.90 2yuj s ASP 33 CO -0.09 -0.41 -0.00 -0.60 1.18 0.00 0.00 175.17 175.25 2yuj s ARG 34 N -4.04 2.63 -0.37 8.23 3.52 -1.26 -5.02 118.95 122.64 2yuj s ARG 34 Ca 0.43 -0.76 0.06 0.00 -0.13 0.00 0.00 55.73 55.33 2yuj s ARG 34 Cb -0.06 -2.58 0.50 0.00 -1.56 0.00 0.00 34.95 31.25 2yuj s ARG 34 CO 0.27 0.57 1.55 0.45 -0.81 0.00 0.00 175.30 177.33 2yuj n SER 35 N 0.87 3.89 -0.01 -2.12 2.88 -1.26 -4.53 113.62 113.35 2yuj n SER 35 Ca -0.12 -3.77 -0.02 0.00 -1.33 0.00 0.00 58.87 53.63 2yuj n SER 35 Cb 0.52 -0.65 -0.01 0.00 -0.75 0.00 0.00 64.21 63.32 2yuj n SER 35 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2yuj n ASP 36 N -1.01 3.47 -0.12 -3.46 9.92 -1.26 -4.35 116.55 119.74 2yuj n ASP 36 Ca 0.43 -0.01 -0.09 0.00 -0.53 0.00 0.00 54.79 54.59 2yuj n ASP 36 Cb 1.02 -0.04 -0.01 0.00 -0.64 0.00 0.00 41.12 41.45 2yuj n ASP 36 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 2yuj h VAL 37 N -0.01 1.17 -0.37 2.53 2.07 -1.90 -2.99 116.25 116.75 2yuj h VAL 37 Ca -0.05 -0.50 -0.16 0.00 0.82 0.00 0.00 66.70 66.81 2yuj h VAL 37 Cb 1.08 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 2yuj h VAL 37 CO -0.01 0.18 -0.39 -0.33 0.02 0.00 0.00 177.57 177.04 2yuj h GLU 38 N 0.43 0.90 -5.72 1.57 4.39 -1.85 -3.34 114.58 110.96 2yuj h GLU 38 Ca 0.12 -0.47 -0.62 0.00 0.34 0.00 0.00 59.36 58.73 2yuj h GLU 38 Cb 0.14 0.02 -0.13 0.00 -0.10 0.00 0.00 28.75 28.68 2yuj h GLU 38 CO -0.01 1.12 1.02 0.15 -1.16 0.00 0.00 179.01 180.13 2yuj s LYS 39 N -4.38 3.40 0.00 2.33 1.02 -1.13 -4.78 119.74 116.20 2yuj s LYS 39 Ca -0.11 -1.05 0.00 0.00 0.02 0.00 0.00 55.97 54.83 2yuj s LYS 39 Cb 0.11 -4.75 0.00 0.00 -0.52 0.00 0.00 37.83 32.67 2yuj s LYS 39 CO 0.88 -1.99 0.00 0.41 -0.92 0.00 0.00 175.35 173.72 2yuj n GLY 40 N 5.87 0.35 2.61 -3.33 0.00 -1.26 -4.77 105.19 104.66 2yuj n GLY 40 Ca 0.16 -1.32 -0.10 0.00 0.00 0.00 0.00 46.02 44.76 2yuj n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yuj n GLY 41 N 0.00 1.70 3.61 -0.02 0.00 -1.24 -4.79 105.19 104.44 2yuj n GLY 41 Ca 0.00 -0.92 -0.27 0.00 0.00 0.00 0.00 46.02 44.83 2yuj n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yuj s LYS 42 N -1.83 2.20 0.10 1.61 1.02 -1.25 -2.68 119.74 118.91 2yuj s LYS 42 Ca 0.27 -1.19 0.01 0.00 0.02 0.00 0.00 55.97 55.08 2yuj s LYS 42 Cb 0.41 -2.25 -0.04 0.00 -0.52 0.00 0.00 37.83 35.43 2yuj s LYS 42 CO -0.02 0.45 -0.04 0.96 -0.92 0.00 0.00 175.35 175.78 2yuj s ILE 43 N -1.68 0.54 -0.42 2.17 -4.36 -0.65 -4.37 121.20 112.44 2yuj s ILE 43 Ca 0.26 -1.92 -0.06 0.00 -0.26 0.00 0.00 60.65 58.67 2yuj s ILE 43 Cb -0.09 -1.75 0.10 0.00 1.25 0.00 0.00 42.46 41.96 2yuj s ILE 43 CO 0.16 -0.80 0.23 -0.63 0.24 0.00 0.00 174.94 174.15 2yuj s ILE 44 N -3.73 3.73 0.27 8.37 1.01 -0.72 -0.81 121.20 129.32 2yuj s ILE 44 Ca 0.14 -1.76 0.05 0.00 0.00 0.00 0.00 60.65 59.08 2yuj s ILE 44 Cb 0.06 -3.42 -0.02 0.00 0.01 0.00 0.00 42.46 39.09 2yuj s ILE 44 CO -0.04 -0.61 0.40 -0.04 0.00 0.00 0.00 174.94 174.65 2yuj s MET 45 N 1.28 3.35 0.92 2.79 -1.94 -1.05 -1.66 119.30 122.99 2yuj s MET 45 Ca 0.05 -0.79 -0.12 0.00 -1.71 0.00 0.00 55.69 53.12 2yuj s MET 45 Cb -0.23 -2.85 0.08 0.00 2.01 0.00 0.00 34.83 33.83 2yuj s MET 45 CO -0.01 0.31 0.76 -2.30 -0.01 0.00 0.00 175.02 173.76 2yuj n PRO 46 N -1.50 -0.31 0.18 2.03 -0.02 -1.26 -3.32 135.00 130.80 2yuj n PRO 46 Ca -0.06 -0.04 0.04 0.00 -2.02 0.00 0.00 63.50 61.42 2yuj n PRO 46 Cb 0.57 -2.10 0.35 0.00 -0.02 0.00 0.00 33.50 32.30 2yuj n PRO 46 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 2yuj h PRO 47 N -1.62 0.00 -0.23 0.52 0.13 -1.72 -2.99 132.00 126.10 2yuj h PRO 47 Ca -0.43 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.71 2yuj h PRO 47 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 2yuj h PRO 47 CO 0.38 0.40 0.15 0.66 -0.23 0.00 0.00 178.00 179.36 2yuj h SER 48 N 0.00 0.20 -0.64 1.44 4.64 -1.91 -1.55 113.55 115.73 2yuj h SER 48 Ca -0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2yuj h SER 48 Cb 0.82 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.83 2yuj h SER 48 CO 0.05 0.14 0.41 0.00 -0.87 0.00 0.00 176.83 176.56 2yuj h ALA 49 N 1.87 1.52 -0.51 5.18 0.00 -1.89 -0.65 119.26 124.78 2yuj h ALA 49 Ca 0.09 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2yuj h ALA 49 Cb 0.08 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2yuj h ALA 49 CO -0.02 0.44 0.27 1.25 0.00 0.00 0.00 179.25 181.19 2yuj h LEU 50 N 0.87 0.65 -0.74 0.00 5.85 -1.44 0.29 115.31 120.79 2yuj h LEU 50 Ca 0.23 -0.10 -0.13 0.00 0.84 0.00 0.00 57.88 58.72 2yuj h LEU 50 Cb -0.08 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 2yuj h LEU 50 CO -0.05 0.56 -0.60 0.44 -0.34 0.00 0.00 178.44 178.46 2yuj h ASP 51 N 0.68 0.12 -0.08 1.25 3.32 -1.45 -2.69 116.42 117.57 2yuj h ASP 51 Ca 0.18 -0.07 -0.21 0.00 0.02 0.00 0.00 57.03 56.96 2yuj h ASP 51 Cb 0.07 -0.03 0.01 0.00 0.22 0.00 0.00 39.33 39.60 2yuj h ASP 51 CO -0.03 0.69 -0.75 -0.61 -1.72 0.00 0.00 179.24 176.81 2yuj h GLN 52 N 0.08 0.65 -0.18 3.56 5.75 -0.72 -2.41 115.11 121.84 2yuj h GLN 52 Ca -0.01 -0.60 -0.00 0.00 -0.15 0.00 0.00 58.65 57.90 2yuj h GLN 52 Cb 1.07 0.14 -0.01 0.00 1.07 0.00 0.00 27.48 29.76 2yuj h GLN 52 CO 0.08 1.21 0.10 -0.07 -2.65 0.00 0.00 178.83 177.50 2yuj h LEU 53 N 0.31 0.22 -1.40 -2.39 3.38 -0.41 -1.18 115.31 113.84 2yuj h LEU 53 Ca -0.07 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 57.76 2yuj h LEU 53 Cb 1.41 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 42.09 2yuj h LEU 53 CO 0.15 0.24 -0.24 0.77 0.09 0.00 0.00 178.44 179.46 2yuj h SER 54 N 0.18 0.09 1.53 -0.43 4.64 -1.55 -1.84 113.55 116.17 2yuj h SER 54 Ca 0.06 -0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.35 2yuj h SER 54 Cb 0.07 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.13 2yuj h SER 54 CO -0.01 0.33 -0.03 0.03 -0.87 0.00 0.00 176.83 176.28 2yuj h ARG 55 N 0.09 0.00 -0.70 4.77 2.47 -0.96 -3.02 114.38 117.02 2yuj h ARG 55 Ca 0.01 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.73 2yuj h ARG 55 Cb 0.47 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.79 2yuj h ARG 55 CO 0.03 0.03 0.00 1.28 0.56 0.00 0.00 179.97 181.87 2yuj n LEU 56 N -3.11 4.45 -2.50 3.04 4.77 -0.49 -4.89 117.00 118.27 2yuj n LEU 56 Ca 0.02 -2.26 -0.18 0.00 -0.03 0.00 0.00 56.01 53.57 2yuj n LEU 56 Cb 0.44 -0.64 -0.00 0.00 -2.33 0.00 0.00 43.42 40.89 2yuj n LEU 56 CO 0.31 0.52 -0.20 -3.20 -1.33 0.00 0.00 177.39 173.50 2yuj n ASN 57 N 0.45 -5.04 -4.87 -1.43 5.15 -1.14 -4.70 115.26 103.68 2yuj n ASN 57 Ca 0.20 0.03 -0.36 0.00 -0.60 0.00 0.00 54.58 53.85 2yuj n ASN 57 Cb 0.94 -4.21 -0.06 0.00 -0.53 0.00 0.00 39.78 35.92 2yuj n ASN 57 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2yuj s ILE 58 N -2.88 5.34 0.29 -1.44 1.01 -0.88 -5.06 121.20 117.59 2yuj s ILE 58 Ca 0.04 0.32 0.02 0.00 0.00 0.00 0.00 60.65 61.03 2yuj s ILE 58 Cb -0.02 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.88 2yuj s ILE 58 CO 0.05 0.52 0.12 0.42 0.00 0.00 0.00 174.94 176.05 2yuj s THR 59 N -1.14 0.50 0.39 2.92 -4.23 -1.26 -4.41 115.64 108.42 2yuj s THR 59 Ca 0.21 -2.00 -0.27 0.00 -1.18 0.00 0.00 61.69 58.45 2yuj s THR 59 Cb -0.13 -2.58 -0.10 0.00 1.34 0.00 0.00 72.50 71.02 2yuj s THR 59 CO 0.10 0.00 1.47 -0.47 -0.54 0.00 0.00 174.62 175.18 2yuj s TYR 60 N -3.65 2.56 0.73 3.99 5.04 -1.26 -4.20 117.35 120.57 2yuj s TYR 60 Ca 0.36 1.19 -0.11 0.00 -2.44 0.00 0.00 57.07 56.07 2yuj s TYR 60 Cb 0.06 -4.00 0.03 0.00 0.35 0.00 0.00 41.96 38.41 2yuj s TYR 60 CO 0.15 -2.97 1.08 -1.25 -1.34 0.00 0.00 175.55 171.23 2yuj s PRO 61 N -2.17 2.65 -0.51 4.97 0.04 -1.26 -5.14 135.00 133.58 2yuj s PRO 61 Ca 0.54 0.66 0.07 0.00 0.04 0.00 0.00 61.00 62.31 2yuj s PRO 61 Cb -0.46 -1.98 0.26 0.00 0.04 0.00 0.00 34.50 32.36 2yuj s PRO 61 CO 0.62 -1.23 0.64 -1.33 0.04 0.00 0.00 177.00 175.74 2yuj n MET 62 N -3.17 1.61 -3.36 4.56 2.81 -1.26 -4.98 117.12 113.33 2yuj n MET 62 Ca 0.07 -3.93 -0.34 0.00 -1.81 0.00 0.00 57.70 51.70 2yuj n MET 62 Cb 0.56 -1.73 -0.06 0.00 -0.71 0.00 0.00 33.22 31.29 2yuj n MET 62 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 2yuj s LEU 63 N -1.87 4.24 -0.16 4.03 1.43 -1.26 -3.87 118.68 121.22 2yuj s LEU 63 Ca 0.38 1.03 -0.01 0.00 -1.03 0.00 0.00 54.13 54.49 2yuj s LEU 63 Cb 0.17 -3.52 -0.01 0.00 0.03 0.00 0.00 46.19 42.86 2yuj s LEU 63 CO -0.06 0.00 -0.10 -0.36 0.23 0.00 0.00 176.35 176.05 2yuj s PHE 64 N -1.66 2.86 -1.02 0.29 0.08 0.11 -2.68 117.98 115.97 2yuj s PHE 64 Ca 0.43 -0.76 -0.21 0.00 0.12 0.00 0.00 56.93 56.52 2yuj s PHE 64 Cb -0.13 -1.93 0.08 0.00 -0.57 0.00 0.00 43.02 40.47 2yuj s PHE 64 CO 0.20 -0.32 1.38 0.21 -0.10 0.00 0.00 175.22 176.59 2yuj s LYS 65 N 0.70 3.63 -1.03 0.44 2.20 -0.49 -2.35 119.74 122.85 2yuj s LYS 65 Ca -0.05 -1.39 -0.24 0.00 -0.36 0.00 0.00 55.97 53.94 2yuj s LYS 65 Cb -0.15 -5.25 -0.14 0.00 -1.51 0.00 0.00 37.83 30.78 2yuj s LYS 65 CO 0.02 -2.08 1.94 1.28 -0.36 0.00 0.00 175.35 176.14 2yuj n LEU 66 N 8.14 2.92 -4.53 5.43 4.77 0.13 -4.39 117.00 129.47 2yuj n LEU 66 Ca 0.32 -2.94 -0.42 0.00 -0.03 0.00 0.00 56.01 52.94 2yuj n LEU 66 Cb 0.50 -1.55 -0.03 0.00 -2.33 0.00 0.00 43.42 40.01 2yuj n LEU 66 CO 0.62 -1.81 1.21 -0.89 -1.33 0.00 0.00 177.39 175.20 2yuj s THR 67 N 10.53 3.96 -0.12 -5.08 2.01 -1.22 -2.31 115.64 123.42 2yuj s THR 67 Ca 0.68 -0.30 -0.29 0.00 0.31 0.00 0.00 61.69 62.08 2yuj s THR 67 Cb 0.03 -4.93 -0.05 0.00 0.01 0.00 0.00 72.50 67.55 2yuj s THR 67 CO 0.15 -1.81 1.86 0.21 -0.69 0.00 0.00 174.62 174.35 2yuj s ASN 68 N 4.18 6.23 -0.40 3.53 2.47 -0.98 -3.66 114.94 126.31 2yuj s ASN 68 Ca 0.37 2.08 0.04 0.00 0.42 0.00 0.00 52.86 55.77 2yuj s ASN 68 Cb -0.06 -2.53 0.61 0.00 -1.45 0.00 0.00 41.25 37.83 2yuj s ASN 68 CO 0.03 -1.31 1.82 0.29 -3.72 0.00 0.00 177.10 174.21 2yuj n LYS 69 N 7.80 2.25 -0.01 0.43 5.02 -1.26 -2.63 118.16 129.76 2yuj n LYS 69 Ca 0.21 -2.73 -0.01 0.00 -2.02 0.00 0.00 58.31 53.76 2yuj n LYS 69 Cb 0.44 -2.08 -0.00 0.00 -0.02 0.00 0.00 35.03 33.37 2yuj n LYS 69 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2yuj n ASN 70 N -0.92 3.72 -0.27 4.39 5.03 -1.26 -4.79 115.26 121.16 2yuj n ASN 70 Ca 0.53 -0.00 0.07 0.00 0.87 0.00 0.00 54.58 56.05 2yuj n ASN 70 Cb 1.55 -0.02 0.12 0.00 -1.02 0.00 0.00 39.78 40.41 2yuj n ASN 70 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 2yuj n SER 71 N -2.56 1.80 -3.57 6.41 7.64 -1.26 -4.98 113.62 117.10 2yuj n SER 71 Ca -0.02 -2.97 -0.26 0.00 1.01 0.00 0.00 58.87 56.62 2yuj n SER 71 Cb 0.52 -0.40 0.03 0.00 -1.01 0.00 0.00 64.21 63.35 2yuj n SER 71 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2yuj n ASP 72 N -1.07 -5.02 -4.91 6.43 8.00 -1.19 -4.97 116.55 113.82 2yuj n ASP 72 Ca 0.13 -0.56 -0.22 0.00 0.71 0.00 0.00 54.79 54.85 2yuj n ASP 72 Cb 0.68 -4.03 0.05 0.00 -0.02 0.00 0.00 41.12 37.80 2yuj n ASP 72 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2yuj s ARG 73 N -6.27 2.35 -0.24 -1.24 1.81 -1.08 -4.98 118.95 109.31 2yuj s ARG 73 Ca 0.53 -0.87 -0.11 0.00 -1.72 0.00 0.00 55.73 53.56 2yuj s ARG 73 Cb -0.26 -2.46 0.09 0.00 -0.45 0.00 0.00 34.95 31.87 2yuj s ARG 73 CO 0.65 -0.88 0.55 1.41 -0.68 0.00 0.00 175.30 176.35 2yuj s MET 74 N -4.84 0.51 -0.07 3.54 -2.45 -1.26 -2.32 119.30 112.40 2yuj s MET 74 Ca 0.59 1.13 -0.04 0.00 -1.25 0.00 0.00 55.69 56.12 2yuj s MET 74 Cb -0.09 0.31 0.04 0.00 1.25 0.00 0.00 34.83 36.34 2yuj s MET 74 CO 0.40 -0.19 0.18 0.99 1.05 0.00 0.00 175.02 177.45 2yuj s THR 75 N 2.09 -0.04 -0.46 10.11 2.01 -0.98 -4.86 115.64 123.52 2yuj s THR 75 Ca -0.07 0.13 -0.09 0.00 0.31 0.00 0.00 61.69 61.98 2yuj s THR 75 Cb -0.09 -0.28 0.11 0.00 0.01 0.00 0.00 72.50 72.25 2yuj s THR 75 CO -0.16 0.05 0.32 -1.00 -0.69 0.00 0.00 174.62 173.14 2yuj s HIS 76 N 0.95 3.42 0.46 4.92 3.76 -1.26 0.20 115.29 127.74 2yuj s HIS 76 Ca -0.07 -1.85 0.07 0.00 -0.15 0.00 0.00 55.06 53.06 2yuj s HIS 76 Cb -0.09 -3.37 -0.00 0.00 1.11 0.00 0.00 32.58 30.23 2yuj s HIS 76 CO -0.05 -0.96 0.38 0.00 -0.85 0.00 0.00 174.74 173.26 2yuj s GLY 78 N -4.17 0.36 0.57 0.00 0.00 -1.09 -0.71 107.32 102.28 2yuj s GLY 78 Ca 0.44 -0.24 -0.19 0.00 0.00 0.00 0.00 44.72 44.74 2yuj s GLY 78 CO 0.26 -0.09 1.14 0.54 0.00 0.00 0.00 173.10 174.95 2yuj s VAL 79 N 0.08 3.06 0.22 1.40 0.11 -1.25 -1.63 120.40 122.38 2yuj s VAL 79 Ca -0.01 0.63 0.00 0.00 -2.93 0.00 0.00 61.98 59.67 2yuj s VAL 79 Cb -0.05 -3.22 0.00 0.00 -1.53 0.00 0.00 36.38 31.57 2yuj s VAL 79 CO -0.00 -0.17 0.00 -0.11 -3.33 0.00 0.00 175.10 171.48 2yuj n LEU 80 N -1.56 0.22 -4.95 2.54 7.94 0.01 -4.73 117.00 116.47 2yuj n LEU 80 Ca 0.12 0.36 -0.24 0.00 -1.11 0.00 0.00 56.01 55.14 2yuj n LEU 80 Cb 0.51 0.16 -0.03 0.00 0.53 0.00 0.00 43.42 44.60 2yuj n LEU 80 CO 0.44 -0.77 -0.05 -1.61 -1.11 0.00 0.00 177.39 174.29 2yuj s GLU 81 N -1.93 3.45 -0.43 1.96 8.01 -1.19 -5.03 118.70 123.53 2yuj s GLU 81 Ca 0.00 -0.63 0.10 0.00 0.01 0.00 0.00 54.97 54.45 2yuj s GLU 81 Cb 0.00 -2.91 0.39 0.00 -4.31 0.00 0.00 34.13 27.30 2yuj s GLU 81 CO 0.00 0.46 0.92 1.19 0.01 0.00 0.00 175.26 177.84 2yuj n PHE 82 N -0.97 2.15 -2.26 1.61 3.72 -1.26 -2.54 117.46 117.91 2yuj n PHE 82 Ca -0.08 -3.47 0.02 0.00 -0.05 0.00 0.00 57.45 53.88 2yuj n PHE 82 Cb 0.55 -0.35 0.08 0.00 -0.94 0.00 0.00 39.48 38.82 2yuj n PHE 82 CO 0.00 0.00 0.00 1.33 -0.05 0.00 0.00 176.76 178.04 2yuj n VAL 83 N -0.11 0.92 -2.73 -4.37 0.24 -1.22 -3.84 118.33 107.22 2yuj n VAL 83 Ca 0.26 -2.05 -0.22 0.00 -2.04 0.00 0.00 64.34 60.29 2yuj n VAL 83 Cb 0.63 0.56 0.03 0.00 -1.47 0.00 0.00 33.84 33.58 2yuj n VAL 83 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2yuj s ALA 84 N -1.57 3.85 0.39 2.33 0.00 -1.21 -4.96 121.76 120.59 2yuj s ALA 84 Ca 0.35 -1.25 -0.15 0.00 0.00 0.00 0.00 51.96 50.91 2yuj s ALA 84 Cb 0.38 -2.10 -0.09 0.00 0.00 0.00 0.00 23.12 21.31 2yuj s ALA 84 CO -0.11 -0.65 0.83 -0.51 0.00 0.00 0.00 175.76 175.31 2yuj s ASP 85 N -4.37 6.73 0.29 0.00 1.01 -1.25 -4.14 116.67 114.94 2yuj s ASP 85 Ca 0.55 1.38 -0.30 0.00 0.71 0.00 0.00 52.55 54.89 2yuj s ASP 85 Cb -0.10 -2.42 -0.12 0.00 1.01 0.00 0.00 42.92 41.29 2yuj s ASP 85 CO 0.38 -0.34 1.61 -0.62 0.21 0.00 0.00 175.17 176.41 2yuj n GLU 86 N -0.83 2.74 -1.86 8.23 1.02 -1.26 -1.71 120.64 126.97 2yuj n GLU 86 Ca 0.04 0.98 -0.16 0.00 -0.02 0.00 0.00 57.16 58.00 2yuj n GLU 86 Cb 0.54 -2.77 -0.04 0.00 -0.02 0.00 0.00 31.44 29.15 2yuj n GLU 86 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2yuj n GLY 87 N 2.26 0.68 2.69 0.62 0.00 -1.26 -4.96 105.19 105.22 2yuj n GLY 87 Ca 0.09 -0.26 -0.20 0.00 0.00 0.00 0.00 46.02 45.65 2yuj n GLY 87 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yuj s ILE 88 N -2.68 -0.23 -0.18 -0.61 1.01 -0.69 -4.49 121.20 113.33 2yuj s ILE 88 Ca 0.00 -1.06 -0.18 0.00 0.00 0.00 0.00 60.65 59.41 2yuj s ILE 88 Cb 0.00 -0.82 -0.04 0.00 0.01 0.00 0.00 42.46 41.61 2yuj s ILE 88 CO 0.00 -0.66 0.49 0.00 0.00 0.00 0.00 174.94 174.77 2yuj s TYR 90 N 1.27 3.70 0.06 0.00 2.02 -0.67 -1.48 117.35 122.26 2yuj s TYR 90 Ca 0.24 1.00 -0.03 0.00 -0.37 0.00 0.00 57.07 57.91 2yuj s TYR 90 Cb -0.15 -2.30 -0.03 0.00 -0.40 0.00 0.00 41.96 39.08 2yuj s TYR 90 CO 0.09 0.60 0.03 -0.51 -1.57 0.00 0.00 175.55 174.19 2yuj s LEU 91 N -1.30 2.21 1.10 -1.29 1.02 0.56 -1.76 118.68 119.22 2yuj s LEU 91 Ca 0.27 -0.93 -0.16 0.00 0.02 0.00 0.00 54.13 53.34 2yuj s LEU 91 Cb -0.16 0.40 0.20 0.00 0.02 0.00 0.00 46.19 46.65 2yuj s LEU 91 CO 0.15 -0.64 0.39 -2.65 0.02 0.00 0.00 176.35 173.63 2yuj n PRO 92 N 0.06 -2.64 -0.02 1.29 -0.02 -1.26 -2.73 135.00 129.68 2yuj n PRO 92 Ca -0.14 -0.78 -0.20 0.00 -2.02 0.00 0.00 63.50 60.36 2yuj n PRO 92 Cb 0.61 -1.58 -0.13 0.00 -0.02 0.00 0.00 33.50 32.38 2yuj n PRO 92 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2yuj h HIS 93 N -2.78 0.30 -0.84 6.00 2.76 -1.95 -3.26 115.15 115.37 2yuj h HIS 93 Ca -0.31 -0.22 0.00 0.00 -2.20 0.00 0.00 60.37 57.65 2yuj h HIS 93 Cb 0.93 -0.01 -0.04 0.00 1.55 0.00 0.00 27.41 29.84 2yuj h HIS 93 CO -2.74 1.39 0.55 0.11 -1.30 0.00 0.00 177.93 175.93 2yuj h TRP 94 N -0.57 1.08 -0.85 5.26 5.08 -1.93 -2.18 115.95 121.83 2yuj h TRP 94 Ca -0.22 0.02 -0.01 0.00 1.08 0.00 0.00 58.89 59.76 2yuj h TRP 94 Cb 1.51 -0.36 -0.04 0.00 -3.00 0.00 0.00 29.16 27.27 2yuj h TRP 94 CO 0.16 0.69 0.49 1.98 -1.28 0.00 0.00 178.44 180.48 2yuj h MET 95 N 1.15 1.18 -0.67 0.12 4.05 -1.89 0.11 114.93 118.98 2yuj h MET 95 Ca 0.31 -0.12 -0.03 0.00 -0.28 0.00 0.00 59.70 59.57 2yuj h MET 95 Cb -0.11 -0.24 -0.03 0.00 -0.80 0.00 0.00 31.60 30.42 2yuj h MET 95 CO -0.06 0.85 0.29 0.52 0.23 0.00 0.00 176.91 178.73 2yuj h MET 96 N 1.18 0.99 -0.18 0.39 2.86 -1.45 -1.80 114.93 116.92 2yuj h MET 96 Ca 0.30 -0.17 -0.17 0.00 -2.06 0.00 0.00 59.70 57.60 2yuj h MET 96 Cb -0.00 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.49 2yuj h MET 96 CO -0.05 0.81 -0.60 1.96 1.06 0.00 0.00 176.91 180.09 2yuj h GLN 97 N 0.94 0.59 -0.78 1.72 4.20 -1.06 0.85 115.11 121.57 2yuj h GLN 97 Ca 0.23 -0.40 -0.03 0.00 0.06 0.00 0.00 58.65 58.51 2yuj h GLN 97 Cb 0.18 0.06 -0.04 0.00 0.30 0.00 0.00 27.48 27.98 2yuj h GLN 97 CO -0.02 1.01 0.37 -0.97 -0.67 0.00 0.00 178.83 178.55 2yuj h ASN 98 N 0.44 1.01 1.23 1.46 -1.24 -0.52 -2.55 115.58 115.41 2yuj h ASN 98 Ca -0.00 -0.12 -0.02 0.00 0.71 0.00 0.00 56.30 56.87 2yuj h ASN 98 Cb 1.16 -0.26 -0.00 0.00 0.73 0.00 0.00 38.32 39.95 2yuj h ASN 98 CO 0.11 0.86 -0.78 -0.07 -1.29 0.00 0.00 177.43 176.26 2yuj h LEU 99 N 1.11 0.00 -1.09 0.34 3.38 -1.28 -3.49 115.31 114.28 2yuj h LEU 99 Ca 0.27 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.89 2yuj h LEU 99 Cb 0.11 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.00 2yuj h LEU 99 CO -0.03 0.07 -0.64 0.18 0.09 0.00 0.00 178.44 178.10 2yuj n LEU 100 N -2.82 -3.45 -4.94 1.67 4.77 0.28 -4.87 117.00 107.64 2yuj n LEU 100 Ca 0.00 -0.51 -0.24 0.00 -0.03 0.00 0.00 56.01 55.22 2yuj n LEU 100 Cb 0.58 -2.84 0.06 0.00 -2.33 0.00 0.00 43.42 38.88 2yuj n LEU 100 CO 0.39 0.53 0.54 -0.76 -1.33 0.00 0.00 177.39 176.76 2yuj s LEU 101 N -6.55 2.95 0.54 2.23 1.43 -1.11 -5.04 118.68 113.13 2yuj s LEU 101 Ca 0.39 0.32 0.03 0.00 -1.03 0.00 0.00 54.13 53.84 2yuj s LEU 101 Cb -0.17 -3.03 0.03 0.00 0.03 0.00 0.00 46.19 43.04 2yuj s LEU 101 CO 0.67 -1.47 0.25 -0.70 0.23 0.00 0.00 176.35 175.33 2yuj s GLU 102 N -5.11 2.23 -0.83 1.70 2.56 -1.26 -4.95 118.70 113.05 2yuj s GLU 102 Ca 0.59 -2.20 -0.26 0.00 0.00 0.00 0.00 54.97 53.10 2yuj s GLU 102 Cb -0.11 -1.87 -0.15 0.00 2.00 0.00 0.00 34.13 34.00 2yuj s GLU 102 CO 0.43 -0.56 2.38 -0.85 -0.56 0.00 0.00 175.26 176.10 2yuj n GLU 103 N -1.60 0.50 0.00 4.30 0.00 -1.26 -1.98 120.64 120.60 2yuj n GLU 103 Ca -0.09 -0.97 0.00 0.00 0.00 0.00 0.00 57.16 56.10 2yuj n GLU 103 Cb 0.65 -3.73 0.00 0.00 0.00 0.00 0.00 31.44 28.36 2yuj n GLU 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2yuj n GLY 104 N 6.73 0.66 3.52 -1.84 0.00 -1.24 -5.04 105.19 107.97 2yuj n GLY 104 Ca 0.46 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 46.05 2yuj n GLY 104 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2yuj s GLY 105 N -1.13 1.58 0.16 -0.02 0.00 -0.84 -4.71 107.32 102.36 2yuj s GLY 105 Ca 0.00 -1.22 -0.30 0.00 0.00 0.00 0.00 44.72 43.20 2yuj s GLY 105 CO 0.00 1.79 1.33 1.08 0.00 0.00 0.00 173.10 177.31 2yuj s LEU 106 N 3.34 4.40 0.06 0.66 1.43 -1.26 -2.06 118.68 125.25 2yuj s LEU 106 Ca 0.27 2.36 0.04 0.00 -1.03 0.00 0.00 54.13 55.77 2yuj s LEU 106 Cb -0.14 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.46 2yuj s LEU 106 CO 0.19 -0.57 -0.12 -0.69 0.23 0.00 0.00 176.35 175.39 2yuj s VAL 107 N 0.51 0.93 -0.26 -1.59 1.01 -0.18 -4.82 120.40 116.01 2yuj s VAL 107 Ca 0.60 -1.20 -0.28 0.00 0.00 0.00 0.00 61.98 61.10 2yuj s VAL 107 Cb -0.36 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 2yuj s VAL 107 CO 0.35 -0.25 2.05 -1.58 0.00 0.00 0.00 175.10 175.67 2yuj s GLN 108 N -1.62 3.23 -0.27 2.72 2.00 -1.24 -2.29 119.66 122.18 2yuj s GLN 108 Ca -0.04 1.80 -0.11 0.00 -2.00 0.00 0.00 55.36 55.01 2yuj s GLN 108 Cb -0.10 -4.30 -0.05 0.00 0.80 0.00 0.00 33.01 29.36 2yuj s GLN 108 CO 0.02 -1.99 0.20 0.08 -0.50 0.00 0.00 175.29 173.10 2yuj s VAL 109 N 7.69 5.30 -0.09 1.34 1.01 0.30 -3.38 120.40 132.57 2yuj s VAL 109 Ca 0.92 0.21 -0.12 0.00 0.00 0.00 0.00 61.98 62.99 2yuj s VAL 109 Cb -0.29 -3.54 0.03 0.00 0.00 0.00 0.00 36.38 32.58 2yuj s VAL 109 CO 0.35 0.25 0.31 -1.61 0.00 0.00 0.00 175.10 174.40 2yuj s GLU 110 N 1.71 0.44 -0.36 2.72 2.02 -1.26 -1.17 118.70 122.80 2yuj s GLU 110 Ca 0.08 0.27 -0.21 0.00 0.02 0.00 0.00 54.97 55.13 2yuj s GLU 110 Cb -0.16 0.21 0.00 0.00 0.10 0.00 0.00 34.13 34.28 2yuj s GLU 110 CO 0.10 -0.08 0.66 -1.54 0.02 0.00 0.00 175.26 174.43 2yuj s SER 111 N -0.22 6.45 0.15 -0.19 1.04 -1.24 -1.39 113.70 118.30 2yuj s SER 111 Ca -0.04 0.19 0.09 0.00 0.48 0.00 0.00 55.95 56.68 2yuj s SER 111 Cb -0.03 -2.34 -0.04 0.00 0.10 0.00 0.00 66.02 63.71 2yuj s SER 111 CO 0.01 -0.62 -0.17 0.68 0.98 0.00 0.00 173.24 174.13 2yuj s VAL 112 N 2.78 2.85 -0.25 5.02 -7.23 -1.09 -4.64 120.40 117.84 2yuj s VAL 112 Ca 0.26 -1.66 -0.06 0.00 -1.81 0.00 0.00 61.98 58.71 2yuj s VAL 112 Cb -0.14 -2.35 -0.02 0.00 0.56 0.00 0.00 36.38 34.43 2yuj s VAL 112 CO 0.15 -0.01 0.03 0.20 -0.31 0.00 0.00 175.10 175.17 2yuj s ASN 113 N -2.46 4.84 0.53 4.85 -0.87 -1.26 -4.37 114.94 116.20 2yuj s ASN 113 Ca 0.21 -0.36 0.00 0.00 -1.57 0.00 0.00 52.86 51.14 2yuj s ASN 113 Cb -0.09 -1.85 0.00 0.00 -0.02 0.00 0.00 41.25 39.29 2yuj s ASN 113 CO 0.12 -0.06 0.02 -0.76 -2.57 0.00 0.00 177.10 173.85 2yuj s LEU 114 N 1.55 2.21 0.43 0.60 1.43 -1.26 -5.11 118.68 118.53 2yuj s LEU 114 Ca 0.06 -1.69 0.06 0.00 -1.03 0.00 0.00 54.13 51.53 2yuj s LEU 114 Cb -0.15 -0.72 -0.06 0.00 0.03 0.00 0.00 46.19 45.29 2yuj s LEU 114 CO 0.01 -0.94 0.06 -1.10 0.23 0.00 0.00 176.35 174.61 2yuj s GLN 115 N -3.93 2.07 0.16 1.70 -0.21 -1.26 -4.72 119.66 113.48 2yuj s GLN 115 Ca 0.02 -2.09 -0.30 0.00 0.02 0.00 0.00 55.36 53.01 2yuj s GLN 115 Cb -0.00 -1.72 -0.08 0.00 1.00 0.00 0.00 33.01 32.21 2yuj s GLN 115 CO 0.01 -0.14 1.26 0.14 -2.12 0.00 0.00 175.29 174.44 2yuj s VAL 116 N -2.71 3.49 0.53 1.09 -7.23 -1.22 -0.11 120.40 114.23 2yuj s VAL 116 Ca 0.32 1.19 -0.21 0.00 -1.81 0.00 0.00 61.98 61.47 2yuj s VAL 116 Cb 0.07 -3.76 -0.05 0.00 0.56 0.00 0.00 36.38 33.19 2yuj s VAL 116 CO 0.17 0.16 1.25 0.00 -0.31 0.00 0.00 175.10 176.37 2yuj s ALA 117 N 0.28 2.80 -0.09 1.32 0.00 -1.26 -4.73 121.76 120.07 2yuj s ALA 117 Ca 0.56 1.10 0.04 0.00 0.00 0.00 0.00 51.96 53.66 2yuj s ALA 117 Cb -0.34 -3.47 -0.08 0.00 0.00 0.00 0.00 23.12 19.23 2yuj s ALA 117 CO 0.35 -1.05 -0.04 0.25 0.00 0.00 0.00 175.76 175.27 2yuj n THR 118 N -0.99 0.58 -3.70 0.00 -2.24 -1.09 -4.57 114.28 102.26 2yuj n THR 118 Ca 0.10 -0.28 -0.30 0.00 -2.27 0.00 0.00 64.05 61.30 2yuj n THR 118 Cb 0.47 -0.83 -0.15 0.00 -2.10 0.00 0.00 70.33 67.72 2yuj n THR 118 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2yuj s TYR 119 N -2.20 1.49 -0.30 4.78 5.04 -1.26 -0.16 117.35 124.73 2yuj s TYR 119 Ca -0.10 -1.61 -0.03 0.00 -2.44 0.00 0.00 57.07 52.89 2yuj s TYR 119 Cb 0.03 -1.59 0.04 0.00 0.35 0.00 0.00 41.96 40.80 2yuj s TYR 119 CO 0.28 -0.87 0.01 -1.54 -1.34 0.00 0.00 175.55 172.10 2yuj s SER 120 N 1.67 4.90 -0.13 4.32 1.04 -1.06 -1.53 113.70 122.91 2yuj s SER 120 Ca 0.10 -1.15 -0.06 0.00 0.48 0.00 0.00 55.95 55.31 2yuj s SER 120 Cb -0.17 -1.74 -0.04 0.00 0.10 0.00 0.00 66.02 64.17 2yuj s SER 120 CO -0.27 -0.25 0.08 -0.75 0.98 0.00 0.00 173.24 173.04 2yuj s LYS 121 N 1.31 3.53 0.20 4.02 2.20 0.85 -2.56 119.74 129.30 2yuj s LYS 121 Ca -0.03 -0.26 0.11 0.00 -0.36 0.00 0.00 55.97 55.43 2yuj s LYS 121 Cb -0.19 -3.12 -0.04 0.00 -1.51 0.00 0.00 37.83 32.97 2yuj s LYS 121 CO -0.01 0.59 -0.23 -0.06 -0.36 0.00 0.00 175.35 175.28 2yuj s PHE 122 N -0.51 2.26 -0.36 4.03 0.40 -1.11 -1.72 117.98 120.96 2yuj s PHE 122 Ca 0.11 -0.36 0.00 0.00 -0.60 0.00 0.00 56.93 56.08 2yuj s PHE 122 Cb -0.12 -1.10 0.12 0.00 0.51 0.00 0.00 43.02 42.44 2yuj s PHE 122 CO 0.02 0.52 0.17 -1.14 0.70 0.00 0.00 175.22 175.49 2yuj s GLN 123 N -2.82 0.86 -0.22 0.44 0.74 -0.68 -2.57 119.66 115.41 2yuj s GLN 123 Ca 0.22 -1.42 -0.38 0.00 0.05 0.00 0.00 55.36 53.83 2yuj s GLN 123 Cb -0.07 -1.94 -0.15 0.00 1.10 0.00 0.00 33.01 31.95 2yuj s GLN 123 CO 0.10 -1.09 1.77 -2.30 -0.55 0.00 0.00 175.29 173.23 2yuj n PRO 124 N 4.27 1.44 0.09 1.67 -0.02 -1.26 -3.79 135.00 137.39 2yuj n PRO 124 Ca 0.04 0.53 -0.07 0.00 -2.02 0.00 0.00 63.50 61.98 2yuj n PRO 124 Cb 0.38 -2.25 0.01 0.00 -0.02 0.00 0.00 33.50 31.62 2yuj n PRO 124 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2yuj h GLN 125 N 7.69 0.10 -6.61 -0.52 1.08 -1.85 -3.45 115.11 111.55 2yuj h GLN 125 Ca -0.47 -0.11 -0.67 0.00 -1.45 0.00 0.00 58.65 55.94 2yuj h GLN 125 Cb 1.31 0.03 -0.17 0.00 -0.05 0.00 0.00 27.48 28.59 2yuj h GLN 125 CO 0.95 0.89 -0.77 0.45 -0.95 0.00 0.00 178.83 179.40 2yuj s SER 126 N -6.86 4.15 0.00 1.46 0.15 -1.24 -5.01 113.70 106.35 2yuj s SER 126 Ca -0.02 -0.45 0.15 0.00 0.70 0.00 0.00 55.95 56.33 2yuj s SER 126 Cb 0.11 -0.71 0.64 0.00 -1.71 0.00 0.00 66.02 64.35 2yuj s SER 126 CO 0.81 0.19 1.47 -0.81 1.20 0.00 0.00 173.24 176.10 2yuj n PRO 127 N 0.83 0.02 -0.16 5.44 -0.04 -1.26 -3.17 135.00 136.65 2yuj n PRO 127 Ca -0.15 0.24 0.10 0.00 -0.04 0.00 0.00 63.50 63.65 2yuj n PRO 127 Cb 0.52 -1.50 0.42 0.00 -0.04 0.00 0.00 33.50 32.90 2yuj n PRO 127 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2yuj h ASP 128 N 0.00 0.54 0.68 3.54 3.32 -1.98 -0.46 116.42 122.07 2yuj h ASP 128 Ca 0.00 0.01 -0.26 0.00 0.02 0.00 0.00 57.03 56.80 2yuj h ASP 128 Cb 0.25 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 39.69 2yuj h ASP 128 CO 0.00 0.33 -1.17 0.15 -1.72 0.00 0.00 179.24 176.83 2yuj h PHE 129 N 0.61 0.40 -0.30 4.55 3.57 -1.94 -3.28 116.94 120.55 2yuj h PHE 129 Ca 0.32 -0.29 -0.08 0.00 3.53 0.00 0.00 57.97 61.46 2yuj h PHE 129 Cb 0.46 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.17 2yuj h PHE 129 CO -0.00 1.21 -0.15 -0.07 -2.23 0.00 0.00 178.31 177.07 2yuj h LEU 130 N 0.07 0.51 -2.11 0.59 3.38 -1.41 -2.37 115.31 113.97 2yuj h LEU 130 Ca -0.11 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.71 2yuj h LEU 130 Cb 1.90 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 42.51 2yuj h LEU 130 CO 0.19 0.68 -0.07 0.44 0.09 0.00 0.00 178.44 179.77 2yuj h ASP 131 N 0.48 0.00 -3.87 -0.43 5.19 -1.19 -3.43 116.42 113.16 2yuj h ASP 131 Ca 0.08 0.00 -0.54 0.00 -0.62 0.00 0.00 57.03 55.96 2yuj h ASP 131 Cb 0.54 0.00 0.11 0.00 0.18 0.00 0.00 39.33 40.15 2yuj h ASP 131 CO 0.03 0.07 0.80 -0.63 -3.12 0.00 0.00 179.24 176.40 2yuj s ILE 132 N -4.51 2.00 0.07 0.35 1.01 -0.89 -4.93 121.20 114.30 2yuj s ILE 132 Ca -0.04 0.00 -0.27 0.00 0.00 0.00 0.00 60.65 60.34 2yuj s ILE 132 Cb 0.15 -3.00 -0.17 0.00 0.01 0.00 0.00 42.46 39.44 2yuj s ILE 132 CO 0.59 0.00 1.61 0.74 0.00 0.00 0.00 174.94 177.88 2yuj h THR 133 N 3.02 0.70 -3.07 2.92 2.02 -1.88 -3.35 112.91 113.27 2yuj h THR 133 Ca -0.51 -0.12 -0.62 0.00 0.77 0.00 0.00 66.41 65.94 2yuj h THR 133 Cb 1.24 0.76 -0.42 0.00 -1.74 0.00 0.00 68.15 67.99 2yuj h THR 133 CO 0.66 0.03 -0.58 0.20 0.37 0.00 0.00 175.52 176.20 2yuj s ASN 134 N -4.86 4.78 0.39 4.18 0.02 -1.26 -4.93 114.94 113.26 2yuj s ASN 134 Ca -0.15 -3.86 0.09 0.00 -1.02 0.00 0.00 52.86 47.92 2yuj s ASN 134 Cb 0.04 -1.62 0.87 0.00 0.02 0.00 0.00 41.25 40.56 2yuj s ASN 134 CO 0.63 -0.08 1.97 -0.65 0.02 0.00 0.00 177.10 178.99 2yuj h PRO 135 N 5.38 0.58 -0.41 -0.60 0.11 -1.83 -1.22 132.00 134.00 2yuj h PRO 135 Ca 0.15 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.23 2yuj h PRO 135 Cb 0.75 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.71 2yuj h PRO 135 CO 0.71 0.39 0.25 -0.22 -0.21 0.00 0.00 178.00 178.92 2yuj h LYS 136 N 0.60 0.54 -0.31 1.05 3.64 -1.95 0.94 116.57 121.07 2yuj h LYS 136 Ca 0.29 -0.04 -0.17 0.00 -1.27 0.00 0.00 60.65 59.47 2yuj h LYS 136 Cb 0.36 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.06 2yuj h LYS 136 CO -0.09 0.37 -0.47 0.00 -2.27 0.00 0.00 179.45 176.99 2yuj h ALA 137 N 1.73 0.58 -0.00 5.00 0.00 -1.65 -1.22 119.26 123.70 2yuj h ALA 137 Ca 0.15 -0.48 -0.17 0.00 0.00 0.00 0.00 54.91 54.40 2yuj h ALA 137 Cb -0.04 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2yuj h ALA 137 CO -0.03 0.68 -0.79 0.28 0.00 0.00 0.00 179.25 179.39 2yuj h VAL 138 N 0.66 1.53 0.00 0.00 2.07 -1.27 -2.03 116.25 117.21 2yuj h VAL 138 Ca 0.04 -2.60 -0.18 0.00 0.82 0.00 0.00 66.70 64.77 2yuj h VAL 138 Cb 1.05 2.41 -0.02 0.00 -1.52 0.00 0.00 31.29 33.22 2yuj h VAL 138 CO 0.11 0.75 -0.86 0.25 0.02 0.00 0.00 177.57 177.84 2yuj h LEU 139 N 0.04 0.07 0.04 2.57 5.85 -0.78 -2.98 115.31 120.12 2yuj h LEU 139 Ca -0.02 -0.06 -0.24 0.00 0.84 0.00 0.00 57.88 58.41 2yuj h LEU 139 Cb 1.39 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.38 2yuj h LEU 139 CO 0.11 0.89 -1.13 -0.33 -0.34 0.00 0.00 178.44 177.64 2yuj h GLU 140 N 0.03 0.09 -0.08 1.25 4.39 -1.20 -2.73 114.58 116.32 2yuj h GLU 140 Ca -0.02 -0.15 -0.11 0.00 0.34 0.00 0.00 59.36 59.42 2yuj h GLU 140 Cb 1.50 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 30.19 2yuj h GLU 140 CO 0.12 1.04 -0.46 -0.91 -1.16 0.00 0.00 179.01 177.64 2yuj h ASN 141 N 0.02 0.20 0.69 1.42 2.35 -1.39 -3.06 115.58 115.82 2yuj h ASN 141 Ca -0.07 -0.09 -0.26 0.00 -0.55 0.00 0.00 56.30 55.33 2yuj h ASN 141 Cb 1.85 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 40.15 2yuj h ASN 141 CO 0.15 0.64 -1.25 0.00 -1.65 0.00 0.00 177.43 175.32 2yuj h ALA 142 N 1.37 0.23 -0.01 -0.83 0.00 -1.58 -3.27 119.26 115.17 2yuj h ALA 142 Ca 0.01 -0.96 0.00 0.00 0.00 0.00 0.00 54.91 53.96 2yuj h ALA 142 Cb 0.88 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 2yuj h ALA 142 CO 0.07 1.11 0.01 -0.07 0.00 0.00 0.00 179.25 180.37 2yuj h LEU 143 N 0.05 0.00 -1.70 0.00 3.38 -1.39 -1.47 115.31 114.19 2yuj h LEU 143 Ca -0.13 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.89 2yuj h LEU 143 Cb 1.93 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.65 2yuj h LEU 143 CO 0.17 0.00 0.29 0.03 0.09 0.00 0.00 178.44 179.02 2yuj h ARG 144 N 0.00 0.37 0.03 1.13 3.08 -1.59 -1.34 114.38 116.05 2yuj h ARG 144 Ca 0.01 -0.02 -0.22 0.00 0.07 0.00 0.00 59.98 59.81 2yuj h ARG 144 Cb 0.02 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 2yuj h ARG 144 CO -0.00 0.24 -1.03 -0.91 -1.07 0.00 0.00 179.97 177.20 2yuj h ASN 145 N 0.38 0.10 -3.97 7.04 2.35 -1.46 -3.46 115.58 116.56 2yuj h ASN 145 Ca 0.18 -0.10 -0.50 0.00 -0.55 0.00 0.00 56.30 55.33 2yuj h ASN 145 Cb 0.24 -0.03 0.05 0.00 0.05 0.00 0.00 38.32 38.63 2yuj h ASN 145 CO -0.04 1.06 0.47 -0.36 -1.65 0.00 0.00 177.43 176.91 2yuj s PHE 146 N -2.76 3.03 -0.09 1.19 0.40 -0.51 -3.70 117.98 115.55 2yuj s PHE 146 Ca -0.00 1.57 0.11 0.00 -0.60 0.00 0.00 56.93 58.00 2yuj s PHE 146 Cb 0.09 -3.32 -0.16 0.00 0.51 0.00 0.00 43.02 40.14 2yuj s PHE 146 CO 0.83 -1.24 0.10 0.00 0.70 0.00 0.00 175.22 175.62 2yuj n ALA 147 N -0.21 1.92 -2.37 5.36 0.00 -1.26 -4.72 120.51 119.23 2yuj n ALA 147 Ca 0.06 -0.64 -0.13 0.00 0.00 0.00 0.00 53.44 52.73 2yuj n ALA 147 Cb 0.48 -0.11 -0.09 0.00 0.00 0.00 0.00 19.45 19.73 2yuj n ALA 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yuj s LEU 149 N -3.17 -0.26 0.10 0.00 1.43 -0.11 -4.82 118.68 111.84 2yuj s LEU 149 Ca 0.37 1.14 0.08 0.00 -1.03 0.00 0.00 54.13 54.69 2yuj s LEU 149 Cb 0.05 1.87 -0.03 0.00 0.03 0.00 0.00 46.19 48.11 2yuj s LEU 149 CO 0.14 -0.20 -0.21 -0.89 0.23 0.00 0.00 176.35 175.42 2yuj s THR 150 N 0.76 1.69 -0.60 5.49 2.01 -1.26 -1.02 115.64 122.72 2yuj s THR 150 Ca -0.04 -1.52 -0.27 0.00 0.31 0.00 0.00 61.69 60.17 2yuj s THR 150 Cb -0.05 -1.54 -0.02 0.00 0.01 0.00 0.00 72.50 70.90 2yuj s THR 150 CO -0.06 -0.05 1.89 -0.89 -0.69 0.00 0.00 174.62 174.81 2yuj s THR 151 N -1.15 3.34 0.00 -0.82 2.01 -1.09 -2.39 115.64 115.54 2yuj s THR 151 Ca 0.06 0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.27 2yuj s THR 151 Cb -0.10 -3.88 0.00 0.00 0.01 0.00 0.00 72.50 68.53 2yuj s THR 151 CO 0.04 -0.85 0.00 0.61 -0.69 0.00 0.00 174.62 173.73 2yuj n GLY 152 N 5.70 1.91 3.34 4.40 0.00 -1.24 -5.02 105.19 114.28 2yuj n GLY 152 Ca 0.21 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.77 2yuj n GLY 152 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yuj s ASP 153 N -2.00 6.75 -0.51 1.61 1.11 -1.01 -4.94 116.67 117.68 2yuj s ASP 153 Ca 0.00 -2.62 -0.26 0.00 0.18 0.00 0.00 52.55 49.84 2yuj s ASP 153 Cb 0.00 -2.23 -0.05 0.00 1.07 0.00 0.00 42.92 41.71 2yuj s ASP 153 CO 0.00 -0.62 2.22 -0.69 1.18 0.00 0.00 175.17 177.25 2yuj s VAL 154 N 0.43 3.13 0.29 -1.27 1.01 -1.26 -4.14 120.40 118.58 2yuj s VAL 154 Ca 0.19 0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.33 2yuj s VAL 154 Cb -0.10 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 2yuj s VAL 154 CO -0.09 -0.30 0.13 0.27 0.00 0.00 0.00 175.10 175.11 2yuj s ILE 155 N 10.96 3.65 -0.33 2.22 -4.36 -0.65 -4.68 121.20 128.02 2yuj s ILE 155 Ca 0.88 -1.63 0.01 0.00 -0.26 0.00 0.00 60.65 59.65 2yuj s ILE 155 Cb -0.16 -3.09 0.10 0.00 1.25 0.00 0.00 42.46 40.56 2yuj s ILE 155 CO 0.25 -0.29 0.09 0.00 0.24 0.00 0.00 174.94 175.23 2yuj s ALA 156 N -2.29 2.09 0.55 2.27 0.00 -1.26 -2.08 121.76 121.04 2yuj s ALA 156 Ca 0.35 -2.06 -0.19 0.00 0.00 0.00 0.00 51.96 50.06 2yuj s ALA 156 Cb -0.06 -1.77 -0.06 0.00 0.00 0.00 0.00 23.12 21.24 2yuj s ALA 156 CO 0.23 -1.70 1.13 0.96 0.00 0.00 0.00 175.76 176.39 2yuj s ILE 157 N 1.27 3.13 -0.04 0.00 -4.36 -0.97 -4.76 121.20 115.47 2yuj s ILE 157 Ca 0.11 0.70 -0.28 0.00 -0.26 0.00 0.00 60.65 60.91 2yuj s ILE 157 Cb -0.18 -3.28 0.06 0.00 1.25 0.00 0.00 42.46 40.31 2yuj s ILE 157 CO -0.17 -0.15 0.62 0.21 0.24 0.00 0.00 174.94 175.68 2yuj s ASN 158 N -1.77 -0.58 0.00 4.36 2.47 -1.26 -0.85 114.94 117.31 2yuj s ASN 158 Ca 0.73 0.60 0.00 0.00 0.42 0.00 0.00 52.86 54.61 2yuj s ASN 158 Cb -0.24 0.51 0.00 0.00 -1.45 0.00 0.00 41.25 40.06 2yuj s ASN 158 CO 0.28 -0.59 0.00 0.00 -3.72 0.00 0.00 177.10 173.06 2yuj n TYR 159 N 0.93 0.00 -1.43 0.43 4.11 -1.26 -4.88 117.16 115.06 2yuj n TYR 159 Ca -0.19 0.00 -0.32 0.00 -0.00 0.00 0.00 57.90 57.39 2yuj n TYR 159 Cb 0.57 0.00 0.08 0.00 -0.00 0.00 0.00 39.34 39.99 2yuj n TYR 159 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 176.86 177.13 2yuj n ASN 160 N -0.49 6.83 -2.29 9.48 0.23 -1.26 -4.85 115.26 122.90 2yuj n ASN 160 Ca 0.00 -3.77 -0.20 0.00 -0.53 0.00 0.00 54.58 50.08 2yuj n ASN 160 Cb 0.00 -0.86 -0.01 0.00 -2.08 0.00 0.00 39.78 36.83 2yuj n ASN 160 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 2yuj n GLU 161 N -0.91 -1.61 -3.47 -3.83 1.02 -1.26 -4.96 120.64 105.62 2yuj n GLU 161 Ca 0.59 0.98 -0.18 0.00 -0.02 0.00 0.00 57.16 58.53 2yuj n GLU 161 Cb 0.80 -5.60 -0.12 0.00 -0.02 0.00 0.00 31.44 26.50 2yuj n GLU 161 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2yuj s LYS 162 N -5.00 0.22 -0.41 3.49 1.02 -1.26 -5.12 119.74 112.69 2yuj s LYS 162 Ca 0.00 0.17 -0.27 0.00 0.02 0.00 0.00 55.97 55.89 2yuj s LYS 162 Cb 0.00 -1.07 0.02 0.00 -0.52 0.00 0.00 37.83 36.26 2yuj s LYS 162 CO 0.00 -0.72 1.01 0.42 -0.92 0.00 0.00 175.35 175.14 2yuj s ILE 163 N 2.35 4.45 -0.12 2.17 1.09 -1.26 -4.38 121.20 125.50 2yuj s ILE 163 Ca 0.08 1.22 -0.15 0.00 -1.10 0.00 0.00 60.65 60.69 2yuj s ILE 163 Cb -0.15 -4.44 -0.05 0.00 -1.06 0.00 0.00 42.46 36.76 2yuj s ILE 163 CO -0.16 -0.70 0.38 -0.31 -0.10 0.00 0.00 174.94 174.04 2yuj s TYR 164 N 3.81 3.52 -0.53 3.97 1.51 -0.03 -4.93 117.35 124.68 2yuj s TYR 164 Ca 0.42 0.77 -0.26 0.00 -1.01 0.00 0.00 57.07 56.98 2yuj s TYR 164 Cb -0.10 -2.41 0.03 0.00 -0.11 0.00 0.00 41.96 39.37 2yuj s TYR 164 CO 0.23 0.28 1.03 -1.21 -1.11 0.00 0.00 175.55 174.77 2yuj s GLU 165 N 0.26 3.47 -0.03 -0.62 0.41 -1.26 -2.28 118.70 118.65 2yuj s GLU 165 Ca 0.21 0.07 0.04 0.00 -0.41 0.00 0.00 54.97 54.88 2yuj s GLU 165 Cb -0.14 -4.00 -0.00 0.00 -1.78 0.00 0.00 34.13 28.21 2yuj s GLU 165 CO 0.08 -1.47 -0.14 -0.51 -0.49 0.00 0.00 175.26 172.73 2yuj s LEU 166 N 4.25 1.89 -0.05 1.80 1.43 -0.88 -2.59 118.68 124.54 2yuj s LEU 166 Ca 0.37 -0.28 0.02 0.00 -1.03 0.00 0.00 54.13 53.22 2yuj s LEU 166 Cb -0.10 -0.78 0.01 0.00 0.03 0.00 0.00 46.19 45.35 2yuj s LEU 166 CO 0.24 0.13 -0.10 -0.60 0.23 0.00 0.00 176.35 176.25 2yuj s ARG 167 N 0.02 1.33 0.64 1.70 3.52 -1.25 -1.63 118.95 123.28 2yuj s ARG 167 Ca -0.02 -0.34 -0.16 0.00 -0.13 0.00 0.00 55.73 55.09 2yuj s ARG 167 Cb -0.09 -1.17 -0.01 0.00 -1.56 0.00 0.00 34.95 32.12 2yuj s ARG 167 CO 0.01 0.04 1.11 0.08 -0.81 0.00 0.00 175.30 175.73 2yuj s VAL 168 N 0.54 3.28 0.09 7.11 1.01 -1.26 -1.68 120.40 129.50 2yuj s VAL 168 Ca -0.10 0.62 0.00 0.00 0.00 0.00 0.00 61.98 62.50 2yuj s VAL 168 Cb -0.13 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.10 2yuj s VAL 168 CO 0.02 -0.35 0.00 0.23 0.00 0.00 0.00 175.10 175.00 2yuj n MET 169 N -2.25 0.00 -4.88 2.72 2.81 -0.70 -3.71 117.12 111.11 2yuj n MET 169 Ca 0.10 0.00 -0.26 0.00 -1.81 0.00 0.00 57.70 55.73 2yuj n MET 169 Cb 0.52 -0.47 -0.15 0.00 -0.71 0.00 0.00 33.22 32.41 2yuj n MET 169 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2yuj s GLU 170 N -2.00 1.56 -0.01 0.03 2.02 -1.19 -4.66 118.70 114.45 2yuj s GLU 170 Ca 0.00 -0.79 -0.08 0.00 0.02 0.00 0.00 54.97 54.12 2yuj s GLU 170 Cb 0.00 -1.56 0.01 0.00 0.10 0.00 0.00 34.13 32.68 2yuj s GLU 170 CO 0.00 0.42 0.16 0.95 0.02 0.00 0.00 175.26 176.81 2yuj s THR 171 N -0.57 0.07 0.11 3.63 -4.23 -1.25 -0.10 115.64 113.28 2yuj s THR 171 Ca 0.08 -0.56 0.03 0.00 -1.18 0.00 0.00 61.69 60.06 2yuj s THR 171 Cb -0.08 -0.42 -0.04 0.00 1.34 0.00 0.00 72.50 73.30 2yuj s THR 171 CO 0.00 -0.31 -0.09 -0.54 -0.54 0.00 0.00 174.62 173.15 2yuj s LYS 172 N -1.14 0.88 0.04 3.99 1.02 -0.58 -4.49 119.74 119.47 2yuj s LYS 172 Ca -0.12 -1.28 -0.16 0.00 0.02 0.00 0.00 55.97 54.43 2yuj s LYS 172 Cb -0.06 -0.41 -0.24 0.00 -0.52 0.00 0.00 37.83 36.59 2yuj s LYS 172 CO 0.02 0.04 1.14 -1.00 -0.92 0.00 0.00 175.35 174.62 2yuj h PRO 173 N 3.19 0.58 -6.55 -1.68 0.13 -1.90 -2.90 132.00 122.88 2yuj h PRO 173 Ca -0.36 -0.65 -0.50 0.00 -0.87 0.00 0.00 66.00 63.62 2yuj h PRO 173 Cb 1.18 0.19 0.02 0.00 0.13 0.00 0.00 31.00 32.52 2yuj h PRO 173 CO 0.59 1.25 -0.13 -0.51 -0.23 0.00 0.00 178.00 178.98 2yuj s ASP 174 N -7.11 5.04 0.15 1.44 1.11 -1.26 -5.02 116.67 111.02 2yuj s ASP 174 Ca -0.11 -0.90 -0.17 0.00 0.18 0.00 0.00 52.55 51.55 2yuj s ASP 174 Cb 0.05 0.30 0.04 0.00 1.07 0.00 0.00 42.92 44.39 2yuj s ASP 174 CO 0.89 -1.30 1.76 0.07 1.18 0.00 0.00 175.17 177.76 2yuj h LYS 175 N 0.26 0.29 -5.30 8.23 2.10 -1.93 -3.41 116.57 116.82 2yuj h LYS 175 Ca -0.31 -0.02 -0.60 0.00 -2.00 0.00 0.00 60.65 57.73 2yuj h LYS 175 Cb 1.29 -0.07 -0.12 0.00 -0.90 0.00 0.00 32.23 32.44 2yuj h LYS 175 CO 0.43 0.19 -0.45 0.00 -2.00 0.00 0.00 179.45 177.62 2yuj s ALA 176 N -6.16 3.66 -0.02 0.07 0.00 -1.26 -2.69 121.76 115.36 2yuj s ALA 176 Ca -0.13 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.20 2yuj s ALA 176 Cb 0.11 -2.24 0.00 0.00 0.00 0.00 0.00 23.12 21.00 2yuj s ALA 176 CO 0.71 0.10 -0.09 0.14 0.00 0.00 0.00 175.76 176.63 2yuj s VAL 177 N 0.47 0.75 -0.70 0.00 -7.23 -0.19 -4.72 120.40 108.77 2yuj s VAL 177 Ca 0.10 -0.34 -0.19 0.00 -1.81 0.00 0.00 61.98 59.74 2yuj s VAL 177 Cb -0.12 -0.67 0.12 0.00 0.56 0.00 0.00 36.38 36.27 2yuj s VAL 177 CO -0.00 0.24 0.84 -0.55 -0.31 0.00 0.00 175.10 175.32 2yuj s SER 178 N 0.19 6.33 -1.15 4.85 0.15 0.84 -0.93 113.70 123.99 2yuj s SER 178 Ca -0.03 -1.62 -0.16 0.00 0.70 0.00 0.00 55.95 54.85 2yuj s SER 178 Cb -0.08 -2.33 0.15 0.00 -1.71 0.00 0.00 66.02 62.04 2yuj s SER 178 CO 0.00 -1.11 1.40 0.27 1.20 0.00 0.00 173.24 175.01 2yuj s ILE 179 N 2.67 4.83 -0.89 6.45 -4.36 0.59 -3.42 121.20 127.06 2yuj s ILE 179 Ca 0.18 -2.26 -0.02 0.00 -0.26 0.00 0.00 60.65 58.29 2yuj s ILE 179 Cb -0.17 -4.92 0.22 0.00 1.25 0.00 0.00 42.46 38.84 2yuj s ILE 179 CO 0.02 -1.65 0.78 -0.63 0.24 0.00 0.00 174.94 173.70 2yuj s ILE 180 N 2.23 4.45 -0.32 8.37 1.01 -1.26 -4.26 121.20 131.42 2yuj s ILE 180 Ca 0.42 -3.78 -0.02 0.00 0.00 0.00 0.00 60.65 57.28 2yuj s ILE 180 Cb -0.02 -3.76 0.00 0.00 0.01 0.00 0.00 42.46 38.69 2yuj s ILE 180 CO -0.02 -1.08 0.06 1.21 0.00 0.00 0.00 174.94 175.11 2yuj n GLU 181 N 2.43 -3.38 -3.68 2.79 0.00 -1.26 -5.07 120.64 112.47 2yuj n GLU 181 Ca 0.21 2.72 -0.07 0.00 0.00 0.00 0.00 57.16 60.02 2yuj n GLU 181 Cb 0.37 -5.39 -0.02 0.00 0.00 0.00 0.00 31.44 26.41 2yuj n GLU 181 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2yuj s ASP 183 N -2.82 5.06 0.28 0.00 -1.08 -1.26 -5.09 116.67 111.77 2yuj s ASP 183 Ca 0.08 -0.19 0.02 0.00 -0.52 0.00 0.00 52.55 51.94 2yuj s ASP 183 Cb -0.03 -1.90 -0.04 0.00 -1.46 0.00 0.00 42.92 39.49 2yuj s ASP 183 CO -0.01 0.00 0.12 0.00 0.52 0.00 0.00 175.17 175.80 2yuj s MET 184 N 1.39 1.51 -0.39 4.34 0.23 -1.26 -4.95 119.30 120.17 2yuj s MET 184 Ca 0.05 -1.84 -0.16 0.00 -1.03 0.00 0.00 55.69 52.71 2yuj s MET 184 Cb -0.15 -0.22 0.01 0.00 -1.53 0.00 0.00 34.83 32.94 2yuj s MET 184 CO 0.03 -0.36 0.36 1.21 -2.03 0.00 0.00 175.02 174.22 2yuj s ASN 185 N -3.35 6.15 -0.14 -1.18 2.47 0.77 -5.01 114.94 114.65 2yuj s ASN 185 Ca 0.36 -0.61 -0.14 0.00 0.42 0.00 0.00 52.86 52.90 2yuj s ASN 185 Cb 0.06 -2.19 -0.05 0.00 -1.45 0.00 0.00 41.25 37.63 2yuj s ASN 185 CO 0.15 -0.45 0.30 -0.69 -3.72 0.00 0.00 177.10 172.69 2yuj s VAL 186 N 1.93 5.29 0.37 -5.21 1.01 -1.26 -2.57 120.40 119.96 2yuj s VAL 186 Ca 0.09 0.57 0.08 0.00 0.00 0.00 0.00 61.98 62.72 2yuj s VAL 186 Cb -0.18 -3.63 -0.05 0.00 0.00 0.00 0.00 36.38 32.52 2yuj s VAL 186 CO 0.12 0.42 0.10 -0.62 0.00 0.00 0.00 175.10 175.12 2yuj s ASP 187 N 0.21 4.33 0.00 3.32 2.15 -1.06 -4.99 116.67 120.64 2yuj s ASP 187 Ca 0.17 -1.02 0.05 0.00 0.43 0.00 0.00 52.55 52.19 2yuj s ASP 187 Cb -0.13 -0.53 -0.02 0.00 -0.30 0.00 0.00 42.92 41.94 2yuj s ASP 187 CO 0.05 -0.38 -0.17 -0.36 -0.17 0.00 0.00 175.17 174.14 2yuj s PHE 188 N -2.55 1.48 -0.64 -5.34 0.08 -1.26 -2.76 117.98 106.99 2yuj s PHE 188 Ca 0.38 -0.30 0.05 0.00 0.12 0.00 0.00 56.93 57.17 2yuj s PHE 188 Cb 0.02 -0.93 0.16 0.00 -0.57 0.00 0.00 43.02 41.70 2yuj s PHE 188 CO 0.21 0.00 0.44 0.34 -0.10 0.00 0.00 175.22 176.11 2yuj s ASP 189 N -0.63 4.37 0.00 1.36 -1.08 -1.06 -4.97 116.67 114.66 2yuj s ASP 189 Ca 0.06 -3.62 0.00 0.00 -0.52 0.00 0.00 52.55 48.46 2yuj s ASP 189 Cb -0.07 -1.49 0.00 0.00 -1.46 0.00 0.00 42.92 39.90 2yuj s ASP 189 CO 0.00 -0.12 0.00 0.00 0.52 0.00 0.00 175.17 175.57