#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yax n LYS 46 N 0.00 0.62 -0.16 0.11 2.85 -1.26 -4.20 118.16 116.12 1yax n LYS 46 Ca 0.00 0.19 -0.11 0.00 -1.05 0.00 0.00 58.31 57.34 1yax n LYS 46 Cb 0.00 -1.50 -0.00 0.00 -0.65 0.00 0.00 35.03 32.87 1yax n LYS 46 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1yax h THR 47 N -0.39 1.27 0.00 0.58 1.03 -2.06 -2.77 112.91 110.57 1yax h THR 47 Ca -0.63 -1.24 -0.11 0.00 -0.01 0.00 0.00 66.41 64.43 1yax h THR 47 Cb 1.78 1.09 -0.02 0.00 -1.07 0.00 0.00 68.15 69.94 1yax h THR 47 CO -0.22 0.43 -0.52 0.00 -0.01 0.00 0.00 175.52 175.20 1yax h THR 48 N 0.76 1.16 0.10 0.00 1.03 -2.00 -2.97 112.91 110.99 1yax h THR 48 Ca 0.12 -1.91 -0.00 0.00 -0.01 0.00 0.00 66.41 64.60 1yax h THR 48 Cb 0.66 2.10 0.00 0.00 -1.07 0.00 0.00 68.15 69.84 1yax h THR 48 CO 0.05 0.51 -0.05 0.15 -0.01 0.00 0.00 175.52 176.16 1yax h PHE 49 N 0.00 -0.13 -0.55 0.00 3.57 -1.69 -0.55 116.94 117.60 1yax h PHE 49 Ca -0.01 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.63 1yax h PHE 49 Cb 1.06 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.81 1yax h PHE 49 CO 0.00 0.09 0.39 0.00 -2.23 0.00 0.00 178.31 176.55 1yax h ARG 50 N -0.32 0.14 0.02 1.11 2.47 -1.46 -1.36 114.38 114.99 1yax h ARG 50 Ca -0.01 -0.01 -0.04 0.00 -1.26 0.00 0.00 59.98 58.66 1yax h ARG 50 Cb 0.27 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.56 1yax h ARG 50 CO 0.02 0.10 -0.18 1.37 0.56 0.00 0.00 179.97 181.84 1yax h LEU 51 N 0.15 0.12 -0.19 3.04 8.10 -1.29 -2.65 115.31 122.58 1yax h LEU 51 Ca 0.26 -0.93 -0.22 0.00 0.11 0.00 0.00 57.88 57.10 1yax h LEU 51 Cb 0.84 -0.04 0.00 0.00 -0.44 0.00 0.00 40.66 41.03 1yax h LEU 51 CO -0.04 1.04 -0.93 -0.07 -4.11 0.00 0.00 178.44 174.33 1yax h LEU 52 N -0.79 0.50 -0.10 0.17 3.38 -0.94 -2.33 115.31 115.21 1yax h LEU 52 Ca -0.03 -0.40 -0.18 0.00 0.09 0.00 0.00 57.88 57.36 1yax h LEU 52 Cb 1.09 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 41.69 1yax h LEU 52 CO 0.03 1.20 -0.62 -0.09 0.09 0.00 0.00 178.44 179.05 1yax h ARG 53 N 0.22 0.59 -0.60 1.13 9.65 -1.42 -1.65 114.38 122.31 1yax h ARG 53 Ca -0.07 -0.51 0.05 0.00 -1.10 0.00 0.00 59.98 58.35 1yax h ARG 53 Cb 1.56 0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 30.20 1yax h ARG 53 CO 0.16 1.13 0.32 0.78 2.80 0.00 0.00 179.97 185.16 1yax h GLY 54 N 0.22 0.86 0.94 2.80 0.00 -1.51 -0.72 103.07 105.66 1yax h GLY 54 Ca -0.05 -0.22 -0.00 0.00 0.00 0.00 0.00 47.33 47.06 1yax h GLY 54 CO 0.13 0.14 0.07 -2.09 0.00 0.00 0.00 176.54 174.78 1yax h GLU 55 N 0.60 0.16 -0.95 4.80 4.57 -1.42 -1.52 114.58 120.83 1yax h GLU 55 Ca 0.27 -0.02 0.01 0.00 -1.18 0.00 0.00 59.36 58.44 1yax h GLU 55 Cb 0.16 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.67 1yax h GLU 55 CO -0.17 0.17 0.63 1.03 -1.18 0.00 0.00 179.01 179.50 1yax h SER 56 N 0.10 1.09 -0.49 1.04 0.87 -1.02 -1.75 113.55 113.40 1yax h SER 56 Ca 0.04 -0.03 -0.06 0.00 -1.23 0.00 0.00 61.79 60.51 1yax h SER 56 Cb 0.06 -0.27 -0.02 0.00 -0.44 0.00 0.00 62.40 61.72 1yax h SER 56 CO -0.01 0.79 0.09 0.78 -0.53 0.00 0.00 176.83 177.95 1yax h ASN 57 N 1.29 0.82 -0.65 6.23 2.35 -1.03 -1.99 115.58 122.60 1yax h ASN 57 Ca 0.35 -0.17 -0.07 0.00 -0.55 0.00 0.00 56.30 55.87 1yax h ASN 57 Cb -0.15 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 37.98 1yax h ASN 57 CO -0.08 0.83 0.16 0.25 -1.65 0.00 0.00 177.43 176.94 1yax h LEU 58 N 0.82 1.00 -0.53 1.61 5.85 -0.44 -1.82 115.31 121.81 1yax h LEU 58 Ca 0.17 -0.21 -0.13 0.00 0.84 0.00 0.00 57.88 58.56 1yax h LEU 58 Cb 0.36 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1yax h LEU 58 CO 0.01 0.96 -0.62 -0.26 -0.34 0.00 0.00 178.44 178.20 1yax h PHE 59 N 1.01 0.00 -0.63 1.25 -1.00 -1.22 -2.51 116.94 113.83 1yax h PHE 59 Ca 0.21 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.94 1yax h PHE 59 Cb 0.36 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.89 1yax h PHE 59 CO 0.03 0.62 0.20 -0.92 -1.61 0.00 0.00 178.31 176.62 1yax h TYR 60 N 0.00 0.98 -0.69 -0.55 5.03 -0.80 -0.55 116.97 120.40 1yax h TYR 60 Ca -0.01 -0.08 -0.07 0.00 2.58 0.00 0.00 58.73 61.15 1yax h TYR 60 Cb 1.23 -0.29 -0.03 0.00 1.55 0.00 0.00 36.73 39.19 1yax h TYR 60 CO 0.00 0.79 0.17 1.15 -1.32 0.00 0.00 178.16 178.95 1yax h THR 61 N 0.93 1.26 -0.00 1.81 2.02 -1.15 -3.12 112.91 114.66 1yax h THR 61 Ca 0.21 -0.96 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1yax h THR 61 Cb 0.27 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 1yax h THR 61 CO -0.01 0.37 -0.06 0.18 0.37 0.00 0.00 175.52 176.37 1yax n LEU 62 N -4.26 0.08 -4.76 2.58 4.77 -0.94 -4.82 117.00 109.65 1yax n LEU 62 Ca 0.05 0.39 -0.40 0.00 -0.03 0.00 0.00 56.01 56.01 1yax n LEU 62 Cb 0.25 -0.42 -0.05 0.00 -2.33 0.00 0.00 43.42 40.87 1yax n LEU 62 CO 0.42 0.02 0.53 0.00 -1.33 0.00 0.00 177.39 177.03 1yax s ALA 63 N -2.89 3.38 -0.00 -1.18 0.00 -0.26 -3.70 121.76 117.10 1yax s ALA 63 Ca 0.17 0.41 0.03 0.00 0.00 0.00 0.00 51.96 52.57 1yax s ALA 63 Cb 0.19 -3.06 -0.01 0.00 0.00 0.00 0.00 23.12 20.25 1yax s ALA 63 CO 0.53 0.16 -0.09 0.15 0.00 0.00 0.00 175.76 176.52 1yax s LYS 64 N -0.64 0.71 -0.46 0.00 3.01 -1.04 -5.00 119.74 116.31 1yax s LYS 64 Ca 0.39 -0.33 -0.05 0.00 -1.01 0.00 0.00 55.97 54.97 1yax s LYS 64 Cb -0.23 -0.68 0.12 0.00 -1.01 0.00 0.00 37.83 36.03 1yax s LYS 64 CO 0.27 0.19 0.28 -0.46 0.51 0.00 0.00 175.35 176.13 1yax s TRP 65 N -0.24 3.53 -0.03 3.18 -0.11 -1.26 -1.88 118.94 122.12 1yax s TRP 65 Ca 0.03 -2.31 0.03 0.00 1.22 0.00 0.00 56.10 55.08 1yax s TRP 65 Cb -0.04 -3.31 0.00 0.00 -1.50 0.00 0.00 33.47 28.63 1yax s TRP 65 CO -0.00 -0.96 -0.12 -1.21 -4.62 0.00 0.00 176.95 170.03 1yax s GLU 66 N 1.03 1.26 -1.34 5.86 0.41 -1.04 -4.78 118.70 120.10 1yax s GLU 66 Ca 0.09 -0.42 -0.08 0.00 -0.41 0.00 0.00 54.97 54.15 1yax s GLU 66 Cb -0.23 -1.14 0.01 0.00 -1.78 0.00 0.00 34.13 30.99 1yax s GLU 66 CO -0.03 0.17 1.15 0.09 -0.49 0.00 0.00 175.26 176.14 1yax n ASN 67 N 3.22 -5.61 -2.52 -0.19 4.13 -1.26 -2.96 115.26 110.08 1yax n ASN 67 Ca -0.18 -0.57 -0.18 0.00 1.68 0.00 0.00 54.58 55.34 1yax n ASN 67 Cb 0.54 -4.99 -0.00 0.00 -1.54 0.00 0.00 39.78 33.78 1yax n ASN 67 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1yax n ASN 68 N -3.03 -5.02 -3.70 6.41 3.02 -1.26 -4.96 115.26 106.72 1yax n ASN 68 Ca -0.04 0.03 -0.14 0.00 -0.03 0.00 0.00 54.58 54.40 1yax n ASN 68 Cb 0.58 -4.19 -0.08 0.00 -0.61 0.00 0.00 39.78 35.47 1yax n ASN 68 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 1yax s LYS 69 N -5.14 0.73 0.51 3.52 0.00 -1.16 -5.17 119.74 113.02 1yax s LYS 69 Ca 0.05 0.08 -0.14 0.00 0.00 0.00 0.00 55.97 55.96 1yax s LYS 69 Cb -0.02 0.33 -0.07 0.00 0.00 0.00 0.00 37.83 38.07 1yax s LYS 69 CO 0.06 -0.19 0.94 -1.50 0.00 0.00 0.00 175.35 174.66 1yax s ILE 70 N -0.96 4.62 -0.24 3.79 2.07 -1.26 -2.50 121.20 126.71 1yax s ILE 70 Ca -0.10 1.02 -0.06 0.00 -1.41 0.00 0.00 60.65 60.10 1yax s ILE 70 Cb -0.04 -3.75 0.12 0.00 0.13 0.00 0.00 42.46 38.93 1yax s ILE 70 CO 0.05 -0.73 0.49 -0.94 -1.91 0.00 0.00 174.94 171.89 1yax s SER 71 N -3.29 -0.51 -0.17 4.50 1.04 -0.79 -4.96 113.70 109.52 1yax s SER 71 Ca 0.56 0.96 -0.05 0.00 0.48 0.00 0.00 55.95 57.90 1yax s SER 71 Cb -0.10 1.63 -0.03 0.00 0.10 0.00 0.00 66.02 67.62 1yax s SER 71 CO 0.35 -0.25 0.01 0.68 0.98 0.00 0.00 173.24 175.01 1yax s VAL 72 N 2.70 4.23 -0.13 5.02 -7.23 -1.26 -2.49 120.40 121.24 1yax s VAL 72 Ca 0.03 -0.23 -0.04 0.00 -1.81 0.00 0.00 61.98 59.93 1yax s VAL 72 Cb -0.13 -2.89 -0.04 0.00 0.56 0.00 0.00 36.38 33.89 1yax s VAL 72 CO -0.16 0.47 0.03 -1.61 -0.31 0.00 0.00 175.10 173.52 1yax s GLU 73 N 0.50 3.44 0.00 4.82 8.01 -1.24 -5.06 118.70 129.16 1yax s GLU 73 Ca -0.01 -0.37 0.00 0.00 0.01 0.00 0.00 54.97 54.61 1yax s GLU 73 Cb -0.14 -2.99 0.00 0.00 -4.31 0.00 0.00 34.13 26.70 1yax s GLU 73 CO 0.02 0.52 0.00 1.28 0.01 0.00 0.00 175.26 177.09 1yax n LEU 74 N 2.73 0.00 -4.12 1.80 4.77 -1.26 -4.95 117.00 115.96 1yax n LEU 74 Ca -0.18 0.00 -0.43 0.00 -0.03 0.00 0.00 56.01 55.37 1yax n LEU 74 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1yax n LEU 74 CO 0.31 0.00 1.77 -0.81 -1.33 0.00 0.00 177.39 177.34 1yax n PRO 83 N 0.00 3.47 -4.18 3.23 -0.04 -1.26 -5.30 135.00 130.92 1yax n PRO 83 Ca 0.00 -3.60 -0.11 0.00 -0.04 0.00 0.00 63.50 59.75 1yax n PRO 83 Cb 0.00 -3.01 -0.10 0.00 -0.04 0.00 0.00 33.50 30.35 1yax n PRO 83 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1yax s THR 84 N 1.14 0.10 -0.03 0.52 -4.23 -1.26 -1.79 115.64 110.09 1yax s THR 84 Ca 0.42 -1.96 0.03 0.00 -1.18 0.00 0.00 61.69 59.00 1yax s THR 84 Cb 0.05 -2.28 0.00 0.00 1.34 0.00 0.00 72.50 71.61 1yax s THR 84 CO 0.00 -0.24 -0.10 -0.32 -0.54 0.00 0.00 174.62 173.43 1yax s MET 85 N -4.09 1.01 -0.10 3.99 1.75 -0.86 -4.90 119.30 116.09 1yax s MET 85 Ca 0.31 -0.33 0.02 0.00 -1.25 0.00 0.00 55.69 54.45 1yax s MET 85 Cb 0.07 -0.93 -0.01 0.00 2.84 0.00 0.00 34.83 36.79 1yax s MET 85 CO 0.07 0.13 -0.17 0.99 -0.65 0.00 0.00 175.02 175.39 1yax s THR 86 N 0.15 2.76 0.09 10.11 2.01 -1.26 -1.55 115.64 127.96 1yax s THR 86 Ca -0.03 -0.79 0.09 0.00 0.31 0.00 0.00 61.69 61.28 1yax s THR 86 Cb -0.08 -2.11 -0.04 0.00 0.01 0.00 0.00 72.50 70.28 1yax s THR 86 CO 0.00 0.55 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.51 1yax s LEU 87 N 0.04 2.50 -0.07 4.42 1.02 0.57 -1.43 118.68 125.74 1yax s LEU 87 Ca -0.06 -0.58 0.03 0.00 0.02 0.00 0.00 54.13 53.53 1yax s LEU 87 Cb -0.15 -1.42 0.01 0.00 0.02 0.00 0.00 46.19 44.65 1yax s LEU 87 CO 0.05 0.21 -0.16 -0.63 0.02 0.00 0.00 176.35 175.84 1yax s ILE 88 N -1.02 1.39 0.43 -0.59 1.01 0.17 -0.73 121.20 121.86 1yax s ILE 88 Ca 0.15 -0.64 0.06 0.00 0.00 0.00 0.00 60.65 60.23 1yax s ILE 88 Cb -0.10 -1.24 -0.05 0.00 0.01 0.00 0.00 42.46 41.07 1yax s ILE 88 CO 0.07 0.41 0.07 -0.31 0.00 0.00 0.00 174.94 175.18 1yax s TYR 89 N 0.53 2.39 0.54 3.97 1.51 0.25 -0.49 117.35 126.05 1yax s TYR 89 Ca -0.15 -0.71 0.07 0.00 -1.01 0.00 0.00 57.07 55.27 1yax s TYR 89 Cb -0.16 -1.81 0.04 0.00 -0.11 0.00 0.00 41.96 39.93 1yax s TYR 89 CO 0.05 0.29 0.49 0.16 -1.11 0.00 0.00 175.55 175.43 1yax s ASP 90 N -3.82 4.78 0.45 2.29 -4.77 -0.31 -2.69 116.67 112.60 1yax s ASP 90 Ca 0.31 -1.11 0.14 0.00 -3.30 0.00 0.00 52.55 48.60 1yax s ASP 90 Cb 0.06 0.29 1.02 0.00 -1.09 0.00 0.00 42.92 43.21 1yax s ASP 90 CO 0.17 -1.11 2.02 1.05 0.70 0.00 0.00 175.17 177.99 1yax h GLU 91 N 0.65 0.06 0.00 2.11 -0.00 -1.90 -1.62 114.58 113.88 1yax h GLU 91 Ca -0.36 -0.01 -0.04 0.00 -0.00 0.00 0.00 59.36 58.96 1yax h GLU 91 Cb 1.30 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 30.03 1yax h GLU 91 CO 0.53 0.18 -0.17 1.79 -0.00 0.00 0.00 179.01 181.34 1yax h THR 92 N 0.06 0.38 0.00 -1.06 1.35 -1.96 -3.47 112.91 108.20 1yax h THR 92 Ca 0.01 -1.07 0.00 0.00 -0.55 0.00 0.00 66.41 64.80 1yax h THR 92 Cb 0.24 1.80 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 1yax h THR 92 CO 0.02 0.17 0.00 0.61 -0.25 0.00 0.00 175.52 176.06 1yax n GLY 93 N 0.36 0.78 3.79 5.82 0.00 -0.61 -5.11 105.19 110.22 1yax n GLY 93 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1yax n GLY 93 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yax s LYS 94 N -0.46 3.79 -0.22 1.61 0.00 -1.26 -4.80 119.74 118.40 1yax s LYS 94 Ca 0.00 1.42 -0.19 0.00 0.00 0.00 0.00 55.97 57.20 1yax s LYS 94 Cb 0.00 -2.14 -0.03 0.00 0.00 0.00 0.00 37.83 35.66 1yax s LYS 94 CO 0.00 -0.45 0.55 -1.17 0.00 0.00 0.00 175.35 174.28 1yax s LEU 95 N -3.41 4.12 -0.01 2.77 2.96 -1.26 -1.17 118.68 122.67 1yax s LEU 95 Ca 0.67 0.68 0.21 0.00 -0.22 0.00 0.00 54.13 55.47 1yax s LEU 95 Cb -0.18 -2.76 -0.27 0.00 0.50 0.00 0.00 46.19 43.49 1yax s LEU 95 CO 0.22 -0.24 0.53 0.18 -1.32 0.00 0.00 176.35 175.72 1yax n LEU 96 N 5.10 0.18 -3.64 -0.68 4.77 0.36 -4.97 117.00 118.11 1yax n LEU 96 Ca -0.03 0.07 -0.06 0.00 -0.03 0.00 0.00 56.01 55.95 1yax n LEU 96 Cb 0.50 0.06 -0.07 0.00 -2.33 0.00 0.00 43.42 41.58 1yax n LEU 96 CO 0.42 0.04 0.77 0.86 -1.33 0.00 0.00 177.39 178.16 1yax s TRP 97 N -3.33 -0.45 0.02 -1.77 -0.00 -1.05 -4.87 118.94 107.49 1yax s TRP 97 Ca -0.07 1.03 0.03 0.00 -0.00 0.00 0.00 56.10 57.09 1yax s TRP 97 Cb 0.12 0.37 -0.02 0.00 -0.00 0.00 0.00 33.47 33.94 1yax s TRP 97 CO 0.88 -0.22 -0.08 -0.08 -0.00 0.00 0.00 176.95 177.44 1yax s THR 98 N 0.53 0.63 0.10 5.86 -1.32 -1.26 -0.66 115.64 119.52 1yax s THR 98 Ca 0.00 -0.73 0.34 0.00 -1.21 0.00 0.00 61.69 60.09 1yax s THR 98 Cb -0.05 -0.61 0.39 0.00 -1.51 0.00 0.00 72.50 70.73 1yax s THR 98 CO -0.10 -0.10 1.99 -0.61 -2.21 0.00 0.00 174.62 173.60 1yax h GLN 99 N 5.19 0.00 0.00 7.08 4.15 -1.63 -3.44 115.11 126.46 1yax h GLN 99 Ca -0.33 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.09 1yax h GLN 99 Cb 1.19 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.88 1yax h GLN 99 CO 0.45 0.00 0.00 0.54 -1.93 0.00 0.00 178.83 177.89 1yax n ARG 100 N -3.06 2.39 -2.71 1.69 1.74 -1.26 -5.00 116.66 110.46 1yax n ARG 100 Ca 0.01 0.00 -0.07 0.00 -0.77 0.00 0.00 57.85 57.01 1yax n ARG 100 Cb 0.29 0.00 0.10 0.00 -1.02 0.00 0.00 32.46 31.83 1yax n ARG 100 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1yax n ASN 101 N 0.00 -2.01 -4.37 0.55 3.02 -1.26 -5.13 115.26 106.07 1yax n ASN 101 Ca 0.00 -2.89 -0.42 0.00 -0.03 0.00 0.00 54.58 51.24 1yax n ASN 101 Cb 0.00 1.40 -0.10 0.00 -0.61 0.00 0.00 39.78 40.47 1yax n ASN 101 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1yax s ILE 102 N 0.21 4.76 0.29 2.41 1.01 -1.26 -4.99 121.20 123.64 1yax s ILE 102 Ca 0.21 -0.99 0.02 0.00 0.00 0.00 0.00 60.65 59.89 1yax s ILE 102 Cb 0.33 -3.75 0.10 0.00 0.01 0.00 0.00 42.46 39.14 1yax s ILE 102 CO -0.07 -0.38 1.76 1.55 0.00 0.00 0.00 174.94 177.79 1yax h PRO 103 N 8.53 0.55 -0.12 2.79 0.13 -2.00 -2.68 132.00 139.21 1yax h PRO 103 Ca -0.26 -0.17 -0.11 0.00 -0.87 0.00 0.00 66.00 64.59 1yax h PRO 103 Cb 1.10 -0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.17 1yax h PRO 103 CO 0.74 0.68 -0.39 0.11 -0.23 0.00 0.00 178.00 178.92 1yax h TRP 104 N 0.50 0.31 -0.02 1.56 5.08 -2.00 -2.48 115.95 118.90 1yax h TRP 104 Ca 0.09 -0.08 -0.01 0.00 1.08 0.00 0.00 58.89 59.97 1yax h TRP 104 Cb 0.55 -0.07 0.00 0.00 -3.00 0.00 0.00 29.16 26.64 1yax h TRP 104 CO 0.02 0.62 -0.03 1.25 -1.28 0.00 0.00 178.44 179.02 1yax h LEU 105 N 0.22 0.06 -0.96 0.11 6.46 -1.93 -2.22 115.31 117.06 1yax h LEU 105 Ca 0.02 -0.56 0.18 0.00 -0.12 0.00 0.00 57.88 57.40 1yax h LEU 105 Cb 0.80 -0.02 -0.10 0.00 -0.73 0.00 0.00 40.66 40.61 1yax h LEU 105 CO 0.06 0.61 0.55 0.40 -0.62 0.00 0.00 178.44 179.45 1yax h ILE 106 N -0.48 0.71 -0.06 4.05 2.04 -1.48 -2.48 117.51 119.81 1yax h ILE 106 Ca 0.00 -0.25 -0.18 0.00 1.00 0.00 0.00 64.86 65.43 1yax h ILE 106 Cb 0.60 -0.07 0.01 0.00 -0.74 0.00 0.00 36.82 36.61 1yax h ILE 106 CO 0.01 0.13 -0.68 0.11 0.00 0.00 0.00 178.15 177.72 1yax h LYS 107 N 0.72 0.57 -0.04 2.37 1.57 -1.43 -3.22 116.57 117.11 1yax h LYS 107 Ca 0.55 -0.53 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1yax h LYS 107 Cb 0.83 0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.27 1yax h LYS 107 CO -0.38 1.15 0.09 0.66 -0.57 0.00 0.00 179.45 180.40 1yax h SER 108 N 0.17 0.00 -2.36 0.86 4.64 -0.93 -3.38 113.55 112.56 1yax h SER 108 Ca -0.07 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.72 1yax h SER 108 Cb 1.35 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.38 1yax h SER 108 CO 0.14 0.00 1.19 -0.63 -0.87 0.00 0.00 176.83 176.66 1yax s ILE 109 N -4.33 3.59 0.16 0.95 -1.09 -1.13 -4.97 121.20 114.39 1yax s ILE 109 Ca -0.05 0.41 -0.31 0.00 -2.23 0.00 0.00 60.65 58.47 1yax s ILE 109 Cb 0.13 -4.37 -0.09 0.00 -1.58 0.00 0.00 42.46 36.56 1yax s ILE 109 CO 0.44 -1.25 1.42 -1.10 -1.23 0.00 0.00 174.94 173.22 1yax s GLN 110 N 6.16 4.30 0.51 2.79 1.11 -1.26 -4.91 119.66 128.37 1yax s GLN 110 Ca 0.54 2.17 0.34 0.00 0.01 0.00 0.00 55.36 58.41 1yax s GLN 110 Cb -0.11 -3.20 1.65 0.00 -1.01 0.00 0.00 33.01 30.35 1yax s GLN 110 CO 0.21 -0.44 2.03 -1.00 0.01 0.00 0.00 175.29 176.09 1yax h PRO 111 N 6.31 0.00 -0.08 2.91 0.13 -1.93 -1.13 132.00 138.21 1yax h PRO 111 Ca -0.43 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.57 1yax h PRO 111 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1yax h PRO 111 CO 0.85 0.00 -0.54 0.93 -0.23 0.00 0.00 178.00 179.01 1yax h GLU 112 N 0.00 0.23 -0.16 0.86 3.07 -2.02 -3.12 114.58 113.44 1yax h GLU 112 Ca 0.00 -0.14 0.05 0.00 -0.50 0.00 0.00 59.36 58.77 1yax h GLU 112 Cb 0.23 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.14 1yax h GLU 112 CO 0.00 0.71 0.16 -1.49 -1.40 0.00 0.00 179.01 176.98 1yax h TRP 113 N 0.18 0.00 0.00 4.33 6.55 -1.57 -2.52 115.95 122.91 1yax h TRP 113 Ca 0.00 0.00 -0.08 0.00 0.95 0.00 0.00 58.89 59.76 1yax h TRP 113 Cb 1.00 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.29 1yax h TRP 113 CO 0.02 0.00 -0.39 -0.07 -1.05 0.00 0.00 178.44 176.94 1yax h LEU 114 N 0.00 0.00 -1.65 -4.49 3.38 -1.66 -3.25 115.31 107.64 1yax h LEU 114 Ca 0.08 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1yax h LEU 114 Cb 0.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1yax h LEU 114 CO -0.00 0.39 -0.20 0.11 0.09 0.00 0.00 178.44 178.84 1yax h LYS 115 N 0.00 0.00 -5.22 1.13 1.79 -1.62 -3.45 116.57 109.20 1yax h LYS 115 Ca -0.00 0.00 -0.37 0.00 -2.18 0.00 0.00 60.65 58.09 1yax h LYS 115 Cb 1.01 0.00 -0.14 0.00 -1.58 0.00 0.00 32.23 31.51 1yax h LYS 115 CO 0.05 0.20 -0.71 0.99 -1.08 0.00 0.00 179.45 178.90 1yax s THR 116 N -4.21 1.32 0.24 -0.16 2.01 -1.23 -5.08 115.64 108.53 1yax s THR 116 Ca -0.03 -2.10 -0.30 0.00 0.31 0.00 0.00 61.69 59.58 1yax s THR 116 Cb 0.14 -2.00 -0.09 0.00 0.01 0.00 0.00 72.50 70.56 1yax s THR 116 CO 0.64 -0.63 1.26 0.20 -0.69 0.00 0.00 174.62 175.40 1yax s ASN 117 N -3.24 6.96 0.00 3.53 0.01 -1.26 -4.62 114.94 116.32 1yax s ASN 117 Ca 0.20 2.41 0.00 0.00 -0.71 0.00 0.00 52.86 54.76 1yax s ASN 117 Cb 0.02 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 39.06 1yax s ASN 117 CO 0.04 -0.44 0.00 0.61 -1.51 0.00 0.00 177.10 175.80 1yax n GLY 118 N 1.83 -0.78 3.09 0.66 0.00 -1.00 -5.01 105.19 103.99 1yax n GLY 118 Ca 0.03 -1.01 -0.27 0.00 0.00 0.00 0.00 46.02 44.78 1yax n GLY 118 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yax s PHE 119 N -2.00 1.82 0.41 1.61 0.08 -1.26 -1.16 117.98 117.48 1yax s PHE 119 Ca 0.00 -0.70 0.04 0.00 0.12 0.00 0.00 56.93 56.39 1yax s PHE 119 Cb 0.00 -1.28 -0.02 0.00 -0.57 0.00 0.00 43.02 41.15 1yax s PHE 119 CO 0.00 -0.32 0.14 -1.01 -0.10 0.00 0.00 175.22 173.93 1yax s HIS 120 N 0.54 1.78 0.06 0.36 3.76 0.20 -4.98 115.29 117.00 1yax s HIS 120 Ca -0.16 -1.33 0.05 0.00 -0.15 0.00 0.00 55.06 53.48 1yax s HIS 120 Cb -0.16 -1.13 -0.03 0.00 1.11 0.00 0.00 32.58 32.37 1yax s HIS 120 CO 0.05 -0.35 -0.15 -1.21 -0.85 0.00 0.00 174.74 172.24 1yax s GLU 121 N -3.68 0.94 -0.09 1.40 2.02 -1.26 -0.93 118.70 117.10 1yax s GLU 121 Ca 0.24 -0.87 0.02 0.00 0.02 0.00 0.00 54.97 54.38 1yax s GLU 121 Cb 0.02 -0.98 0.01 0.00 0.10 0.00 0.00 34.13 33.29 1yax s GLU 121 CO 0.15 0.23 -0.13 0.96 0.02 0.00 0.00 175.26 176.49 1yax s ILE 122 N -1.01 1.30 -0.12 -1.63 -5.25 -0.11 -4.94 121.20 109.43 1yax s ILE 122 Ca 0.01 -0.54 -0.13 0.00 -0.99 0.00 0.00 60.65 59.00 1yax s ILE 122 Cb -0.09 -1.20 -0.05 0.00 2.95 0.00 0.00 42.46 44.07 1yax s ILE 122 CO 0.02 0.40 0.29 -1.61 -1.79 0.00 0.00 174.94 172.24 1yax s GLU 123 N 0.91 4.03 0.33 0.37 2.02 -1.26 -0.68 118.70 124.41 1yax s GLU 123 Ca -0.09 0.11 -0.03 0.00 0.02 0.00 0.00 54.97 54.98 1yax s GLU 123 Cb -0.15 -3.34 0.00 0.00 0.10 0.00 0.00 34.13 30.74 1yax s GLU 123 CO 0.00 0.44 0.46 -0.08 0.02 0.00 0.00 175.26 176.10 1yax s THR 124 N -0.15 0.00 0.73 3.63 -1.32 0.37 -5.00 115.64 113.90 1yax s THR 124 Ca 0.18 -1.60 -0.11 0.00 -1.21 0.00 0.00 61.69 58.94 1yax s THR 124 Cb -0.14 -2.59 0.03 0.00 -1.51 0.00 0.00 72.50 68.29 1yax s THR 124 CO 0.06 0.00 1.10 0.54 -2.21 0.00 0.00 174.62 174.11 1yax s ASN 125 N -3.22 5.24 0.43 8.08 6.03 -1.26 0.53 114.94 130.77 1yax s ASN 125 Ca 0.30 1.16 0.15 0.00 -1.03 0.00 0.00 52.86 53.45 1yax s ASN 125 Cb -0.00 -1.94 0.96 0.00 -3.03 0.00 0.00 41.25 37.24 1yax s ASN 125 CO 0.19 -1.47 1.95 1.62 -2.03 0.00 0.00 177.10 177.35 1yax h VAL 126 N -0.75 1.11 0.00 3.54 3.04 -1.77 -2.65 116.25 118.78 1yax h VAL 126 Ca -0.45 -0.83 -0.10 0.00 -1.01 0.00 0.00 66.70 64.31 1yax h VAL 126 Cb 1.26 1.46 -0.01 0.00 -2.01 0.00 0.00 31.29 31.98 1yax h VAL 126 CO 0.63 0.23 -0.46 0.44 -1.01 0.00 0.00 177.57 177.40 1yax h ASP 127 N 0.00 0.00 0.58 3.17 5.19 -1.89 -2.15 116.42 121.32 1yax h ASP 127 Ca -0.00 0.00 -0.28 0.00 -0.62 0.00 0.00 57.03 56.13 1yax h ASP 127 Cb 0.44 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.93 1yax h ASP 127 CO 0.03 0.46 -1.45 0.00 -3.12 0.00 0.00 179.24 175.16 1yax h ALA 128 N 1.54 0.40 -0.23 3.45 0.00 -1.87 -2.64 119.26 119.91 1yax h ALA 128 Ca -0.00 -1.14 -0.12 0.00 0.00 0.00 0.00 54.91 53.64 1yax h ALA 128 Cb 1.02 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1yax h ALA 128 CO 0.06 1.27 -0.38 1.15 0.00 0.00 0.00 179.25 181.35 1yax h THR 129 N 0.04 1.30 -0.20 0.00 2.02 -1.52 -2.13 112.91 112.42 1yax h THR 129 Ca -0.20 -1.52 -0.13 0.00 0.77 0.00 0.00 66.41 65.33 1yax h THR 129 Cb 1.96 1.53 -0.01 0.00 -1.74 0.00 0.00 68.15 69.89 1yax h THR 129 CO 0.14 0.48 -0.43 0.28 0.37 0.00 0.00 175.52 176.36 1yax h SER 130 N 0.44 0.50 1.03 4.18 0.02 -1.42 -2.93 113.55 115.36 1yax h SER 130 Ca 0.04 -0.23 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 1yax h SER 130 Cb 0.86 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.26 1yax h SER 130 CO 0.07 0.87 -0.16 1.07 -1.14 0.00 0.00 176.83 177.54 1yax n THR 131 N -4.01 0.20 -0.04 -2.27 5.66 -1.00 -3.55 114.28 109.28 1yax n THR 131 Ca -0.02 -0.11 -0.16 0.00 -3.05 0.00 0.00 64.05 60.71 1yax n THR 131 Cb 0.52 -0.35 -0.07 0.00 -1.55 0.00 0.00 70.33 68.88 1yax n THR 131 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 175.07 172.27 1yax h LEU 132 N 0.00 0.77-10.39 1.09 5.85 -1.19 -3.46 115.31 107.98 1yax h LEU 132 Ca 0.00 -0.61 -0.48 0.00 0.84 0.00 0.00 57.88 57.63 1yax h LEU 132 Cb 0.59 -0.23 0.05 0.00 0.37 0.00 0.00 40.66 41.45 1yax h LEU 132 CO 0.00 1.25 0.19 -0.76 -0.34 0.00 0.00 178.44 178.78 1yax s LEU 133 N -8.59 3.33 0.90 2.25 1.43 -1.22 -5.05 118.68 111.73 1yax s LEU 133 Ca -0.12 0.86 -0.14 0.00 -1.03 0.00 0.00 54.13 53.70 1yax s LEU 133 Cb 0.07 -3.74 -0.01 0.00 0.03 0.00 0.00 46.19 42.55 1yax s LEU 133 CO 0.86 -0.93 0.29 -0.24 0.23 0.00 0.00 176.35 176.56 1yax n SER 134 N -2.53 -2.35 -0.04 2.29 2.88 -1.26 -4.91 113.62 107.69 1yax n SER 134 Ca 0.04 0.38 -0.09 0.00 -1.33 0.00 0.00 58.87 57.86 1yax n SER 134 Cb 0.57 -1.15 -0.03 0.00 -0.75 0.00 0.00 64.21 62.84 1yax n SER 134 CO 0.00 0.00 0.00 1.05 -1.23 0.00 0.00 175.04 174.86 1yax h GLU 135 N -1.20 0.18 -1.93 -1.46 9.09 -1.96 -2.92 114.58 114.38 1yax h GLU 135 Ca -0.44 -0.01 -0.67 0.00 0.05 0.00 0.00 59.36 58.29 1yax h GLU 135 Cb 1.30 -0.04 -0.36 0.00 -1.65 0.00 0.00 28.75 28.00 1yax h GLU 135 CO 0.35 0.12 0.03 -0.40 0.05 0.00 0.00 179.01 179.16 1yax n ASP 136 N -5.03 5.81 -4.82 3.06 5.75 -1.26 -5.01 116.55 115.06 1yax n ASP 136 Ca -0.03 -3.74 -0.33 0.00 -0.01 0.00 0.00 54.79 50.69 1yax n ASP 136 Cb 0.06 -0.75 -0.01 0.00 -1.03 0.00 0.00 41.12 39.39 1yax n ASP 136 CO 0.00 0.00 0.00 -2.28 -0.11 0.00 0.00 177.20 174.81 1yax s HIS 137 N -3.79 3.17 0.17 2.11 5.04 -1.11 -4.99 115.29 115.89 1yax s HIS 137 Ca 0.48 1.50 -0.22 0.00 -1.54 0.00 0.00 55.06 55.27 1yax s HIS 137 Cb 0.35 -2.93 0.07 0.00 0.04 0.00 0.00 32.58 30.12 1yax s HIS 137 CO -0.23 -0.81 1.60 1.03 -2.34 0.00 0.00 174.74 173.99 1yax h SER 138 N 0.69 -1.09 -0.19 9.88 0.87 -1.96 -3.04 113.55 118.71 1yax h SER 138 Ca -0.47 0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.29 1yax h SER 138 Cb 1.21 0.52 0.00 0.00 -0.44 0.00 0.00 62.40 63.68 1yax h SER 138 CO 0.59 -0.31 0.00 0.00 -0.53 0.00 0.00 176.83 176.58 1yax n ALA 139 N -3.03 2.49 0.02 6.23 0.00 -1.26 -3.77 120.51 121.19 1yax n ALA 139 Ca 0.02 -0.34 -0.03 0.00 0.00 0.00 0.00 53.44 53.09 1yax n ALA 139 Cb 0.34 -0.99 0.20 0.00 0.00 0.00 0.00 19.45 19.01 1yax n ALA 139 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1yax h GLN 140 N 1.09 0.47 -0.11 0.00 1.08 -1.92 -1.94 115.11 113.78 1yax h GLN 140 Ca 0.00 -0.18 -0.08 0.00 -1.45 0.00 0.00 58.65 56.94 1yax h GLN 140 Cb 0.28 -0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 1yax h GLN 140 CO 0.01 0.69 -0.30 0.93 -0.95 0.00 0.00 178.83 179.21 1yax h GLU 141 N 0.42 0.20 -0.24 1.46 3.07 -1.81 0.13 114.58 117.80 1yax h GLU 141 Ca 0.06 -0.07 -0.10 0.00 -0.50 0.00 0.00 59.36 58.75 1yax h GLU 141 Cb 0.67 -0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.56 1yax h GLU 141 CO 0.05 0.49 -0.25 1.57 -1.40 0.00 0.00 179.01 179.47 1yax h LYS 142 N 0.18 0.60 0.00 2.33 5.09 -1.74 -2.95 116.57 120.08 1yax h LYS 142 Ca 0.03 -0.32 -0.01 0.00 0.09 0.00 0.00 60.65 60.44 1yax h LYS 142 Cb 0.63 0.01 -0.00 0.00 0.10 0.00 0.00 32.23 32.97 1yax h LYS 142 CO 0.05 0.91 -0.05 -0.07 -2.09 0.00 0.00 179.45 178.20 1yax h LEU 143 N 0.30 0.00 -0.65 7.07 3.38 -1.16 -2.70 115.31 121.56 1yax h LEU 143 Ca 0.04 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.86 1yax h LEU 143 Cb 0.81 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1yax h LEU 143 CO 0.06 0.05 -0.55 0.11 0.09 0.00 0.00 178.44 178.21 1yax h LYS 144 N 0.00 0.36 -0.42 1.13 1.57 -0.75 -2.14 116.57 116.33 1yax h LYS 144 Ca -0.00 -0.23 -0.12 0.00 -1.87 0.00 0.00 60.65 58.43 1yax h LYS 144 Cb 0.80 0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 1yax h LYS 144 CO 0.01 0.82 -0.22 1.05 -0.57 0.00 0.00 179.45 180.53 1yax h GLU 145 N 0.28 0.88 0.00 3.15 9.09 -1.30 -1.79 114.58 124.89 1yax h GLU 145 Ca 0.00 -0.40 -0.07 0.00 0.05 0.00 0.00 59.36 58.95 1yax h GLU 145 Cb 1.05 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 28.12 1yax h GLU 145 CO 0.09 1.04 -0.33 -0.24 0.05 0.00 0.00 179.01 179.62 1yax h VAL 146 N 0.71 0.93 -0.04 -1.06 3.04 -1.46 -2.48 116.25 115.87 1yax h VAL 146 Ca 0.09 -1.29 -0.22 0.00 -1.01 0.00 0.00 66.70 64.27 1yax h VAL 146 Cb 0.79 1.76 0.02 0.00 -2.01 0.00 0.00 31.29 31.85 1yax h VAL 146 CO 0.06 0.32 -0.85 -0.09 -1.01 0.00 0.00 177.57 176.01 1yax h ARG 147 N 0.00 0.65 0.00 4.17 2.43 -1.28 -1.84 114.38 118.51 1yax h ARG 147 Ca -0.00 -0.64 -0.02 0.00 -0.81 0.00 0.00 59.98 58.50 1yax h ARG 147 Cb 0.74 0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.45 1yax h ARG 147 CO 0.04 1.25 -0.09 0.93 -1.51 0.00 0.00 179.97 180.58 1yax h GLU 148 N 0.30 0.00 0.00 0.20 5.08 -1.12 -2.18 114.58 116.86 1yax h GLU 148 Ca -0.09 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.20 1yax h GLU 148 Cb 1.51 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.75 1yax h GLU 148 CO 0.17 0.09 -0.52 0.22 -1.00 0.00 0.00 179.01 177.97 1yax h ASP 149 N 0.00 0.00 -3.02 1.42 -0.00 -1.44 -3.45 116.42 109.92 1yax h ASP 149 Ca -0.00 -0.33 -0.56 0.00 -0.00 0.00 0.00 57.03 56.14 1yax h ASP 149 Cb 0.31 0.00 -0.40 0.00 -0.00 0.00 0.00 39.33 39.24 1yax h ASP 149 CO 0.01 0.96 -0.77 -0.62 -0.00 0.00 0.00 179.24 178.83 1yax s ASP 150 N -6.11 3.77 0.37 2.28 3.68 -0.70 -5.01 116.67 114.95 1yax s ASP 150 Ca -0.16 -1.45 0.13 0.00 2.13 0.00 0.00 52.55 53.19 1yax s ASP 150 Cb 0.02 -0.65 0.94 0.00 -1.45 0.00 0.00 42.92 41.77 1yax s ASP 150 CO 0.37 -0.42 1.83 -2.24 0.13 0.00 0.00 175.17 174.84 1yax h ASP 151 N 8.22 0.56 -0.77 -0.34 3.04 -1.60 -2.09 116.42 123.44 1yax h ASP 151 Ca -0.16 0.06 -0.34 0.00 -3.24 0.00 0.00 57.03 53.35 1yax h ASP 151 Cb 1.02 -0.04 -0.20 0.00 -1.04 0.00 0.00 39.33 39.06 1yax h ASP 151 CO 0.45 0.22 0.38 -0.67 -2.04 0.00 0.00 179.24 177.58 1yax n ASP 152 N -4.60 3.84 -4.49 4.15 2.03 -1.26 -4.71 116.55 111.50 1yax n ASP 152 Ca 0.21 -3.50 -0.37 0.00 0.52 0.00 0.00 54.79 51.65 1yax n ASP 152 Cb 0.64 -0.76 0.06 0.00 -0.72 0.00 0.00 41.12 40.34 1yax n ASP 152 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1yax n ALA 153 N -0.83 -1.20 -2.59 -1.67 0.00 -0.79 -4.81 120.51 108.62 1yax n ALA 153 Ca 0.48 -0.18 -0.40 0.00 0.00 0.00 0.00 53.44 53.34 1yax n ALA 153 Cb 1.44 -1.89 -0.11 0.00 0.00 0.00 0.00 19.45 18.89 1yax n ALA 153 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1yax s GLU 154 N -2.69 3.56 -0.03 0.00 2.12 -1.26 -2.46 118.70 117.95 1yax s GLU 154 Ca 0.68 -0.59 -0.03 0.00 0.36 0.00 0.00 54.97 55.38 1yax s GLU 154 Cb -0.37 -3.74 -0.04 0.00 0.26 0.00 0.00 34.13 30.24 1yax s GLU 154 CO 0.56 -0.39 0.17 -1.64 -0.54 0.00 0.00 175.26 173.42 1yax s MET 155 N 1.71 3.41 -0.04 4.30 -1.94 0.19 -4.98 119.30 121.95 1yax s MET 155 Ca 0.06 -0.30 0.03 0.00 -1.71 0.00 0.00 55.69 53.76 1yax s MET 155 Cb -0.17 -3.10 0.01 0.00 2.01 0.00 0.00 34.83 33.58 1yax s MET 155 CO 0.10 0.69 -0.10 -0.08 -0.01 0.00 0.00 175.02 175.62 1yax s THR 156 N -1.27 0.93 -0.02 2.05 -1.32 -1.26 -0.48 115.64 114.27 1yax s THR 156 Ca 0.25 -0.41 0.06 0.00 -1.21 0.00 0.00 61.69 60.38 1yax s THR 156 Cb -0.12 -0.84 -0.02 0.00 -1.51 0.00 0.00 72.50 70.00 1yax s THR 156 CO 0.16 0.29 -0.20 -1.00 -2.21 0.00 0.00 174.62 171.66 1yax s HIS 157 N 0.36 2.51 0.34 9.09 3.76 0.14 -1.20 115.29 130.29 1yax s HIS 157 Ca -0.07 -0.30 -0.17 0.00 -0.15 0.00 0.00 55.06 54.37 1yax s HIS 157 Cb -0.11 -1.54 -0.09 0.00 1.11 0.00 0.00 32.58 31.94 1yax s HIS 157 CO 0.01 0.10 0.79 -1.12 -0.85 0.00 0.00 174.74 173.67 1yax s SER 158 N -0.79 6.87 -0.02 1.40 0.01 -1.26 -0.94 113.70 118.97 1yax s SER 158 Ca 0.11 1.42 0.01 0.00 1.31 0.00 0.00 55.95 58.80 1yax s SER 158 Cb -0.10 -2.43 0.01 0.00 0.21 0.00 0.00 66.02 63.71 1yax s SER 158 CO 0.00 -0.21 -0.05 -0.69 0.41 0.00 0.00 173.24 172.71 1yax s VAL 159 N -1.96 0.45 -0.14 3.43 1.01 -0.11 -1.60 120.40 121.49 1yax s VAL 159 Ca 0.55 -0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.38 1yax s VAL 159 Cb -0.11 -0.44 0.02 0.00 0.00 0.00 0.00 36.38 35.85 1yax s VAL 159 CO 0.17 0.17 -0.17 0.00 0.00 0.00 0.00 175.10 175.26 1yax s ALA 160 N 0.38 1.96 -0.07 5.51 0.00 -0.63 -0.63 121.76 128.28 1yax s ALA 160 Ca -0.04 -0.93 -0.04 0.00 0.00 0.00 0.00 51.96 50.95 1yax s ALA 160 Cb -0.08 -0.97 -0.04 0.00 0.00 0.00 0.00 23.12 22.03 1yax s ALA 160 CO -0.00 -0.18 0.11 0.08 0.00 0.00 0.00 175.76 175.77 1yax s VAL 161 N 1.11 5.09 -0.17 0.00 1.01 -0.31 -1.62 120.40 125.52 1yax s VAL 161 Ca -0.02 -0.06 -0.13 0.00 0.00 0.00 0.00 61.98 61.77 1yax s VAL 161 Cb -0.14 -3.25 0.05 0.00 0.00 0.00 0.00 36.38 33.04 1yax s VAL 161 CO -0.05 0.52 0.43 0.20 0.00 0.00 0.00 175.10 176.20 1yax s ASN 162 N -1.27 -0.48 -0.13 3.32 -0.87 -0.72 -2.39 114.94 112.40 1yax s ASN 162 Ca 0.18 0.89 -0.02 0.00 -1.57 0.00 0.00 52.86 52.34 1yax s ASN 162 Cb -0.12 0.85 -0.02 0.00 -0.02 0.00 0.00 41.25 41.93 1yax s ASN 162 CO 0.08 -0.17 -0.07 -0.63 -2.57 0.00 0.00 177.10 173.74 1yax s ILE 163 N 0.69 3.65 -0.32 0.60 1.01 -1.26 0.10 121.20 125.68 1yax s ILE 163 Ca -0.04 -0.46 -0.02 0.00 0.00 0.00 0.00 60.65 60.13 1yax s ILE 163 Cb -0.05 -2.56 0.06 0.00 0.01 0.00 0.00 42.46 39.92 1yax s ILE 163 CO -0.05 0.52 0.04 -0.31 0.00 0.00 0.00 174.94 175.15 1yax s TYR 164 N 0.09 3.33 0.39 3.97 1.51 0.12 -4.99 117.35 121.76 1yax s TYR 164 Ca -0.02 -1.94 -0.24 0.00 -1.01 0.00 0.00 57.07 53.86 1yax s TYR 164 Cb -0.14 -2.32 -0.12 0.00 -0.11 0.00 0.00 41.96 39.27 1yax s TYR 164 CO 0.03 -0.83 0.83 -2.30 -1.11 0.00 0.00 175.55 172.18 1yax n PRO 165 N 4.63 1.02 -0.56 -1.71 -0.02 -1.26 -2.21 135.00 134.89 1yax n PRO 165 Ca -0.11 0.36 -0.29 0.00 -2.02 0.00 0.00 63.50 61.44 1yax n PRO 165 Cb 0.43 -1.79 0.20 0.00 -0.02 0.00 0.00 33.50 32.33 1yax n PRO 165 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1yax n ALA 166 N -0.51 -3.58 -3.57 3.55 0.00 -1.26 -4.61 120.51 110.52 1yax n ALA 166 Ca 0.11 -1.33 -0.08 0.00 0.00 0.00 0.00 53.44 52.14 1yax n ALA 166 Cb 0.38 -1.52 -0.04 0.00 0.00 0.00 0.00 19.45 18.27 1yax n ALA 166 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1yax s THR 167 N -2.23 0.00 0.20 0.00 2.01 0.57 -4.86 115.64 111.33 1yax s THR 167 Ca 0.57 0.00 -0.13 0.00 0.31 0.00 0.00 61.69 62.44 1yax s THR 167 Cb -0.14 -1.00 0.18 0.00 0.01 0.00 0.00 72.50 71.55 1yax s THR 167 CO 0.60 0.00 1.66 0.00 -0.69 0.00 0.00 174.62 176.19 1yax h ALA 168 N 2.26 0.46 0.34 7.40 0.00 -2.01 -2.74 119.26 124.98 1yax h ALA 168 Ca -0.16 0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1yax h ALA 168 Cb 1.18 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 19.32 1yax h ALA 168 CO 0.28 -0.41 -0.31 0.07 0.00 0.00 0.00 179.25 178.87 1yax h ARG 169 N 0.06 -0.62 -4.65 0.00 -0.00 -1.99 -3.47 114.38 103.71 1yax h ARG 169 Ca 0.28 0.04 -0.23 0.00 -0.00 0.00 0.00 59.98 60.07 1yax h ARG 169 Cb 0.44 0.14 -0.15 0.00 -0.00 0.00 0.00 29.97 30.40 1yax h ARG 169 CO -0.53 -0.41 -0.68 0.00 -0.00 0.00 0.00 179.97 178.35 1yax s MET 170 N -4.75 0.91 0.90 0.08 0.00 -1.03 -4.82 119.30 110.58 1yax s MET 170 Ca -0.11 -1.40 -0.14 0.00 0.00 0.00 0.00 55.69 54.04 1yax s MET 170 Cb 0.02 -0.16 0.14 0.00 0.00 0.00 0.00 34.83 34.84 1yax s MET 170 CO 0.37 -0.08 1.24 -1.25 0.00 0.00 0.00 175.02 175.30 1yax s PRO 171 N -3.88 1.22 -0.35 3.16 0.04 -1.26 -0.32 135.00 133.62 1yax s PRO 171 Ca 0.16 -0.11 -0.43 0.00 0.04 0.00 0.00 61.00 60.66 1yax s PRO 171 Cb 0.06 -1.89 -0.18 0.00 0.04 0.00 0.00 34.50 32.53 1yax s PRO 171 CO -0.02 -2.07 1.63 0.94 0.04 0.00 0.00 177.00 177.52 1yax n GLN 172 N -3.59 0.58 -4.74 4.56 7.27 -1.26 -4.50 117.38 115.69 1yax n GLN 172 Ca 0.11 0.21 -0.33 0.00 0.07 0.00 0.00 57.00 57.06 1yax n GLN 172 Cb 0.60 -1.80 -0.13 0.00 2.41 0.00 0.00 30.24 31.32 1yax n GLN 172 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1yax s LEU 173 N 2.98 2.86 -0.18 1.69 1.02 -0.94 -4.20 118.68 121.91 1yax s LEU 173 Ca 1.00 -0.21 -0.02 0.00 0.02 0.00 0.00 54.13 54.93 1yax s LEU 173 Cb -1.27 -1.63 -0.00 0.00 0.02 0.00 0.00 46.19 43.31 1yax s LEU 173 CO 0.72 0.25 -0.10 -0.89 0.02 0.00 0.00 176.35 176.35 1yax s THR 174 N -0.17 3.01 -0.18 5.49 2.01 -1.09 0.10 115.64 124.80 1yax s THR 174 Ca 0.01 -0.64 0.01 0.00 0.31 0.00 0.00 61.69 61.38 1yax s THR 174 Cb -0.13 -2.32 0.02 0.00 0.01 0.00 0.00 72.50 70.08 1yax s THR 174 CO 0.03 0.48 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.62 1yax s ILE 175 N 1.08 2.06 -0.10 1.82 1.01 0.12 -0.58 121.20 126.60 1yax s ILE 175 Ca 0.00 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.68 1yax s ILE 175 Cb -0.15 -1.88 -0.02 0.00 0.01 0.00 0.00 42.46 40.42 1yax s ILE 175 CO -0.02 0.50 -0.14 -0.69 0.00 0.00 0.00 174.94 174.59 1yax s VAL 176 N 1.28 3.03 -0.13 2.92 1.01 0.09 -1.76 120.40 126.85 1yax s VAL 176 Ca 0.04 -0.69 -0.02 0.00 0.00 0.00 0.00 61.98 61.31 1yax s VAL 176 Cb -0.13 -2.24 0.04 0.00 0.00 0.00 0.00 36.38 34.05 1yax s VAL 176 CO -0.12 0.55 0.01 -0.69 0.00 0.00 0.00 175.10 174.84 1yax s VAL 177 N -0.07 0.51 -0.20 2.92 1.01 -0.64 -0.31 120.40 123.62 1yax s VAL 177 Ca -0.03 -0.20 -0.10 0.00 0.00 0.00 0.00 61.98 61.65 1yax s VAL 177 Cb -0.14 -0.79 -0.05 0.00 0.00 0.00 0.00 36.38 35.40 1yax s VAL 177 CO 0.04 0.08 0.14 -0.69 0.00 0.00 0.00 175.10 174.68 1yax s VAL 178 N 1.90 5.40 -0.19 2.92 1.01 -0.59 -1.60 120.40 129.24 1yax s VAL 178 Ca 0.03 0.22 -0.29 0.00 0.00 0.00 0.00 61.98 61.93 1yax s VAL 178 Cb -0.14 -3.48 -0.01 0.00 0.00 0.00 0.00 36.38 32.75 1yax s VAL 178 CO -0.07 0.43 1.24 -0.62 0.00 0.00 0.00 175.10 176.09 1yax s ASP 179 N 0.40 6.92 0.00 3.32 -1.08 -0.63 -2.04 116.67 123.57 1yax s ASP 179 Ca 0.09 1.59 0.28 0.00 -0.52 0.00 0.00 52.55 53.98 1yax s ASP 179 Cb -0.11 -2.54 1.00 0.00 -1.46 0.00 0.00 42.92 39.81 1yax s ASP 179 CO -0.01 -0.80 1.75 0.35 0.52 0.00 0.00 175.17 176.98 1yax n THR 180 N 5.49 0.00 -3.58 1.71 -2.24 -0.74 -4.24 114.28 110.68 1yax n THR 180 Ca 0.14 -0.02 -0.38 0.00 -2.27 0.00 0.00 64.05 61.53 1yax n THR 180 Cb 0.45 -0.15 -0.10 0.00 -2.10 0.00 0.00 70.33 68.43 1yax n THR 180 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1yax s ILE 181 N -2.86 5.30 0.86 2.28 -5.25 -1.26 -4.85 121.20 115.43 1yax s ILE 181 Ca 0.17 0.26 -0.11 0.00 -0.99 0.00 0.00 60.65 59.98 1yax s ILE 181 Cb 0.19 -3.55 0.11 0.00 2.95 0.00 0.00 42.46 42.15 1yax s ILE 181 CO 0.57 0.27 1.09 -2.16 -1.79 0.00 0.00 174.94 172.93 1yax s PRO 182 N 1.50 1.55 0.23 0.37 0.04 -1.26 -4.80 135.00 132.64 1yax s PRO 182 Ca 0.09 1.03 0.23 0.00 0.04 0.00 0.00 61.00 62.39 1yax s PRO 182 Cb -0.15 -1.83 0.95 0.00 0.04 0.00 0.00 34.50 33.51 1yax s PRO 182 CO 0.08 -2.10 1.69 0.44 0.04 0.00 0.00 177.00 177.15 1yax n ILE 183 N -3.81 0.85 0.55 0.56 -6.64 -0.35 -2.77 119.36 107.75 1yax n ILE 183 Ca 0.08 0.23 0.11 0.00 -1.77 0.00 0.00 62.75 61.41 1yax n ILE 183 Cb 0.54 -1.15 0.45 0.00 -1.44 0.00 0.00 39.64 38.04 1yax n ILE 183 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 1yax n GLU 184 N -2.17 0.14 -1.03 6.28 4.71 -1.26 -2.90 120.64 124.42 1yax n GLU 184 Ca 0.02 0.28 -0.13 0.00 -0.01 0.00 0.00 57.16 57.32 1yax n GLU 184 Cb 0.22 -1.73 0.21 0.00 -1.01 0.00 0.00 31.44 29.14 1yax n GLU 184 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1yax n LEU 185 N -1.99 5.67 -0.30 -4.62 4.77 -1.11 -5.18 117.00 114.23 1yax n LEU 185 Ca 0.04 -3.58 0.04 0.00 -0.03 0.00 0.00 56.01 52.48 1yax n LEU 185 Cb 0.28 -0.75 0.03 0.00 -2.33 0.00 0.00 43.42 40.65 1yax n LEU 185 CO 0.22 1.06 0.37 0.29 -1.33 0.00 0.00 177.39 178.00