#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 -8.67 -3.53 1.61 2.88 -1.26 -4.82 113.62 99.83 2yuj n SER 2 Ca 0.00 0.85 -0.29 0.00 -1.33 0.00 0.00 58.87 58.10 2yuj n SER 2 Cb 0.00 -4.56 -0.12 0.00 -0.75 0.00 0.00 64.21 58.77 2yuj n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yuj s SER 3 N -7.21 3.17 0.00 -3.46 0.15 -1.26 -5.10 113.70 99.98 2yuj s SER 3 Ca 0.00 -2.23 0.00 0.00 0.70 0.00 0.00 55.95 54.42 2yuj s SER 3 Cb 0.00 -0.55 0.00 0.00 -1.71 0.00 0.00 66.02 63.76 2yuj s SER 3 CO 0.00 -0.31 0.00 0.61 1.20 0.00 0.00 173.24 174.74 2yuj n GLY 4 N 4.00 1.68 3.20 9.45 0.00 -1.26 -5.09 105.19 117.16 2yuj n GLY 4 Ca 0.10 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.92 2yuj n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yuj s SER 5 N 0.65 6.15 -0.10 1.61 0.15 -1.26 -4.77 113.70 116.12 2yuj s SER 5 Ca 0.00 -3.10 0.08 0.00 0.70 0.00 0.00 55.95 53.63 2yuj s SER 5 Cb 0.00 -2.02 -0.12 0.00 -1.71 0.00 0.00 66.02 62.17 2yuj s SER 5 CO 0.00 -0.38 0.02 -1.20 1.20 0.00 0.00 173.24 172.88 2yuj n SER 6 N 3.27 2.54 -3.94 5.45 7.64 -1.26 -5.03 113.62 122.29 2yuj n SER 6 Ca 0.15 -0.01 -0.30 0.00 1.01 0.00 0.00 58.87 59.72 2yuj n SER 6 Cb 0.41 0.63 0.22 0.00 -1.01 0.00 0.00 64.21 64.46 2yuj n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yuj s GLY 7 N -4.38 1.61 0.78 0.23 0.00 -1.26 -5.01 107.32 99.29 2yuj s GLY 7 Ca -0.07 -0.95 -0.11 0.00 0.00 0.00 0.00 44.72 43.59 2yuj s GLY 7 CO 0.40 -0.11 1.12 -0.26 0.00 0.00 0.00 173.10 174.25 2yuj s ILE 8 N -3.16 2.95 0.42 0.90 -5.25 -1.26 -4.94 121.20 110.86 2yuj s ILE 8 Ca 0.71 0.34 -0.24 0.00 -0.99 0.00 0.00 60.65 60.47 2yuj s ILE 8 Cb -0.09 -2.73 -0.11 0.00 2.95 0.00 0.00 42.46 42.48 2yuj s ILE 8 CO 0.55 -0.37 0.95 -2.65 -1.79 0.00 0.00 174.94 171.64 2yuj n PRO 9 N -3.45 1.24 -3.77 0.37 -0.02 -1.26 -5.02 135.00 123.10 2yuj n PRO 9 Ca 0.10 0.45 -0.13 0.00 -2.02 0.00 0.00 63.50 61.90 2yuj n PRO 9 Cb 0.52 -1.98 -0.10 0.00 -0.02 0.00 0.00 33.50 31.93 2yuj n PRO 9 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2yuj s ARG 10 N -1.98 0.55 -0.32 -0.52 0.52 -1.26 -5.07 118.95 110.86 2yuj s ARG 10 Ca 0.64 0.06 0.17 0.00 -0.52 0.00 0.00 55.73 56.08 2yuj s ARG 10 Cb -0.56 0.25 0.46 0.00 0.52 0.00 0.00 34.95 35.61 2yuj s ARG 10 CO 0.57 -0.13 1.05 1.33 0.02 0.00 0.00 175.30 178.14 2yuj n VAL 11 N 1.93 0.86 -2.74 3.52 0.24 -1.26 -5.03 118.33 115.85 2yuj n VAL 11 Ca -0.18 -2.74 -0.06 0.00 -2.04 0.00 0.00 64.34 59.32 2yuj n VAL 11 Cb 0.57 0.83 0.01 0.00 -1.47 0.00 0.00 33.84 33.77 2yuj n VAL 11 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 2yuj n PHE 12 N -0.27 -3.41 0.00 6.34 3.72 -1.26 -5.01 117.46 117.57 2yuj n PHE 12 Ca 0.06 1.41 0.00 0.00 -0.05 0.00 0.00 57.45 58.87 2yuj n PHE 12 Cb 0.82 -3.92 0.00 0.00 -0.94 0.00 0.00 39.48 35.44 2yuj n PHE 12 CO 0.00 0.00 0.00 0.94 -0.05 0.00 0.00 176.76 177.65 2yuj n GLN 13 N -0.07 0.00 -2.58 -1.08 7.27 -1.26 -5.13 117.38 114.53 2yuj n GLN 13 Ca 0.08 0.00 -0.06 0.00 0.07 0.00 0.00 57.00 57.10 2yuj n GLN 13 Cb 0.32 -0.18 -0.05 0.00 2.41 0.00 0.00 30.24 32.74 2yuj n GLN 13 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2yuj n ASN 14 N -2.23 -0.52 -3.41 1.69 5.03 -1.26 -5.05 115.26 109.50 2yuj n ASN 14 Ca 0.00 1.33 -0.13 0.00 0.87 0.00 0.00 54.58 56.65 2yuj n ASN 14 Cb 0.03 -5.21 -0.10 0.00 -1.02 0.00 0.00 39.78 33.48 2yuj n ASN 14 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2yuj s ARG 15 N -0.71 0.28 0.08 3.52 0.52 -1.26 -5.09 118.95 116.28 2yuj s ARG 15 Ca -0.28 0.38 -0.31 0.00 -0.52 0.00 0.00 55.73 55.00 2yuj s ARG 15 Cb 0.02 -0.80 -0.10 0.00 0.52 0.00 0.00 34.95 34.59 2yuj s ARG 15 CO 0.79 -0.66 1.91 0.34 0.02 0.00 0.00 175.30 177.71 2yuj n PHE 16 N 5.34 2.57 -3.61 -0.53 7.35 -1.26 -4.91 117.46 122.42 2yuj n PHE 16 Ca -0.04 -0.27 -0.18 0.00 -0.76 0.00 0.00 57.45 56.19 2yuj n PHE 16 Cb 0.50 -2.77 -0.15 0.00 0.35 0.00 0.00 39.48 37.40 2yuj n PHE 16 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 2yuj s SER 17 N 3.64 1.13 -0.18 -2.13 1.04 -1.25 -2.75 113.70 113.21 2yuj s SER 17 Ca 0.86 0.06 -0.35 0.00 0.48 0.00 0.00 55.95 56.99 2yuj s SER 17 Cb -0.45 0.23 0.14 0.00 0.10 0.00 0.00 66.02 66.04 2yuj s SER 17 CO 0.40 -0.28 1.27 0.28 0.98 0.00 0.00 173.24 175.89 2yuj s THR 18 N 2.28 0.00 0.17 2.02 -1.32 -1.12 -5.00 115.64 112.67 2yuj s THR 18 Ca 0.04 -0.04 -0.05 0.00 -1.21 0.00 0.00 61.69 60.43 2yuj s THR 18 Cb -0.14 -1.21 -0.06 0.00 -1.51 0.00 0.00 72.50 69.58 2yuj s THR 18 CO -0.08 0.00 0.41 -1.10 -2.21 0.00 0.00 174.62 171.65 2yuj s GLN 19 N -2.32 3.65 -0.04 7.08 -0.21 -1.26 -0.92 119.66 125.64 2yuj s GLN 19 Ca 0.11 -0.03 -0.03 0.00 0.02 0.00 0.00 55.36 55.43 2yuj s GLN 19 Cb 0.00 -2.80 0.01 0.00 1.00 0.00 0.00 33.01 31.23 2yuj s GLN 19 CO -0.04 0.43 0.09 0.71 -2.12 0.00 0.00 175.29 174.36 2yuj s TYR 20 N -1.71 -0.10 -0.26 0.91 2.02 -1.21 -4.89 117.35 112.11 2yuj s TYR 20 Ca 0.42 0.27 -0.29 0.00 -0.37 0.00 0.00 57.07 57.10 2yuj s TYR 20 Cb -0.12 -0.00 -0.01 0.00 -0.40 0.00 0.00 41.96 41.43 2yuj s TYR 20 CO 0.24 -0.07 1.45 1.03 -1.57 0.00 0.00 175.55 176.64 2yuj s ARG 21 N 0.28 3.86 0.07 -0.62 0.52 -1.25 -2.75 118.95 119.06 2yuj s ARG 21 Ca -0.02 1.45 -0.24 0.00 -0.52 0.00 0.00 55.73 56.40 2yuj s ARG 21 Cb -0.03 -3.95 -0.06 0.00 0.52 0.00 0.00 34.95 31.43 2yuj s ARG 21 CO -0.01 -1.19 0.74 0.00 0.02 0.00 0.00 175.30 174.85 2yuj s PHE 23 N -0.39 1.29 0.31 0.00 0.08 0.10 0.88 117.98 120.25 2yuj s PHE 23 Ca 0.36 -1.37 -0.21 0.00 0.12 0.00 0.00 56.93 55.83 2yuj s PHE 23 Cb -0.21 -0.64 -0.09 0.00 -0.57 0.00 0.00 43.02 41.51 2yuj s PHE 23 CO 0.23 -0.61 0.84 0.45 -0.10 0.00 0.00 175.22 176.02 2yuj s SER 24 N -3.21 7.07 0.51 1.36 0.15 -1.26 -1.18 113.70 117.14 2yuj s SER 24 Ca 0.39 1.57 0.24 0.00 0.70 0.00 0.00 55.95 58.85 2yuj s SER 24 Cb 0.07 -2.48 1.39 0.00 -1.71 0.00 0.00 66.02 63.29 2yuj s SER 24 CO 0.14 -0.12 2.09 -0.37 1.20 0.00 0.00 173.24 176.18 2yuj h VAL 25 N 2.40 0.73 -0.35 4.45 -1.51 -1.89 -2.24 116.25 117.83 2yuj h VAL 25 Ca -0.48 -0.45 0.10 0.00 -1.23 0.00 0.00 66.70 64.65 2yuj h VAL 25 Cb 1.19 1.27 -0.01 0.00 -2.13 0.00 0.00 31.29 31.60 2yuj h VAL 25 CO 0.64 0.11 0.28 -1.28 -1.23 0.00 0.00 177.57 176.10 2yuj h SER 26 N 0.00 0.00 -0.14 4.19 0.87 -1.92 0.23 113.55 116.78 2yuj h SER 26 Ca -0.00 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.60 2yuj h SER 26 Cb 0.26 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 2yuj h SER 26 CO 0.01 0.00 0.13 0.24 -0.53 0.00 0.00 176.83 176.68 2yuj h MET 27 N 0.00 0.00 -0.67 2.24 2.07 -1.80 -1.21 114.93 115.55 2yuj h MET 27 Ca 0.17 0.00 0.07 0.00 -2.07 0.00 0.00 59.70 57.87 2yuj h MET 27 Cb 0.73 0.00 -0.04 0.00 -1.87 0.00 0.00 31.60 30.42 2yuj h MET 27 CO -0.00 0.00 0.45 1.25 1.07 0.00 0.00 176.91 179.67 2yuj h LEU 28 N 0.00 0.58 0.00 1.22 5.85 -1.14 -3.48 115.31 118.34 2yuj h LEU 28 Ca 0.07 0.00 0.35 0.00 0.84 0.00 0.00 57.88 59.14 2yuj h LEU 28 Cb 0.33 -0.12 -0.09 0.00 0.37 0.00 0.00 40.66 41.15 2yuj h LEU 28 CO -0.00 0.37 -0.46 0.00 -0.34 0.00 0.00 178.44 178.01 2yuj n ALA 29 N -2.47 -3.34 0.00 1.25 0.00 -0.46 -5.07 120.51 110.42 2yuj n ALA 29 Ca 0.10 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.94 2yuj n ALA 29 Cb 0.25 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.56 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 -3.73 4.67 0.27 0.00 0.00 -1.26 -4.96 105.19 100.18 2yuj n GLY 30 Ca 0.01 -1.20 0.03 0.00 0.00 0.00 0.00 46.02 44.86 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 0.50 0.00 1.61 0.11 -2.05 -3.43 132.00 128.75 2yuj h PRO 31 Ca 0.00 -0.03 -0.38 0.00 0.11 0.00 0.00 66.00 65.70 2yuj h PRO 31 Cb 0.00 -0.11 0.04 0.00 0.11 0.00 0.00 31.00 31.04 2yuj h PRO 31 CO 0.00 0.33 0.00 0.09 -0.21 0.00 0.00 178.00 178.21 2yuj n ASN 32 N -4.93 1.48 -4.20 -2.05 3.02 -1.26 -5.14 115.26 102.17 2yuj n ASN 32 Ca 0.12 -2.12 -0.12 0.00 -0.03 0.00 0.00 54.58 52.43 2yuj n ASN 32 Cb 0.34 -0.41 -0.10 0.00 -0.61 0.00 0.00 39.78 39.00 2yuj n ASN 32 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2yuj s ASP 33 N -4.05 1.12 0.08 6.41 1.11 -1.26 -5.04 116.67 115.05 2yuj s ASP 33 Ca 0.51 -1.10 0.05 0.00 0.18 0.00 0.00 52.55 52.20 2yuj s ASP 33 Cb -0.04 0.12 -0.03 0.00 1.07 0.00 0.00 42.92 44.04 2yuj s ASP 33 CO 0.33 -0.53 -0.15 -0.13 1.18 0.00 0.00 175.17 175.87 2yuj s ARG 34 N -3.88 0.87 -0.05 8.23 1.81 -1.26 -5.05 118.95 119.61 2yuj s ARG 34 Ca 0.18 -1.00 0.01 0.00 -1.72 0.00 0.00 55.73 53.20 2yuj s ARG 34 Cb 0.06 -0.88 -0.04 0.00 -0.45 0.00 0.00 34.95 33.64 2yuj s ARG 34 CO -0.00 0.19 -0.04 -1.13 -0.68 0.00 0.00 175.30 173.64 2yuj n SER 35 N 1.18 3.64 0.25 0.23 3.41 -1.26 -4.63 113.62 116.44 2yuj n SER 35 Ca -0.20 -0.02 0.11 0.00 -0.26 0.00 0.00 58.87 58.49 2yuj n SER 35 Cb 0.54 0.02 0.72 0.00 -0.26 0.00 0.00 64.21 65.23 2yuj n SER 35 CO 0.00 0.00 0.00 -2.24 -0.16 0.00 0.00 175.04 172.64 2yuj h ASP 36 N 0.00 0.00 -0.28 4.04 3.04 -1.97 -0.58 116.42 120.67 2yuj h ASP 36 Ca -0.12 0.00 -0.02 0.00 -3.24 0.00 0.00 57.03 53.65 2yuj h ASP 36 Cb 1.20 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.47 2yuj h ASP 36 CO -0.01 0.00 0.13 0.58 -2.04 0.00 0.00 179.24 177.90 2yuj h VAL 37 N 0.00 1.13 0.02 4.15 2.07 -1.96 -2.83 116.25 118.84 2yuj h VAL 37 Ca 0.02 -0.41 -0.32 0.00 0.82 0.00 0.00 66.70 66.81 2yuj h VAL 37 Cb 0.07 0.74 -0.05 0.00 -1.52 0.00 0.00 31.29 30.53 2yuj h VAL 37 CO -0.00 0.16 -1.87 1.21 0.02 0.00 0.00 177.57 177.09 2yuj n GLU 38 N -4.40 0.66 -2.73 1.57 2.13 -0.49 -4.68 120.64 112.70 2yuj n GLU 38 Ca 0.02 0.25 -0.42 0.00 0.66 0.00 0.00 57.16 57.66 2yuj n GLU 38 Cb 0.14 -1.74 -0.03 0.00 0.27 0.00 0.00 31.44 30.08 2yuj n GLU 38 CO 0.00 0.00 0.00 0.15 -0.41 0.00 0.00 177.13 176.87 2yuj s LYS 39 N -2.58 3.48 0.00 5.31 1.02 -0.35 -4.85 119.74 121.78 2yuj s LYS 39 Ca -0.09 -1.22 0.00 0.00 0.02 0.00 0.00 55.97 54.68 2yuj s LYS 39 Cb 0.08 -4.92 0.00 0.00 -0.52 0.00 0.00 37.83 32.47 2yuj s LYS 39 CO 0.81 -1.99 0.00 0.41 -0.92 0.00 0.00 175.35 173.66 2yuj n GLY 40 N 6.01 3.19 2.47 -3.33 0.00 -1.26 -4.78 105.19 107.49 2yuj n GLY 40 Ca 0.21 -1.82 -0.35 0.00 0.00 0.00 0.00 46.02 44.07 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 -1.72 4.88 3.37 -0.02 0.00 -1.25 -4.92 105.19 105.54 2yuj n GLY 41 Ca 0.00 -1.97 -0.32 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.24 2.88 0.39 1.61 1.02 -1.25 -2.47 119.74 120.67 2yuj s LYS 42 Ca 0.56 -0.75 0.04 0.00 0.02 0.00 0.00 55.97 55.83 2yuj s LYS 42 Cb 0.25 -2.42 -0.04 0.00 -0.52 0.00 0.00 37.83 35.11 2yuj s LYS 42 CO -0.13 0.39 0.10 0.96 -0.92 0.00 0.00 175.35 175.74 2yuj s ILE 43 N -0.13 0.82 -0.14 2.17 -4.36 -0.51 -4.62 121.20 114.44 2yuj s ILE 43 Ca -0.02 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 58.36 2yuj s ILE 43 Cb -0.14 -2.48 0.03 0.00 1.25 0.00 0.00 42.46 41.12 2yuj s ILE 43 CO 0.04 0.00 -0.07 -0.63 0.24 0.00 0.00 174.94 174.52 2yuj s ILE 44 N -3.23 1.10 0.33 8.37 1.09 -1.17 -1.44 121.20 126.25 2yuj s ILE 44 Ca 0.27 -0.49 0.09 0.00 -1.10 0.00 0.00 60.65 59.42 2yuj s ILE 44 Cb 0.05 -1.20 -0.05 0.00 -1.06 0.00 0.00 42.46 40.20 2yuj s ILE 44 CO 0.14 0.25 -0.00 -0.04 -0.10 0.00 0.00 174.94 175.18 2yuj s MET 45 N 1.66 2.08 0.69 2.79 -1.94 -1.24 -1.91 119.30 121.43 2yuj s MET 45 Ca 0.03 -1.71 -0.17 0.00 -1.71 0.00 0.00 55.69 52.13 2yuj s MET 45 Cb -0.14 -1.95 -0.04 0.00 2.01 0.00 0.00 34.83 34.71 2yuj s MET 45 CO -0.08 0.18 0.61 -2.30 -0.01 0.00 0.00 175.02 173.42 2yuj n PRO 46 N -0.92 0.39 0.22 2.03 -0.02 -1.26 -3.15 135.00 132.28 2yuj n PRO 46 Ca -0.04 0.17 0.07 0.00 -2.02 0.00 0.00 63.50 61.68 2yuj n PRO 46 Cb 0.62 -1.88 0.49 0.00 -0.02 0.00 0.00 33.50 32.70 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 -0.22 0.00 -0.06 0.52 0.13 -1.74 -2.73 132.00 127.89 2yuj h PRO 47 Ca -0.46 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.63 2yuj h PRO 47 Cb 1.36 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.48 2yuj h PRO 47 CO 0.44 0.27 -0.15 0.66 -0.23 0.00 0.00 178.00 178.99 2yuj h SER 48 N 0.00 0.09 -0.81 1.44 4.64 -1.92 -2.56 113.55 114.44 2yuj h SER 48 Ca -0.00 -0.02 -0.03 0.00 -0.47 0.00 0.00 61.79 61.27 2yuj h SER 48 Cb 0.58 -0.02 -0.04 0.00 -0.31 0.00 0.00 62.40 62.61 2yuj h SER 48 CO 0.04 0.25 0.37 0.00 -0.87 0.00 0.00 176.83 176.62 2yuj h ALA 49 N 1.76 1.04 -0.97 5.18 0.00 -1.84 -2.23 119.26 122.21 2yuj h ALA 49 Ca 0.02 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 54.78 2yuj h ALA 49 Cb 0.33 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 17.75 2yuj h ALA 49 CO 0.02 0.62 0.64 1.25 0.00 0.00 0.00 179.25 181.78 2yuj h LEU 50 N 1.15 1.10 -1.06 0.00 5.85 -1.58 0.60 115.31 121.37 2yuj h LEU 50 Ca 0.28 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.87 2yuj h LEU 50 Cb 0.14 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.89 2yuj h LEU 50 CO -0.03 0.78 -0.47 -0.78 -0.34 0.00 0.00 178.44 177.60 2yuj h ASP 51 N 1.29 0.00 0.72 1.25 3.58 -1.47 -3.00 116.42 118.79 2yuj h ASP 51 Ca 0.36 -0.00 -0.26 0.00 0.42 0.00 0.00 57.03 57.55 2yuj h ASP 51 Cb -0.12 -0.00 -0.04 0.00 1.72 0.00 0.00 39.33 40.90 2yuj h ASP 51 CO -0.09 0.47 -1.37 -0.61 -2.88 0.00 0.00 179.24 174.76 2yuj h GLN 52 N 0.00 0.03 -0.13 0.28 4.15 -0.73 -2.89 115.11 115.82 2yuj h GLN 52 Ca -0.00 -0.05 0.02 0.00 0.77 0.00 0.00 58.65 59.39 2yuj h GLN 52 Cb 0.83 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.53 2yuj h GLN 52 CO 0.06 0.79 0.09 -0.07 -1.93 0.00 0.00 178.83 177.77 2yuj h LEU 53 N 0.01 0.08 0.00 -2.39 3.38 0.32 -2.00 115.31 114.71 2yuj h LEU 53 Ca -0.16 -0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.49 2yuj h LEU 53 Cb 1.90 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 42.58 2yuj h LEU 53 CO 0.11 0.06 -1.94 -0.24 0.09 0.00 0.00 178.44 176.52 2yuj n SER 54 N -4.51 0.59 0.29 -0.43 2.88 -1.20 -3.14 113.62 108.10 2yuj n SER 54 Ca -0.01 0.27 0.17 0.00 -1.33 0.00 0.00 58.87 57.98 2yuj n SER 54 Cb 0.14 0.29 0.83 0.00 -0.75 0.00 0.00 64.21 64.71 2yuj n SER 54 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 2yuj h ARG 55 N 0.00 0.00 -0.68 -1.46 3.08 -1.19 -1.89 114.38 112.24 2yuj h ARG 55 Ca -0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.67 2yuj h ARG 55 Cb 2.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.14 2yuj h ARG 55 CO 0.06 0.06 0.00 1.28 -1.07 0.00 0.00 179.97 180.30 2yuj n LEU 56 N -3.30 4.07 -3.85 3.04 4.77 -0.81 -4.91 117.00 116.02 2yuj n LEU 56 Ca -0.01 -2.06 -0.28 0.00 -0.03 0.00 0.00 56.01 53.63 2yuj n LEU 56 Cb 0.23 -0.59 0.03 0.00 -2.33 0.00 0.00 43.42 40.76 2yuj n LEU 56 CO 0.27 0.54 0.08 0.59 -1.33 0.00 0.00 177.39 177.54 2yuj n ASN 57 N 0.53 -4.20 -4.59 -1.43 4.13 -0.71 -4.96 115.26 104.04 2yuj n ASN 57 Ca 0.19 -0.77 -0.34 0.00 1.68 0.00 0.00 54.58 55.34 2yuj n ASN 57 Cb 0.84 -4.01 -0.11 0.00 -1.54 0.00 0.00 39.78 34.96 2yuj n ASN 57 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2yuj s ILE 58 N -3.38 4.19 0.38 2.41 1.01 -1.19 -5.08 121.20 119.55 2yuj s ILE 58 Ca 0.53 -0.27 0.07 0.00 0.00 0.00 0.00 60.65 60.98 2yuj s ILE 58 Cb -0.26 -2.82 -0.07 0.00 0.01 0.00 0.00 42.46 39.32 2yuj s ILE 58 CO 0.82 0.53 -0.00 0.42 0.00 0.00 0.00 174.94 176.70 2yuj s THR 59 N -0.09 1.92 0.44 2.92 -4.23 -1.26 -4.55 115.64 110.79 2yuj s THR 59 Ca 0.03 -2.04 -0.26 0.00 -1.18 0.00 0.00 61.69 58.25 2yuj s THR 59 Cb -0.13 -2.90 -0.09 0.00 1.34 0.00 0.00 72.50 70.73 2yuj s THR 59 CO 0.02 -0.04 1.45 0.00 -0.54 0.00 0.00 174.62 175.51 2yuj n TYR 60 N -0.89 2.76 -1.69 3.99 9.36 -1.26 -4.30 117.16 125.14 2yuj n TYR 60 Ca -0.05 0.44 -0.30 0.00 3.32 0.00 0.00 57.90 61.31 2yuj n TYR 60 Cb 0.66 -2.47 0.08 0.00 -0.63 0.00 0.00 39.34 36.98 2yuj n TYR 60 CO 0.00 0.00 0.00 -1.25 0.22 0.00 0.00 176.86 175.83 2yuj s PRO 61 N -2.41 2.20 -0.39 2.98 0.04 -1.26 -5.13 135.00 131.02 2yuj s PRO 61 Ca 0.60 0.49 0.12 0.00 0.04 0.00 0.00 61.00 62.25 2yuj s PRO 61 Cb -0.45 -1.94 0.43 0.00 0.04 0.00 0.00 34.50 32.57 2yuj s PRO 61 CO 0.58 -1.51 0.99 -1.33 0.04 0.00 0.00 177.00 175.77 2yuj n MET 62 N -3.33 2.09 -2.17 4.56 2.81 -1.26 -4.98 117.12 114.83 2yuj n MET 62 Ca 0.07 -3.83 -0.40 0.00 -1.81 0.00 0.00 57.70 51.74 2yuj n MET 62 Cb 0.57 -1.72 -0.02 0.00 -0.71 0.00 0.00 33.22 31.35 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 -3.23 4.30 -0.08 4.03 1.43 -1.26 -4.62 118.68 119.25 2yuj s LEU 63 Ca 0.37 2.54 -0.00 0.00 -1.03 0.00 0.00 54.13 56.02 2yuj s LEU 63 Cb 0.42 -3.84 -0.03 0.00 0.03 0.00 0.00 46.19 42.76 2yuj s LEU 63 CO -0.07 -0.65 -0.05 -0.36 0.23 0.00 0.00 176.35 175.45 2yuj s PHE 64 N -1.26 2.99 -0.71 0.29 0.08 -1.05 -3.08 117.98 115.24 2yuj s PHE 64 Ca 0.54 0.03 -0.19 0.00 0.12 0.00 0.00 56.93 57.43 2yuj s PHE 64 Cb -0.36 -1.75 0.12 0.00 -0.57 0.00 0.00 43.02 40.46 2yuj s PHE 64 CO 0.46 0.33 0.85 0.21 -0.10 0.00 0.00 175.22 176.97 2yuj s LYS 65 N -0.72 3.24 -1.25 0.44 2.36 0.89 -3.05 119.74 121.65 2yuj s LYS 65 Ca 0.11 -1.47 -0.18 0.00 -2.55 0.00 0.00 55.97 51.88 2yuj s LYS 65 Cb -0.11 -4.42 0.08 0.00 -1.05 0.00 0.00 37.83 32.32 2yuj s LYS 65 CO 0.02 -1.61 1.67 -0.51 1.55 0.00 0.00 175.35 176.47 2yuj s LEU 66 N 2.63 3.91 -0.49 5.43 1.43 0.31 -2.63 118.68 129.26 2yuj s LEU 66 Ca 0.19 -2.37 -0.24 0.00 -1.03 0.00 0.00 54.13 50.68 2yuj s LEU 66 Cb -0.17 -2.56 0.03 0.00 0.03 0.00 0.00 46.19 43.52 2yuj s LEU 66 CO 0.02 -1.18 0.89 -0.89 0.23 0.00 0.00 176.35 175.41 2yuj s THR 67 N 4.09 4.50 -0.02 5.49 2.01 -1.10 -2.64 115.64 127.97 2yuj s THR 67 Ca 0.52 0.47 -0.30 0.00 0.31 0.00 0.00 61.69 62.69 2yuj s THR 67 Cb 0.03 -4.44 -0.05 0.00 0.01 0.00 0.00 72.50 68.05 2yuj s THR 67 CO 0.05 -0.90 1.43 0.21 -0.69 0.00 0.00 174.62 174.72 2yuj s ASN 68 N 2.43 6.82 -0.46 3.53 3.84 -1.10 -2.78 114.94 127.23 2yuj s ASN 68 Ca 0.32 2.11 0.02 0.00 0.21 0.00 0.00 52.86 55.52 2yuj s ASN 68 Cb -0.12 -2.55 0.58 0.00 -0.55 0.00 0.00 41.25 38.60 2yuj s ASN 68 CO 0.23 -0.76 1.89 0.29 -2.79 0.00 0.00 177.10 175.96 2yuj n LYS 69 N 5.74 2.25 0.00 0.43 4.76 -1.26 -3.03 118.16 127.04 2yuj n LYS 69 Ca 0.14 -2.84 0.00 0.00 -2.87 0.00 0.00 58.31 52.73 2yuj n LYS 69 Cb 0.43 -2.12 0.00 0.00 -1.84 0.00 0.00 35.03 31.51 2yuj n LYS 69 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2yuj n ASN 70 N -0.97 1.35 -0.08 4.39 2.85 -1.26 -4.84 115.26 116.71 2yuj n ASN 70 Ca 0.56 0.00 0.07 0.00 -0.11 0.00 0.00 54.58 55.10 2yuj n ASN 70 Cb 1.39 0.00 0.10 0.00 1.24 0.00 0.00 39.78 42.51 2yuj n ASN 70 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2yuj n SER 71 N -2.60 2.09 -3.56 1.20 2.88 -1.26 -5.01 113.62 107.36 2yuj n SER 71 Ca 0.00 -2.77 -0.27 0.00 -1.33 0.00 0.00 58.87 54.50 2yuj n SER 71 Cb 0.38 -0.32 0.05 0.00 -0.75 0.00 0.00 64.21 63.56 2yuj n SER 71 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2yuj n ASP 72 N -1.14 -5.67 -4.90 -3.46 9.92 -1.18 -5.01 116.55 105.12 2yuj n ASP 72 Ca 0.12 -0.93 -0.26 0.00 -0.53 0.00 0.00 54.79 53.19 2yuj n ASP 72 Cb 0.56 -3.88 -0.01 0.00 -0.64 0.00 0.00 41.12 37.15 2yuj n ASP 72 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 2yuj s ARG 73 N -5.55 2.27 -0.23 -1.24 1.81 -1.17 -4.97 118.95 109.88 2yuj s ARG 73 Ca 0.47 -1.97 -0.13 0.00 -1.72 0.00 0.00 55.73 52.39 2yuj s ARG 73 Cb -0.14 -2.13 0.07 0.00 -0.45 0.00 0.00 34.95 32.30 2yuj s ARG 73 CO 0.83 -0.58 0.56 1.41 -0.68 0.00 0.00 175.30 176.84 2yuj s MET 74 N -4.27 0.56 -0.15 3.54 -2.45 -1.26 -2.69 119.30 112.58 2yuj s MET 74 Ca 0.36 1.05 -0.12 0.00 -1.25 0.00 0.00 55.69 55.72 2yuj s MET 74 Cb -0.02 0.10 0.04 0.00 1.25 0.00 0.00 34.83 36.20 2yuj s MET 74 CO 0.22 -0.16 0.39 0.99 1.05 0.00 0.00 175.02 177.51 2yuj s THR 75 N 1.60 -0.01 -0.33 10.11 2.01 -1.08 -4.81 115.64 123.13 2yuj s THR 75 Ca -0.09 0.03 -0.04 0.00 0.31 0.00 0.00 61.69 61.89 2yuj s THR 75 Cb -0.07 -0.55 0.05 0.00 0.01 0.00 0.00 72.50 71.94 2yuj s THR 75 CO -0.17 0.01 0.07 -1.00 -0.69 0.00 0.00 174.62 172.84 2yuj s HIS 76 N 0.51 3.30 0.36 4.92 3.76 -1.26 -0.53 115.29 126.34 2yuj s HIS 76 Ca -0.02 -1.76 0.08 0.00 -0.15 0.00 0.00 55.06 53.21 2yuj s HIS 76 Cb -0.04 -2.32 -0.04 0.00 1.11 0.00 0.00 32.58 31.29 2yuj s HIS 76 CO -0.03 -0.80 0.23 0.00 -0.85 0.00 0.00 174.74 173.29 2yuj s GLY 78 N -3.94 1.16 0.44 0.00 0.00 -1.03 -2.53 107.32 101.42 2yuj s GLY 78 Ca 0.41 -0.95 -0.22 0.00 0.00 0.00 0.00 44.72 43.95 2yuj s GLY 78 CO 0.24 -0.64 1.03 0.54 0.00 0.00 0.00 173.10 174.27 2yuj s VAL 79 N -0.24 3.85 0.08 1.40 0.11 -1.26 -1.42 120.40 122.92 2yuj s VAL 79 Ca 0.00 1.26 0.00 0.00 -2.93 0.00 0.00 61.98 60.31 2yuj s VAL 79 Cb -0.12 -3.57 0.00 0.00 -1.53 0.00 0.00 36.38 31.16 2yuj s VAL 79 CO 0.02 -0.15 0.00 -0.11 -3.33 0.00 0.00 175.10 171.53 2yuj n LEU 80 N -0.55 0.64 0.00 2.54 7.94 -0.52 -4.71 117.00 122.35 2yuj n LEU 80 Ca 0.07 0.12 -0.25 0.00 -1.11 0.00 0.00 56.01 54.84 2yuj n LEU 80 Cb 0.52 -0.17 0.00 0.00 0.53 0.00 0.00 43.42 44.30 2yuj n LEU 80 CO 0.41 -0.67 0.07 -0.62 -1.11 0.00 0.00 177.39 175.47 2yuj n GLU 81 N -3.15 0.70 -3.07 1.96 1.02 -1.19 -5.04 120.64 111.87 2yuj n GLU 81 Ca 0.00 -3.34 -0.15 0.00 -0.02 0.00 0.00 57.16 53.65 2yuj n GLU 81 Cb 0.00 0.35 -0.04 0.00 -0.02 0.00 0.00 31.44 31.72 2yuj n GLU 81 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 2yuj n PHE 82 N -1.76 -2.43 -2.34 -0.32 3.72 -1.26 -3.64 117.46 109.44 2yuj n PHE 82 Ca -0.02 -2.31 -0.01 0.00 -0.05 0.00 0.00 57.45 55.06 2yuj n PHE 82 Cb 0.61 0.89 -0.01 0.00 -0.94 0.00 0.00 39.48 40.03 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 2.89 0.08 -2.50 -4.37 0.24 -1.19 -4.25 118.33 109.24 2yuj n VAL 83 Ca 0.24 -0.74 -0.25 0.00 -2.04 0.00 0.00 64.34 61.55 2yuj n VAL 83 Cb 0.52 0.83 0.04 0.00 -1.47 0.00 0.00 33.84 33.76 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 -0.24 3.46 1.17 2.33 0.00 -1.20 -4.92 121.76 122.37 2yuj s ALA 84 Ca 0.19 -0.94 -0.19 0.00 0.00 0.00 0.00 51.96 51.02 2yuj s ALA 84 Cb 0.24 -2.42 0.27 0.00 0.00 0.00 0.00 23.12 21.22 2yuj s ALA 84 CO -0.09 -0.84 1.14 -0.51 0.00 0.00 0.00 175.76 175.45 2yuj s ASP 85 N -4.37 1.22 -0.98 0.00 1.11 -1.26 -4.02 116.67 108.37 2yuj s ASP 85 Ca 0.55 0.59 -0.21 0.00 0.18 0.00 0.00 52.55 53.67 2yuj s ASP 85 Cb -0.10 -0.82 0.09 0.00 1.07 0.00 0.00 42.92 43.16 2yuj s ASP 85 CO 0.42 -3.93 1.30 -1.61 1.18 0.00 0.00 175.17 172.53 2yuj s GLU 86 N -5.46 3.61 0.00 8.23 0.41 -1.26 -3.57 118.70 120.66 2yuj s GLU 86 Ca 0.71 -1.47 0.00 0.00 -0.41 0.00 0.00 54.97 53.80 2yuj s GLU 86 Cb -0.09 -5.14 0.00 0.00 -1.78 0.00 0.00 34.13 27.12 2yuj s GLU 86 CO 0.56 -1.99 0.00 0.41 -0.49 0.00 0.00 175.26 173.75 2yuj n GLY 87 N 6.14 1.87 2.44 -1.39 0.00 -1.26 -5.08 105.19 107.92 2yuj n GLY 87 Ca 0.29 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.00 0.18 0.00 -0.61 1.01 -1.23 -4.22 121.20 114.33 2yuj s ILE 88 Ca 0.00 -2.27 -0.27 0.00 0.00 0.00 0.00 60.65 58.11 2yuj s ILE 88 Cb 0.00 -1.12 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 2yuj s ILE 88 CO 0.00 -1.09 0.86 0.00 0.00 0.00 0.00 174.94 174.71 2yuj s TYR 90 N 0.63 3.57 0.01 0.00 2.02 -0.80 0.00 117.35 122.77 2yuj s TYR 90 Ca 0.45 0.49 -0.05 0.00 -0.37 0.00 0.00 57.07 57.59 2yuj s TYR 90 Cb -0.20 -1.93 -0.00 0.00 -0.40 0.00 0.00 41.96 39.43 2yuj s TYR 90 CO 0.24 0.63 0.09 -0.51 -1.57 0.00 0.00 175.55 174.43 2yuj s LEU 91 N -1.80 1.76 1.11 -1.29 1.43 -0.32 -3.04 118.68 116.52 2yuj s LEU 91 Ca 0.27 -0.29 -0.16 0.00 -1.03 0.00 0.00 54.13 52.93 2yuj s LEU 91 Cb -0.13 0.50 0.22 0.00 0.03 0.00 0.00 46.19 46.81 2yuj s LEU 91 CO 0.16 -0.34 0.47 -2.65 0.23 0.00 0.00 176.35 174.22 2yuj n PRO 92 N 1.52 -2.85 0.06 1.29 -0.02 -1.26 -3.69 135.00 130.06 2yuj n PRO 92 Ca -0.23 -0.84 -0.23 0.00 -2.02 0.00 0.00 63.50 60.18 2yuj n PRO 92 Cb 0.55 -1.58 -0.15 0.00 -0.02 0.00 0.00 33.50 32.31 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 -2.91 0.67 -0.47 6.00 2.76 -1.95 -3.16 115.15 116.08 2yuj h HIS 93 Ca -0.28 -0.49 -0.04 0.00 -2.20 0.00 0.00 60.37 57.36 2yuj h HIS 93 Cb 0.89 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.80 2yuj h HIS 93 CO -3.15 1.67 0.12 0.11 -1.30 0.00 0.00 177.93 175.37 2yuj h TRP 94 N 0.03 0.72 -0.31 5.26 5.08 -1.92 -2.21 115.95 122.61 2yuj h TRP 94 Ca -0.34 -0.06 -0.16 0.00 1.08 0.00 0.00 58.89 59.41 2yuj h TRP 94 Cb 2.04 -0.22 -0.00 0.00 -3.00 0.00 0.00 29.16 27.98 2yuj h TRP 94 CO 0.11 0.61 -0.43 1.98 -1.28 0.00 0.00 178.44 179.43 2yuj h MET 95 N 0.69 0.84 -0.34 0.12 4.05 -1.84 -2.41 114.93 116.04 2yuj h MET 95 Ca 0.16 -0.49 0.00 0.00 -0.28 0.00 0.00 59.70 59.09 2yuj h MET 95 Cb 0.25 0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.07 2yuj h MET 95 CO -0.00 1.12 0.21 0.52 0.23 0.00 0.00 176.91 178.99 2yuj h MET 96 N 0.62 0.45 -0.25 0.39 2.86 -1.44 -1.54 114.93 116.02 2yuj h MET 96 Ca 0.03 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.59 2yuj h MET 96 Cb 1.03 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 32.57 2yuj h MET 96 CO 0.10 0.32 -0.09 1.96 1.06 0.00 0.00 176.91 180.25 2yuj h GLN 97 N 0.45 0.40 -0.55 1.72 1.08 -1.42 0.37 115.11 117.16 2yuj h GLN 97 Ca 0.12 -0.10 -0.10 0.00 -1.45 0.00 0.00 58.65 57.12 2yuj h GLN 97 Cb -0.03 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.33 2yuj h GLN 97 CO -0.02 0.50 -0.05 -0.97 -0.95 0.00 0.00 178.83 177.33 2yuj h ASN 98 N 0.38 1.00 1.40 1.46 -1.24 -0.90 -2.97 115.58 114.70 2yuj h ASN 98 Ca 0.08 -0.33 -0.04 0.00 0.71 0.00 0.00 56.30 56.72 2yuj h ASN 98 Cb 0.40 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 39.17 2yuj h ASN 98 CO 0.02 1.09 -0.62 -0.07 -1.29 0.00 0.00 177.43 176.56 2yuj h LEU 99 N 0.89 0.00 0.78 0.34 3.38 -0.96 -3.48 115.31 116.25 2yuj h LEU 99 Ca 0.15 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.80 2yuj h LEU 99 Cb 0.61 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.41 2yuj h LEU 99 CO 0.04 0.16 -0.47 0.18 0.09 0.00 0.00 178.44 178.43 2yuj n LEU 100 N -2.94 -2.40 0.00 1.67 4.77 0.13 -4.90 117.00 113.32 2yuj n LEU 100 Ca 0.00 -0.21 -0.27 0.00 -0.03 0.00 0.00 56.01 55.50 2yuj n LEU 100 Cb 0.61 -2.45 0.18 0.00 -2.33 0.00 0.00 43.42 39.43 2yuj n LEU 100 CO 0.38 0.16 0.77 0.18 -1.33 0.00 0.00 177.39 177.55 2yuj n LEU 101 N -3.16 0.00 0.00 2.23 4.77 -1.16 -5.05 117.00 114.62 2yuj n LEU 101 Ca -0.10 -1.63 -0.26 0.00 -0.03 0.00 0.00 56.01 53.99 2yuj n LEU 101 Cb 0.60 -0.89 -0.05 0.00 -2.33 0.00 0.00 43.42 40.76 2yuj n LEU 101 CO 0.36 -1.29 -0.16 -1.84 -1.33 0.00 0.00 177.39 173.13 2yuj n GLU 102 N -3.47 0.95 -2.16 3.23 0.28 -1.26 -4.95 120.64 113.26 2yuj n GLU 102 Ca 0.16 -3.06 -0.30 0.00 -0.16 0.00 0.00 57.16 53.80 2yuj n GLU 102 Cb 0.57 0.75 -0.05 0.00 1.43 0.00 0.00 31.44 34.15 2yuj n GLU 102 CO 0.00 0.00 0.00 -1.21 -0.16 0.00 0.00 177.13 175.76 2yuj s GLU 103 N -3.58 2.77 0.00 3.44 2.02 -1.26 -2.52 118.70 119.57 2yuj s GLU 103 Ca 0.04 -0.90 0.00 0.00 0.02 0.00 0.00 54.97 54.13 2yuj s GLU 103 Cb -0.00 -5.21 0.00 0.00 0.10 0.00 0.00 34.13 29.01 2yuj s GLU 103 CO 0.02 -3.40 0.00 0.41 0.02 0.00 0.00 175.26 172.31 2yuj n GLY 104 N 6.29 1.95 3.78 -1.39 0.00 0.25 -4.99 105.19 111.09 2yuj n GLY 104 Ca 0.42 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.08 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 -2.00 2.74 -0.24 -0.02 0.00 -1.05 -4.42 107.32 102.33 2yuj s GLY 105 Ca 0.00 0.61 -0.14 0.00 0.00 0.00 0.00 44.72 45.19 2yuj s GLY 105 CO 0.00 1.03 0.31 1.08 0.00 0.00 0.00 173.10 175.52 2yuj s LEU 106 N -2.42 4.10 -0.08 0.66 1.43 -1.25 0.76 118.68 121.88 2yuj s LEU 106 Ca 0.55 0.30 0.04 0.00 -1.03 0.00 0.00 54.13 53.99 2yuj s LEU 106 Cb -0.20 -2.35 -0.00 0.00 0.03 0.00 0.00 46.19 43.68 2yuj s LEU 106 CO 0.25 -0.06 -0.23 -0.69 0.23 0.00 0.00 176.35 175.85 2yuj s VAL 107 N 1.47 1.98 -0.54 -1.59 1.01 -1.11 -4.64 120.40 116.97 2yuj s VAL 107 Ca 0.14 -0.99 -0.26 0.00 0.00 0.00 0.00 61.98 60.87 2yuj s VAL 107 Cb -0.15 -1.70 -0.05 0.00 0.00 0.00 0.00 36.38 34.48 2yuj s VAL 107 CO 0.08 0.54 2.16 -1.58 0.00 0.00 0.00 175.10 176.30 2yuj s GLN 108 N 0.22 2.35 -0.11 2.72 2.00 -1.12 -3.29 119.66 122.43 2yuj s GLN 108 Ca -0.14 1.05 -0.26 0.00 -2.00 0.00 0.00 55.36 54.02 2yuj s GLN 108 Cb -0.16 -4.49 -0.02 0.00 0.80 0.00 0.00 33.01 29.13 2yuj s GLN 108 CO 0.07 -3.01 0.84 0.08 -0.50 0.00 0.00 175.29 172.76 2yuj s VAL 109 N 10.73 4.91 -0.10 1.34 1.01 -0.09 -2.70 120.40 135.50 2yuj s VAL 109 Ca 0.84 1.69 -0.01 0.00 0.00 0.00 0.00 61.98 64.49 2yuj s VAL 109 Cb -0.15 -4.16 0.03 0.00 0.00 0.00 0.00 36.38 32.10 2yuj s VAL 109 CO 0.24 0.10 -0.00 -1.61 0.00 0.00 0.00 175.10 173.82 2yuj s GLU 110 N 1.64 0.73 -0.27 2.72 0.41 -1.08 -2.78 118.70 120.08 2yuj s GLU 110 Ca 0.41 -0.03 -0.29 0.00 -0.41 0.00 0.00 54.97 54.65 2yuj s GLU 110 Cb -0.18 -1.24 0.00 0.00 -1.78 0.00 0.00 34.13 30.94 2yuj s GLU 110 CO 0.17 -0.35 1.22 -1.54 -0.49 0.00 0.00 175.26 174.26 2yuj s SER 111 N 1.92 6.83 0.40 -0.19 1.04 -1.11 -0.08 113.70 122.51 2yuj s SER 111 Ca 0.04 1.30 0.06 0.00 0.48 0.00 0.00 55.95 57.84 2yuj s SER 111 Cb -0.13 -2.54 -0.08 0.00 0.10 0.00 0.00 66.02 63.37 2yuj s SER 111 CO -0.06 -0.93 0.02 0.68 0.98 0.00 0.00 173.24 173.93 2yuj s VAL 112 N 3.91 1.86 -0.27 5.02 -7.23 -1.18 -4.68 120.40 117.84 2yuj s VAL 112 Ca 0.53 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.71 2yuj s VAL 112 Cb -0.17 -2.96 0.07 0.00 0.56 0.00 0.00 36.38 33.89 2yuj s VAL 112 CO 0.18 0.00 -0.01 0.21 -0.31 0.00 0.00 175.10 175.17 2yuj s ASN 113 N -3.68 4.11 0.43 4.85 3.84 -1.26 -4.37 114.94 118.86 2yuj s ASN 113 Ca 0.35 -1.47 0.08 0.00 0.21 0.00 0.00 52.86 52.02 2yuj s ASN 113 Cb 0.10 -1.25 -0.02 0.00 -0.55 0.00 0.00 41.25 39.53 2yuj s ASN 113 CO 0.17 -0.29 0.39 -0.76 -2.79 0.00 0.00 177.10 173.82 2yuj s LEU 114 N 1.30 3.35 0.55 3.21 1.43 -1.26 -5.11 118.68 122.15 2yuj s LEU 114 Ca -0.00 -0.78 0.02 0.00 -1.03 0.00 0.00 54.13 52.34 2yuj s LEU 114 Cb -0.19 -1.99 0.02 0.00 0.03 0.00 0.00 46.19 44.06 2yuj s LEU 114 CO -0.09 -0.69 0.18 0.00 0.23 0.00 0.00 176.35 175.98 2yuj s GLN 115 N -4.15 2.24 0.35 1.70 0.00 -1.26 -4.58 119.66 113.95 2yuj s GLN 115 Ca 0.48 -2.29 -0.27 0.00 -0.00 0.00 0.00 55.36 53.27 2yuj s GLN 115 Cb -0.03 -1.76 -0.09 0.00 0.00 0.00 0.00 33.01 31.13 2yuj s GLN 115 CO 0.28 -0.54 1.22 0.14 0.00 0.00 0.00 175.29 176.39 2yuj s VAL 116 N -2.87 3.01 0.20 3.63 -7.23 -1.21 0.08 120.40 116.02 2yuj s VAL 116 Ca 0.14 0.94 -0.24 0.00 -1.81 0.00 0.00 61.98 61.01 2yuj s VAL 116 Cb -0.01 -3.57 -0.08 0.00 0.56 0.00 0.00 36.38 33.27 2yuj s VAL 116 CO 0.09 0.17 0.80 0.00 -0.31 0.00 0.00 175.10 175.85 2yuj s ALA 117 N -1.25 3.40 -0.20 1.32 0.00 -1.26 -4.66 121.76 119.11 2yuj s ALA 117 Ca 0.52 0.35 0.16 0.00 0.00 0.00 0.00 51.96 52.99 2yuj s ALA 117 Cb -0.35 -2.97 -0.24 0.00 0.00 0.00 0.00 23.12 19.56 2yuj s ALA 117 CO 0.45 0.28 0.05 0.25 0.00 0.00 0.00 175.76 176.80 2yuj n THR 118 N 1.24 1.41 -3.59 0.00 -2.24 -1.14 -4.46 114.28 105.50 2yuj n THR 118 Ca -0.04 -0.83 -0.26 0.00 -2.27 0.00 0.00 64.05 60.66 2yuj n THR 118 Cb 0.49 -0.58 -0.16 0.00 -2.10 0.00 0.00 70.33 67.98 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 -2.50 0.19 -0.19 4.78 5.04 -1.26 -0.32 117.35 123.09 2yuj s TYR 119 Ca -0.13 -0.41 0.01 0.00 -2.44 0.00 0.00 57.07 54.11 2yuj s TYR 119 Cb 0.06 -0.72 0.03 0.00 0.35 0.00 0.00 41.96 41.68 2yuj s TYR 119 CO 0.80 -0.59 -0.18 -1.54 -1.34 0.00 0.00 175.55 172.70 2yuj s SER 120 N 2.14 3.30 0.25 4.32 1.04 -1.25 -0.84 113.70 122.67 2yuj s SER 120 Ca 0.04 -0.76 0.06 0.00 0.48 0.00 0.00 55.95 55.77 2yuj s SER 120 Cb -0.16 -1.46 -0.03 0.00 0.10 0.00 0.00 66.02 64.47 2yuj s SER 120 CO -0.16 -0.04 0.28 -0.75 0.98 0.00 0.00 173.24 173.55 2yuj s LYS 121 N 1.28 3.17 0.03 4.02 2.20 0.12 -1.96 119.74 128.60 2yuj s LYS 121 Ca 0.03 -0.92 -0.03 0.00 -0.36 0.00 0.00 55.97 54.69 2yuj s LYS 121 Cb -0.14 -2.72 -0.02 0.00 -1.51 0.00 0.00 37.83 33.44 2yuj s LYS 121 CO -0.11 0.41 0.03 -0.06 -0.36 0.00 0.00 175.35 175.26 2yuj s PHE 122 N -2.06 0.26 -0.41 4.03 0.40 -1.10 -2.61 117.98 116.49 2yuj s PHE 122 Ca 0.33 -0.57 0.01 0.00 -0.60 0.00 0.00 56.93 56.11 2yuj s PHE 122 Cb -0.08 -0.19 0.14 0.00 0.51 0.00 0.00 43.02 43.39 2yuj s PHE 122 CO 0.27 -0.30 0.23 -1.14 0.70 0.00 0.00 175.22 174.98 2yuj s GLN 123 N -2.30 1.00 -0.33 0.44 0.74 0.39 0.06 119.66 119.66 2yuj s GLN 123 Ca -0.08 -1.75 -0.35 0.00 0.05 0.00 0.00 55.36 53.22 2yuj s GLN 123 Cb -0.03 -1.91 -0.12 0.00 1.10 0.00 0.00 33.01 32.05 2yuj s GLN 123 CO -0.04 -1.19 2.15 -2.30 -0.55 0.00 0.00 175.29 173.37 2yuj n PRO 124 N 3.71 1.13 0.17 1.67 -0.02 -1.26 -3.18 135.00 137.21 2yuj n PRO 124 Ca 0.11 0.32 0.05 0.00 -2.02 0.00 0.00 63.50 61.96 2yuj n PRO 124 Cb 0.36 -2.45 0.52 0.00 -0.02 0.00 0.00 33.50 31.91 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 11.93 0.17 -5.80 -0.52 1.08 -1.46 -3.42 115.11 117.10 2yuj h GLN 125 Ca -0.29 -0.02 -0.64 0.00 -1.45 0.00 0.00 58.65 56.25 2yuj h GLN 125 Cb 1.32 -0.03 -0.06 0.00 -0.05 0.00 0.00 27.48 28.66 2yuj h GLN 125 CO 1.01 0.19 -0.43 0.45 -0.95 0.00 0.00 178.83 179.10 2yuj s SER 126 N -6.93 6.45 0.49 1.46 0.15 -1.10 -5.00 113.70 109.22 2yuj s SER 126 Ca -0.06 0.50 0.28 0.00 0.70 0.00 0.00 55.95 57.38 2yuj s SER 126 Cb 0.17 -2.07 0.87 0.00 -1.71 0.00 0.00 66.02 63.27 2yuj s SER 126 CO 0.70 0.31 1.80 1.55 1.20 0.00 0.00 173.24 178.80 2yuj h PRO 127 N 4.31 0.00 -0.99 5.44 0.13 -1.94 -3.23 132.00 135.72 2yuj h PRO 127 Ca -0.51 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.72 2yuj h PRO 127 Cb 1.21 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.26 2yuj h PRO 127 CO 0.64 0.02 0.63 0.22 -0.23 0.00 0.00 178.00 179.28 2yuj h ASP 128 N 0.00 0.94 -0.39 1.44 3.58 -1.95 -1.70 116.42 118.34 2yuj h ASP 128 Ca -0.00 0.03 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 2yuj h ASP 128 Cb 0.76 -0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.63 2yuj h ASP 128 CO 0.00 0.53 0.09 0.15 -2.88 0.00 0.00 179.24 177.14 2yuj h PHE 129 N 1.02 0.66 -0.13 0.28 3.04 -1.95 -2.63 116.94 117.24 2yuj h PHE 129 Ca 0.47 -0.08 0.01 0.00 3.98 0.00 0.00 57.97 62.35 2yuj h PHE 129 Cb 0.40 -0.19 -0.01 0.00 2.56 0.00 0.00 35.95 38.72 2yuj h PHE 129 CO -0.00 0.64 0.09 -0.07 -2.02 0.00 0.00 178.31 176.95 2yuj h LEU 130 N 0.49 0.11 -1.59 0.59 3.38 -1.50 -0.27 115.31 116.53 2yuj h LEU 130 Ca 0.12 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.06 2yuj h LEU 130 Cb 0.32 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2yuj h LEU 130 CO 0.00 0.08 -0.15 -0.78 0.09 0.00 0.00 178.44 177.69 2yuj h ASP 131 N 0.13 0.00 -3.50 -0.43 3.58 -1.01 -3.44 116.42 111.75 2yuj h ASP 131 Ca 0.05 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.97 2yuj h ASP 131 Cb 0.04 0.00 0.09 0.00 1.72 0.00 0.00 39.33 41.18 2yuj h ASP 131 CO -0.01 0.15 0.87 -0.38 -2.88 0.00 0.00 179.24 176.98 2yuj n ILE 132 N -3.46 1.32 0.00 2.25 5.41 -0.11 -4.92 119.36 119.85 2yuj n ILE 132 Ca -0.01 -0.33 -0.11 0.00 1.00 0.00 0.00 62.75 63.30 2yuj n ILE 132 Cb 0.32 -1.99 -0.06 0.00 -0.71 0.00 0.00 39.64 37.19 2yuj n ILE 132 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 2yuj h THR 133 N 3.25 1.08 -3.20 1.39 2.02 -1.87 -3.35 112.91 112.24 2yuj h THR 133 Ca -0.48 -0.23 -0.64 0.00 0.77 0.00 0.00 66.41 65.82 2yuj h THR 133 Cb 1.23 1.10 -0.40 0.00 -1.74 0.00 0.00 68.15 68.33 2yuj h THR 133 CO 0.75 0.07 -0.50 0.21 0.37 0.00 0.00 175.52 176.42 2yuj s ASN 134 N -5.36 4.93 0.23 4.18 2.47 -1.26 -4.91 114.94 115.23 2yuj s ASN 134 Ca -0.13 -3.63 0.05 0.00 0.42 0.00 0.00 52.86 49.57 2yuj s ASN 134 Cb 0.06 -1.69 0.24 0.00 -1.45 0.00 0.00 41.25 38.41 2yuj s ASN 134 CO 0.68 -0.14 1.55 1.55 -3.72 0.00 0.00 177.10 177.02 2yuj h PRO 135 N 5.78 0.20 -0.31 0.43 0.13 -1.86 -2.97 132.00 133.40 2yuj h PRO 135 Ca 0.10 -0.15 -0.03 0.00 -0.87 0.00 0.00 66.00 65.05 2yuj h PRO 135 Cb 0.80 0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.94 2yuj h PRO 135 CO 0.73 0.77 0.05 -0.22 -0.23 0.00 0.00 178.00 179.10 2yuj h LYS 136 N 0.15 0.46 -0.01 0.86 3.64 -1.95 0.17 116.57 119.89 2yuj h LYS 136 Ca -0.01 -0.08 -0.06 0.00 -1.27 0.00 0.00 60.65 59.23 2yuj h LYS 136 Cb 1.14 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 2yuj h LYS 136 CO 0.10 0.45 -0.24 0.00 -2.27 0.00 0.00 179.45 177.48 2yuj h ALA 137 N 1.61 0.04 -0.03 5.00 0.00 -1.96 -1.12 119.26 122.80 2yuj h ALA 137 Ca 0.10 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.49 2yuj h ALA 137 Cb 0.22 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2yuj h ALA 137 CO 0.00 0.08 -0.32 0.28 0.00 0.00 0.00 179.25 179.29 2yuj h VAL 138 N -0.47 1.25 0.06 0.00 2.07 -1.36 0.03 116.25 117.82 2yuj h VAL 138 Ca -0.03 -1.17 -0.13 0.00 0.82 0.00 0.00 66.70 66.19 2yuj h VAL 138 Cb 0.98 1.58 0.01 0.00 -1.52 0.00 0.00 31.29 32.34 2yuj h VAL 138 CO 0.05 0.34 -0.56 0.25 0.02 0.00 0.00 177.57 177.66 2yuj h LEU 139 N 0.05 0.39 -1.09 2.57 5.85 -0.72 -3.22 115.31 119.15 2yuj h LEU 139 Ca 0.01 -0.87 -0.09 0.00 0.84 0.00 0.00 57.88 57.76 2yuj h LEU 139 Cb 0.60 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 2yuj h LEU 139 CO 0.04 1.22 -0.38 -0.33 -0.34 0.00 0.00 178.44 178.65 2yuj h GLU 140 N -0.38 0.13 0.00 1.25 4.39 -1.12 -1.91 114.58 116.94 2yuj h GLU 140 Ca -0.09 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.51 2yuj h GLU 140 Cb 1.36 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.00 2yuj h GLU 140 CO 0.11 0.50 -0.20 -0.91 -1.16 0.00 0.00 179.01 177.35 2yuj h ASN 141 N 0.11 0.00 0.46 1.42 2.35 -1.06 -2.73 115.58 116.13 2yuj h ASN 141 Ca 0.01 0.00 -0.30 0.00 -0.55 0.00 0.00 56.30 55.46 2yuj h ASN 141 Cb 0.73 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.06 2yuj h ASN 141 CO 0.05 0.20 -1.68 0.00 -1.65 0.00 0.00 177.43 174.36 2yuj h ALA 142 N 1.80 0.62 -0.04 -0.83 0.00 -1.47 -3.34 119.26 116.00 2yuj h ALA 142 Ca -0.00 -1.37 0.01 0.00 0.00 0.00 0.00 54.91 53.55 2yuj h ALA 142 Cb 0.39 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 2yuj h ALA 142 CO 0.03 1.46 0.03 -0.07 0.00 0.00 0.00 179.25 180.70 2yuj h LEU 143 N 0.02 0.00 -2.19 0.00 3.38 -1.05 -1.19 115.31 114.28 2yuj h LEU 143 Ca -0.28 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.74 2yuj h LEU 143 Cb 2.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.74 2yuj h LEU 143 CO 0.09 0.00 0.15 0.03 0.09 0.00 0.00 178.44 178.80 2yuj h ARG 144 N 0.00 0.00 0.17 1.13 3.08 -1.64 -1.69 114.38 115.43 2yuj h ARG 144 Ca 0.02 0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.79 2yuj h ARG 144 Cb 0.08 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.16 2yuj h ARG 144 CO -0.00 0.00 -1.21 -0.91 -1.07 0.00 0.00 179.97 176.78 2yuj h ASN 145 N 0.00 0.77 -3.11 7.04 4.21 -1.44 -3.45 115.58 119.60 2yuj h ASN 145 Ca 0.08 -0.88 -0.53 0.00 1.21 0.00 0.00 56.30 56.17 2yuj h ASN 145 Cb 0.38 -0.25 0.02 0.00 -1.12 0.00 0.00 38.32 37.34 2yuj h ASN 145 CO -0.00 1.59 0.65 -0.36 -1.29 0.00 0.00 177.43 178.01 2yuj s PHE 146 N -2.73 3.33 -0.05 1.19 0.08 -0.64 -3.76 117.98 115.41 2yuj s PHE 146 Ca -0.10 1.12 0.05 0.00 0.12 0.00 0.00 56.93 58.12 2yuj s PHE 146 Cb 0.04 -3.56 -0.24 0.00 -0.57 0.00 0.00 43.02 38.68 2yuj s PHE 146 CO 0.91 -1.87 0.65 0.00 -0.10 0.00 0.00 175.22 174.82 2yuj h ALA 147 N 6.68 0.59 -2.37 5.36 0.00 -1.82 -3.46 119.26 124.25 2yuj h ALA 147 Ca -0.42 -1.37 -0.46 0.00 0.00 0.00 0.00 54.91 52.66 2yuj h ALA 147 Cb 1.21 0.48 -0.15 0.00 0.00 0.00 0.00 17.79 19.33 2yuj h ALA 147 CO 0.83 1.44 -0.74 0.00 0.00 0.00 0.00 179.25 180.78 2yuj s LEU 149 N -3.16 0.46 0.10 0.00 1.43 -0.59 -4.95 118.68 111.96 2yuj s LEU 149 Ca 0.21 0.22 0.10 0.00 -1.03 0.00 0.00 54.13 53.62 2yuj s LEU 149 Cb -0.02 0.15 -0.04 0.00 0.03 0.00 0.00 46.19 46.32 2yuj s LEU 149 CO 0.07 -0.19 -0.24 -0.89 0.23 0.00 0.00 176.35 175.32 2yuj s THR 150 N 1.66 2.38 0.01 5.49 2.01 -1.25 -1.77 115.64 124.17 2yuj s THR 150 Ca -0.03 -1.57 -0.30 0.00 0.31 0.00 0.00 61.69 60.10 2yuj s THR 150 Cb -0.12 -2.03 -0.04 0.00 0.01 0.00 0.00 72.50 70.32 2yuj s THR 150 CO -0.05 0.18 1.17 -0.89 -0.69 0.00 0.00 174.62 174.35 2yuj s THR 151 N -1.00 4.22 0.00 -0.82 2.01 -1.11 -3.37 115.64 115.58 2yuj s THR 151 Ca 0.14 1.58 0.00 0.00 0.31 0.00 0.00 61.69 63.72 2yuj s THR 151 Cb -0.10 -4.01 0.00 0.00 0.01 0.00 0.00 72.50 68.40 2yuj s THR 151 CO 0.06 0.08 0.00 0.61 -0.69 0.00 0.00 174.62 174.67 2yuj n GLY 152 N 3.23 1.09 3.33 4.40 0.00 -1.21 -5.02 105.19 111.02 2yuj n GLY 152 Ca 0.09 -0.47 -0.31 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.50 3.25 -0.51 1.61 1.11 -1.22 -4.95 116.67 113.47 2yuj s ASP 153 Ca 0.00 -0.43 -0.18 0.00 0.18 0.00 0.00 52.55 52.13 2yuj s ASP 153 Cb 0.00 -0.58 0.08 0.00 1.07 0.00 0.00 42.92 43.48 2yuj s ASP 153 CO 0.00 0.30 0.55 -0.69 1.18 0.00 0.00 175.17 176.51 2yuj s VAL 154 N -0.50 5.02 -0.80 -1.27 1.01 -1.26 -1.70 120.40 120.89 2yuj s VAL 154 Ca 0.06 -0.85 -0.12 0.00 0.00 0.00 0.00 61.98 61.08 2yuj s VAL 154 Cb -0.11 -4.27 0.21 0.00 0.00 0.00 0.00 36.38 32.21 2yuj s VAL 154 CO 0.01 -0.78 0.72 0.27 0.00 0.00 0.00 175.10 175.32 2yuj s ILE 155 N 2.21 5.29 0.26 2.22 -4.36 -0.33 -4.70 121.20 121.78 2yuj s ILE 155 Ca 0.10 -2.60 -0.30 0.00 -0.26 0.00 0.00 60.65 57.58 2yuj s ILE 155 Cb -0.23 -4.28 -0.11 0.00 1.25 0.00 0.00 42.46 39.09 2yuj s ILE 155 CO 0.08 -1.01 1.52 0.00 0.24 0.00 0.00 174.94 175.78 2yuj s ALA 156 N 0.06 3.70 0.23 2.27 0.00 -1.26 -4.24 121.76 122.51 2yuj s ALA 156 Ca 0.18 1.44 0.11 0.00 0.00 0.00 0.00 51.96 53.69 2yuj s ALA 156 Cb -0.12 -3.60 -0.05 0.00 0.00 0.00 0.00 23.12 19.35 2yuj s ALA 156 CO -0.08 -0.85 -0.20 0.96 0.00 0.00 0.00 175.76 175.59 2yuj s ILE 157 N 0.16 2.26 0.04 0.00 -4.36 -0.82 -4.88 121.20 113.59 2yuj s ILE 157 Ca 0.63 -2.19 -0.05 0.00 -0.26 0.00 0.00 60.65 58.77 2yuj s ILE 157 Cb -0.45 -2.15 -0.01 0.00 1.25 0.00 0.00 42.46 41.10 2yuj s ILE 157 CO 0.43 -0.32 0.08 0.21 0.24 0.00 0.00 174.94 175.58 2yuj s ASN 158 N -3.09 0.21 0.00 4.36 2.47 -1.26 -0.31 114.94 117.31 2yuj s ASN 158 Ca 0.24 -0.57 0.00 0.00 0.42 0.00 0.00 52.86 52.95 2yuj s ASN 158 Cb -0.06 0.22 0.00 0.00 -1.45 0.00 0.00 41.25 39.96 2yuj s ASN 158 CO 0.11 -0.51 0.00 0.00 -3.72 0.00 0.00 177.10 172.98 2yuj n TYR 159 N 0.75 -0.43 -1.54 0.43 4.11 -1.26 -4.97 117.16 114.25 2yuj n TYR 159 Ca -0.19 0.00 -0.36 0.00 -0.00 0.00 0.00 57.90 57.35 2yuj n TYR 159 Cb 0.59 0.09 0.07 0.00 -0.00 0.00 0.00 39.34 40.08 2yuj n TYR 159 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.86 175.15 2yuj n ASN 160 N -1.71 7.55 -2.43 9.48 5.15 -1.26 -4.82 115.26 127.22 2yuj n ASN 160 Ca 0.00 -3.80 -0.20 0.00 -0.60 0.00 0.00 54.58 49.97 2yuj n ASN 160 Cb 0.00 -0.98 -0.01 0.00 -0.53 0.00 0.00 39.78 38.26 2yuj n ASN 160 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2yuj n GLU 161 N -0.79 -1.86 -3.68 1.20 1.02 -1.26 -4.96 120.64 110.30 2yuj n GLU 161 Ca 0.59 0.98 -0.13 0.00 -0.02 0.00 0.00 57.16 58.58 2yuj n GLU 161 Cb 0.54 -5.65 -0.13 0.00 -0.02 0.00 0.00 31.44 26.18 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 -5.08 0.18 -1.04 3.49 -0.14 -1.26 -5.09 119.74 110.80 2yuj s LYS 162 Ca 0.01 0.73 -0.22 0.00 -1.36 0.00 0.00 55.97 55.14 2yuj s LYS 162 Cb -0.01 -0.02 0.06 0.00 -1.68 0.00 0.00 37.83 36.18 2yuj s LYS 162 CO 0.02 -0.26 1.45 0.42 -0.76 0.00 0.00 175.35 176.22 2yuj s ILE 163 N 2.18 4.04 0.18 2.17 1.09 -1.26 -4.13 121.20 125.48 2yuj s ILE 163 Ca -0.01 -0.99 -0.31 0.00 -1.10 0.00 0.00 60.65 58.24 2yuj s ILE 163 Cb -0.12 -5.04 -0.10 0.00 -1.06 0.00 0.00 42.46 36.15 2yuj s ILE 163 CO -0.09 -1.90 1.48 -0.31 -0.10 0.00 0.00 174.94 174.02 2yuj s TYR 164 N 4.62 3.09 -0.39 3.97 1.51 0.58 -4.80 117.35 125.95 2yuj s TYR 164 Ca 0.45 0.85 -0.21 0.00 -1.01 0.00 0.00 57.07 57.15 2yuj s TYR 164 Cb -0.00 -3.83 0.01 0.00 -0.11 0.00 0.00 41.96 38.03 2yuj s TYR 164 CO -0.08 -2.91 0.69 -2.00 -1.11 0.00 0.00 175.55 170.14 2yuj s GLU 165 N 0.58 3.58 -0.01 -0.62 2.12 -1.26 -1.95 118.70 121.13 2yuj s GLU 165 Ca 0.65 -0.00 0.05 0.00 0.36 0.00 0.00 54.97 56.02 2yuj s GLU 165 Cb -0.41 -3.85 -0.01 0.00 0.26 0.00 0.00 34.13 30.11 2yuj s GLU 165 CO 0.35 -0.86 -0.15 -0.51 -0.54 0.00 0.00 175.26 173.55 2yuj s LEU 166 N 2.88 2.03 -0.03 2.70 1.43 -1.26 -1.11 118.68 125.32 2yuj s LEU 166 Ca 0.26 -0.27 0.03 0.00 -1.03 0.00 0.00 54.13 53.12 2yuj s LEU 166 Cb -0.14 -0.77 0.00 0.00 0.03 0.00 0.00 46.19 45.32 2yuj s LEU 166 CO 0.17 0.18 -0.10 -0.60 0.23 0.00 0.00 176.35 176.23 2yuj s ARG 167 N -0.36 1.16 0.52 1.70 3.52 -1.19 -1.18 118.95 123.12 2yuj s ARG 167 Ca 0.06 -0.35 -0.21 0.00 -0.13 0.00 0.00 55.73 55.09 2yuj s ARG 167 Cb -0.06 -1.05 -0.06 0.00 -1.56 0.00 0.00 34.95 32.22 2yuj s ARG 167 CO -0.01 0.11 1.24 0.08 -0.81 0.00 0.00 175.30 175.91 2yuj s VAL 168 N 0.27 2.67 -0.03 7.11 1.01 -0.69 -0.46 120.40 130.27 2yuj s VAL 168 Ca -0.05 0.48 -0.07 0.00 0.00 0.00 0.00 61.98 62.33 2yuj s VAL 168 Cb -0.10 -3.23 -0.02 0.00 0.00 0.00 0.00 36.38 33.02 2yuj s VAL 168 CO 0.01 -0.03 -0.14 0.23 0.00 0.00 0.00 175.10 175.17 2yuj n MET 169 N -0.95 0.22 -4.07 2.72 2.81 -1.07 -3.30 117.12 113.47 2yuj n MET 169 Ca 0.10 0.09 -0.12 0.00 -1.81 0.00 0.00 57.70 55.96 2yuj n MET 169 Cb 0.48 -0.84 -0.11 0.00 -0.71 0.00 0.00 33.22 32.04 2yuj n MET 169 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2yuj s GLU 170 N -2.20 0.56 -0.09 0.03 2.12 -1.25 -4.60 118.70 113.27 2yuj s GLU 170 Ca -0.12 -0.87 -0.14 0.00 0.36 0.00 0.00 54.97 54.20 2yuj s GLU 170 Cb 0.02 -0.20 0.03 0.00 0.26 0.00 0.00 34.13 34.24 2yuj s GLU 170 CO 0.18 0.02 0.36 0.95 -0.54 0.00 0.00 175.26 176.22 2yuj s THR 171 N -1.94 0.02 0.16 -1.70 -4.23 -1.26 0.13 115.64 106.82 2yuj s THR 171 Ca -0.06 -0.16 0.11 0.00 -1.18 0.00 0.00 61.69 60.40 2yuj s THR 171 Cb -0.06 -0.56 -0.04 0.00 1.34 0.00 0.00 72.50 73.17 2yuj s THR 171 CO -0.01 -0.09 -0.25 -0.54 -0.54 0.00 0.00 174.62 173.19 2yuj s LYS 172 N -0.36 1.44 0.09 3.99 1.02 -0.02 -4.10 119.74 121.80 2yuj s LYS 172 Ca -0.05 -1.42 -0.10 0.00 0.02 0.00 0.00 55.97 54.42 2yuj s LYS 172 Cb -0.03 -1.84 -0.19 0.00 -0.52 0.00 0.00 37.83 35.25 2yuj s LYS 172 CO 0.02 0.42 1.22 -1.00 -0.92 0.00 0.00 175.35 175.09 2yuj h PRO 173 N 3.58 0.58 -6.05 -1.68 0.13 -1.90 -3.02 132.00 123.64 2yuj h PRO 173 Ca -0.49 -0.65 -0.55 0.00 -0.87 0.00 0.00 66.00 63.45 2yuj h PRO 173 Cb 1.19 0.19 -0.04 0.00 0.13 0.00 0.00 31.00 32.46 2yuj h PRO 173 CO 0.43 1.25 -0.33 -0.51 -0.23 0.00 0.00 178.00 178.62 2yuj s ASP 174 N -7.23 4.76 0.16 1.44 1.01 -1.26 -5.03 116.67 110.52 2yuj s ASP 174 Ca -0.08 -1.06 -0.16 0.00 0.71 0.00 0.00 52.55 51.95 2yuj s ASP 174 Cb 0.07 0.05 0.07 0.00 1.01 0.00 0.00 42.92 44.12 2yuj s ASP 174 CO 0.90 -0.95 1.74 0.07 0.21 0.00 0.00 175.17 177.15 2yuj h LYS 175 N 0.85 0.24 -5.64 8.23 2.10 -1.92 -3.41 116.57 117.02 2yuj h LYS 175 Ca -0.38 -0.01 -0.59 0.00 -2.00 0.00 0.00 60.65 57.67 2yuj h LYS 175 Cb 1.29 -0.06 -0.09 0.00 -0.90 0.00 0.00 32.23 32.47 2yuj h LYS 175 CO 0.57 0.16 -0.24 0.00 -2.00 0.00 0.00 179.45 177.94 2yuj s ALA 176 N -6.16 3.56 0.04 0.07 0.00 -1.26 -2.73 121.76 115.27 2yuj s ALA 176 Ca -0.13 -0.33 -0.05 0.00 0.00 0.00 0.00 51.96 51.45 2yuj s ALA 176 Cb 0.12 -2.49 -0.01 0.00 0.00 0.00 0.00 23.12 20.74 2yuj s ALA 176 CO 0.71 0.09 0.08 0.14 0.00 0.00 0.00 175.76 176.78 2yuj s VAL 177 N 0.38 0.14 -0.42 0.00 -7.23 -0.73 -4.73 120.40 107.81 2yuj s VAL 177 Ca 0.21 -1.16 -0.04 0.00 -1.81 0.00 0.00 61.98 59.19 2yuj s VAL 177 Cb -0.14 -0.94 0.11 0.00 0.56 0.00 0.00 36.38 35.97 2yuj s VAL 177 CO 0.07 -0.64 0.23 -0.55 -0.31 0.00 0.00 175.10 173.90 2yuj s SER 178 N -2.20 5.31 -1.06 4.85 0.15 0.11 -1.55 113.70 119.32 2yuj s SER 178 Ca -0.04 -2.04 -0.17 0.00 0.70 0.00 0.00 55.95 54.41 2yuj s SER 178 Cb -0.00 -1.85 0.14 0.00 -1.71 0.00 0.00 66.02 62.60 2yuj s SER 178 CO -0.05 -0.56 1.28 0.27 1.20 0.00 0.00 173.24 175.38 2yuj s ILE 179 N 1.14 4.81 -0.45 6.45 -4.36 -0.85 -3.28 121.20 124.65 2yuj s ILE 179 Ca 0.08 -1.99 0.01 0.00 -0.26 0.00 0.00 60.65 58.48 2yuj s ILE 179 Cb -0.23 -4.85 0.12 0.00 1.25 0.00 0.00 42.46 38.75 2yuj s ILE 179 CO -0.04 -1.58 0.22 -0.63 0.24 0.00 0.00 174.94 173.15 2yuj s ILE 180 N 2.35 2.93 -0.83 8.37 1.01 -1.26 -4.76 121.20 129.01 2yuj s ILE 180 Ca 0.38 -2.59 -0.02 0.00 0.00 0.00 0.00 60.65 58.42 2yuj s ILE 180 Cb -0.04 -3.03 -0.03 0.00 0.01 0.00 0.00 42.46 39.38 2yuj s ILE 180 CO -0.05 -0.72 0.76 -0.62 0.00 0.00 0.00 174.94 174.30 2yuj n GLU 181 N 3.96 -1.62 -3.60 2.79 1.02 -1.26 -5.05 120.64 116.89 2yuj n GLU 181 Ca 0.03 1.22 -0.13 0.00 -0.02 0.00 0.00 57.16 58.25 2yuj n GLU 181 Cb 0.39 -5.64 -0.05 0.00 -0.02 0.00 0.00 31.44 26.12 2yuj n GLU 181 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2yuj s ASP 183 N -2.00 6.04 0.06 0.00 2.15 -1.26 -5.07 116.67 116.58 2yuj s ASP 183 Ca -0.05 0.29 0.01 0.00 0.43 0.00 0.00 52.55 53.24 2yuj s ASP 183 Cb -0.01 -1.97 -0.03 0.00 -0.30 0.00 0.00 42.92 40.61 2yuj s ASP 183 CO -0.02 0.31 -0.06 0.00 -0.17 0.00 0.00 175.17 175.23 2yuj s MET 184 N -0.43 0.62 -1.35 4.34 0.23 -1.26 -4.84 119.30 116.61 2yuj s MET 184 Ca 0.11 -1.03 -0.16 0.00 -1.03 0.00 0.00 55.69 53.57 2yuj s MET 184 Cb -0.12 -0.11 0.07 0.00 -1.53 0.00 0.00 34.83 33.14 2yuj s MET 184 CO 0.02 -0.02 1.91 -1.71 -2.03 0.00 0.00 175.02 173.19 2yuj n ASN 185 N 0.69 4.57 -4.69 -1.18 5.15 0.56 -4.93 115.26 115.43 2yuj n ASN 185 Ca -0.17 -2.90 -0.42 0.00 -0.60 0.00 0.00 54.58 50.48 2yuj n ASN 185 Cb 0.58 -1.70 -0.03 0.00 -0.53 0.00 0.00 39.78 38.10 2yuj n ASN 185 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2yuj s VAL 186 N 3.63 2.95 0.37 3.44 1.01 -1.26 -3.79 120.40 126.76 2yuj s VAL 186 Ca 0.51 0.46 0.08 0.00 0.00 0.00 0.00 61.98 63.03 2yuj s VAL 186 Cb 0.07 -3.30 -0.05 0.00 0.00 0.00 0.00 36.38 33.10 2yuj s VAL 186 CO 0.01 0.00 0.09 -1.81 0.00 0.00 0.00 175.10 173.40 2yuj s ASP 187 N 2.23 4.31 -0.12 3.32 1.11 -0.83 -4.98 116.67 121.72 2yuj s ASP 187 Ca 0.74 -1.02 0.03 0.00 0.18 0.00 0.00 52.55 52.48 2yuj s ASP 187 Cb -0.41 -0.53 0.01 0.00 1.07 0.00 0.00 42.92 43.06 2yuj s ASP 187 CO 0.32 -0.37 -0.22 -0.36 1.18 0.00 0.00 175.17 175.72 2yuj s PHE 188 N -2.55 2.55 -0.64 4.23 0.08 -1.26 -2.70 117.98 117.69 2yuj s PHE 188 Ca 0.37 -1.16 -0.16 0.00 0.12 0.00 0.00 56.93 56.11 2yuj s PHE 188 Cb 0.02 -1.72 0.15 0.00 -0.57 0.00 0.00 43.02 40.90 2yuj s PHE 188 CO 0.21 -0.50 0.62 0.34 -0.10 0.00 0.00 175.22 175.79 2yuj s ASP 189 N 0.58 6.37 0.00 1.36 2.15 0.11 -4.92 116.67 122.31 2yuj s ASP 189 Ca -0.13 -2.01 0.00 0.00 0.43 0.00 0.00 52.55 50.84 2yuj s ASP 189 Cb -0.17 -2.23 0.00 0.00 -0.30 0.00 0.00 42.92 40.22 2yuj s ASP 189 CO 0.04 -0.82 0.00 0.00 -0.17 0.00 0.00 175.17 174.22