#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yho n GLY 2 N 0.00 0.92 2.89 2.92 0.00 -1.26 -5.05 105.19 105.61 1yho n GLY 2 Ca 0.00 -0.54 -0.28 0.00 0.00 0.00 0.00 46.02 45.20 1yho n GLY 2 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yho s SER 3 N -2.56 2.77 -0.15 1.61 0.01 -1.26 -4.76 113.70 109.35 1yho s SER 3 Ca 0.00 -0.63 -0.00 0.00 1.31 0.00 0.00 55.95 56.63 1yho s SER 3 Cb 0.00 -0.91 -0.01 0.00 0.21 0.00 0.00 66.02 65.32 1yho s SER 3 CO 0.00 -0.18 -0.14 -0.76 0.41 0.00 0.00 173.24 172.58 1yho s LEU 4 N 1.64 2.58 -0.18 2.44 1.02 -1.26 -1.41 118.68 123.51 1yho s LEU 4 Ca 0.01 -0.42 0.01 0.00 0.02 0.00 0.00 54.13 53.75 1yho s LEU 4 Cb -0.15 -1.59 0.02 0.00 0.02 0.00 0.00 46.19 44.48 1yho s LEU 4 CO -0.08 0.10 -0.18 0.20 0.02 0.00 0.00 176.35 176.41 1yho s ASN 5 N 0.75 3.26 -0.05 2.29 -0.87 -0.27 -1.92 114.94 118.13 1yho s ASN 5 Ca -0.06 -0.61 -0.02 0.00 -1.57 0.00 0.00 52.86 50.60 1yho s ASN 5 Cb -0.15 -1.50 -0.04 0.00 -0.02 0.00 0.00 41.25 39.54 1yho s ASN 5 CO 0.01 0.01 0.05 0.00 -2.57 0.00 0.00 177.10 174.60 1yho s ILE 7 N -1.04 -0.37 0.03 0.00 2.07 -0.96 0.99 121.20 121.92 1yho s ILE 7 Ca 0.18 -0.00 0.01 0.00 -1.41 0.00 0.00 60.65 59.42 1yho s ILE 7 Cb -0.12 -0.62 -0.02 0.00 0.13 0.00 0.00 42.46 41.83 1yho s ILE 7 CO 0.08 -0.11 -0.06 0.68 -1.91 0.00 0.00 174.94 173.62 1yho s VAL 8 N 2.37 0.35 -0.02 4.00 -7.23 0.97 -4.66 120.40 116.18 1yho s VAL 8 Ca 0.06 -1.06 -0.01 0.00 -1.81 0.00 0.00 61.98 59.17 1yho s VAL 8 Cb -0.15 -0.52 -0.04 0.00 0.56 0.00 0.00 36.38 36.23 1yho s VAL 8 CO -0.11 -0.47 0.07 0.00 -0.31 0.00 0.00 175.10 174.27 1yho s ALA 9 N -1.58 3.53 0.02 1.32 0.00 -1.26 -1.33 121.76 122.47 1yho s ALA 9 Ca -0.11 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 50.99 1yho s ALA 9 Cb -0.09 -1.56 -0.02 0.00 0.00 0.00 0.00 23.12 21.45 1yho s ALA 9 CO -0.01 0.67 -0.03 0.14 0.00 0.00 0.00 175.76 176.53 1yho s VAL 10 N -1.15 0.15 0.74 0.00 -7.23 0.28 -4.70 120.40 108.50 1yho s VAL 10 Ca 0.21 -0.79 -0.11 0.00 -1.81 0.00 0.00 61.98 59.48 1yho s VAL 10 Cb -0.12 -0.27 0.04 0.00 0.56 0.00 0.00 36.38 36.59 1yho s VAL 10 CO 0.12 -0.40 1.12 -0.94 -0.31 0.00 0.00 175.10 174.69 1yho s SER 11 N -1.24 5.09 0.67 4.85 1.04 0.17 -0.97 113.70 123.31 1yho s SER 11 Ca -0.13 0.98 0.43 0.00 0.48 0.00 0.00 55.95 57.72 1yho s SER 11 Cb -0.08 -1.67 2.38 0.00 0.10 0.00 0.00 66.02 66.74 1yho s SER 11 CO -0.01 -1.55 2.35 -0.61 0.98 0.00 0.00 173.24 174.41 1yho h GLN 12 N -0.80 0.00 -0.77 4.02 4.15 -1.27 -0.12 115.11 120.32 1yho h GLN 12 Ca -0.45 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 58.87 1yho h GLN 12 Cb 1.28 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.92 1yho h GLN 12 CO 0.65 0.00 0.12 -1.71 -1.93 0.00 0.00 178.83 175.96 1yho n ASN 13 N -3.12 4.23 -2.54 -0.69 2.85 -1.26 -4.87 115.26 109.87 1yho n ASN 13 Ca -0.03 -2.81 -0.21 0.00 -0.11 0.00 0.00 54.58 51.43 1yho n ASN 13 Cb 0.09 -0.67 0.01 0.00 1.24 0.00 0.00 39.78 40.45 1yho n ASN 13 CO 0.00 0.00 0.00 0.23 -2.11 0.00 0.00 177.26 175.38 1yho n MET 14 N 0.16 -2.75 -4.03 1.20 2.81 -0.06 -4.95 117.12 109.51 1yho n MET 14 Ca 0.26 0.95 -0.29 0.00 -1.81 0.00 0.00 57.70 56.81 1yho n MET 14 Cb 1.05 -5.65 -0.06 0.00 -0.71 0.00 0.00 33.22 27.86 1yho n MET 14 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1yho s GLY 15 N -2.31 1.96 -0.12 3.03 0.00 -1.24 -1.00 107.32 107.64 1yho s GLY 15 Ca 0.10 -1.03 -0.00 0.00 0.00 0.00 0.00 44.72 43.79 1yho s GLY 15 CO 0.13 -1.02 -0.12 0.29 0.00 0.00 0.00 173.10 172.38 1yho n ILE 16 N 0.18 0.71 -3.62 0.90 -5.35 -0.94 0.43 119.36 111.67 1yho n ILE 16 Ca -0.08 -0.26 -0.01 0.00 -0.27 0.00 0.00 62.75 62.14 1yho n ILE 16 Cb 0.52 -1.07 -0.02 0.00 -1.74 0.00 0.00 39.64 37.34 1yho n ILE 16 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1yho s GLY 17 N -5.20 -0.27 -0.07 3.28 0.00 -1.26 -4.25 107.32 99.55 1yho s GLY 17 Ca -0.17 1.68 0.03 0.00 0.00 0.00 0.00 44.72 46.25 1yho s GLY 17 CO 0.28 0.53 -0.14 1.25 0.00 0.00 0.00 173.10 175.01 1yho s LYS 18 N -2.06 1.83 -1.56 2.90 2.36 0.24 -2.00 119.74 121.44 1yho s LYS 18 Ca 0.12 -0.48 0.00 0.00 -2.55 0.00 0.00 55.97 53.07 1yho s LYS 18 Cb 0.01 -1.50 0.00 0.00 -1.05 0.00 0.00 37.83 35.29 1yho s LYS 18 CO -0.03 0.07 0.00 0.09 1.55 0.00 0.00 175.35 177.02 1yho n ASN 19 N 3.70 -5.12 -0.11 1.43 4.13 -1.26 -1.79 115.26 116.23 1yho n ASN 19 Ca -0.22 0.06 -0.01 0.00 1.68 0.00 0.00 54.58 56.09 1yho n ASN 19 Cb 0.52 -4.20 -0.00 0.00 -1.54 0.00 0.00 39.78 34.56 1yho n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1yho n GLY 20 N -0.98 0.45 3.06 7.41 0.00 -1.26 -5.04 105.19 108.82 1yho n GLY 20 Ca -0.20 -0.99 -0.11 0.00 0.00 0.00 0.00 46.02 44.72 1yho n GLY 20 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yho s ASP 21 N -2.98 0.68 0.49 1.61 1.11 -0.74 -4.84 116.67 112.00 1yho s ASP 21 Ca 0.00 -0.64 -0.23 0.00 0.18 0.00 0.00 52.55 51.86 1yho s ASP 21 Cb 0.00 0.08 -0.07 0.00 1.07 0.00 0.00 42.92 44.00 1yho s ASP 21 CO 0.00 -0.31 1.27 -0.76 1.18 0.00 0.00 175.17 176.55 1yho s LEU 22 N -1.87 3.98 0.28 1.23 1.43 -1.26 0.83 118.68 123.29 1yho s LEU 22 Ca -0.07 2.55 -0.02 0.00 -1.03 0.00 0.00 54.13 55.56 1yho s LEU 22 Cb -0.06 -4.20 0.44 0.00 0.03 0.00 0.00 46.19 42.40 1yho s LEU 22 CO -0.02 -1.17 1.91 -0.65 0.23 0.00 0.00 176.35 176.65 1yho h PRO 23 N 1.91 1.11 -5.97 1.29 0.11 -1.82 -3.43 132.00 125.20 1yho h PRO 23 Ca -0.50 -0.07 -0.59 0.00 0.11 0.00 0.00 66.00 64.95 1yho h PRO 23 Cb 1.27 -0.25 -0.04 0.00 0.11 0.00 0.00 31.00 32.09 1yho h PRO 23 CO 0.59 0.73 -0.49 1.67 -0.21 0.00 0.00 178.00 180.29 1yho s TRP 24 N -5.98 3.49 1.14 0.65 -2.14 -1.26 -4.78 118.94 110.06 1yho s TRP 24 Ca -0.12 0.19 -0.17 0.00 2.66 0.00 0.00 56.10 58.66 1yho s TRP 24 Cb 0.19 -1.72 0.16 0.00 -3.10 0.00 0.00 33.47 29.01 1yho s TRP 24 CO 0.81 0.56 0.27 -2.30 -2.66 0.00 0.00 176.95 173.63 1yho n PRO 25 N -0.01 -1.90 -1.65 3.25 -0.02 -1.26 -4.82 135.00 128.58 1yho n PRO 25 Ca -0.06 -0.53 -0.43 0.00 -2.02 0.00 0.00 63.50 60.46 1yho n PRO 25 Cb 0.52 -1.82 -0.03 0.00 -0.02 0.00 0.00 33.50 32.15 1yho n PRO 25 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1yho n PRO 26 N -2.88 2.70 -3.47 0.52 -0.04 -1.26 -4.96 135.00 125.61 1yho n PRO 26 Ca 0.01 0.96 -0.38 0.00 -0.04 0.00 0.00 63.50 64.05 1yho n PRO 26 Cb 0.60 -3.02 -0.09 0.00 -0.04 0.00 0.00 33.50 30.95 1yho n PRO 26 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1yho s LEU 27 N 5.02 4.10 0.31 1.53 2.96 -1.26 -4.96 118.68 126.38 1yho s LEU 27 Ca 0.91 0.32 0.08 0.00 -0.22 0.00 0.00 54.13 55.22 1yho s LEU 27 Cb -0.44 -2.37 0.49 0.00 0.50 0.00 0.00 46.19 44.38 1yho s LEU 27 CO 0.42 -0.07 1.71 -0.09 -1.32 0.00 0.00 176.35 177.00 1yho h ARG 28 N 7.70 0.17 -0.15 1.98 2.43 -1.97 -2.14 114.38 122.39 1yho h ARG 28 Ca -0.35 -0.08 -0.22 0.00 -0.81 0.00 0.00 59.98 58.51 1yho h ARG 28 Cb 1.17 -0.00 0.01 0.00 -0.42 0.00 0.00 29.97 30.72 1yho h ARG 28 CO 0.67 0.57 -0.78 -0.97 -1.51 0.00 0.00 179.97 177.95 1yho h ASN 29 N 0.14 0.95 -0.43 -3.80 -1.24 -1.98 -1.31 115.58 107.91 1yho h ASN 29 Ca 0.01 -0.63 -0.06 0.00 0.71 0.00 0.00 56.30 56.33 1yho h ASN 29 Cb 0.81 -0.28 -0.02 0.00 0.73 0.00 0.00 38.32 39.57 1yho h ASN 29 CO 0.06 1.43 0.02 -0.08 -1.29 0.00 0.00 177.43 177.57 1yho h GLU 30 N 0.53 0.75 -0.29 6.67 4.57 -1.95 0.23 114.58 125.08 1yho h GLU 30 Ca -0.05 -0.23 -0.10 0.00 -1.18 0.00 0.00 59.36 57.79 1yho h GLU 30 Cb 1.41 -0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.92 1yho h GLU 30 CO 0.16 0.81 -0.23 0.74 -1.18 0.00 0.00 179.01 179.31 1yho h PHE 31 N 0.59 0.79 -0.36 0.92 -1.00 -1.43 0.31 116.94 116.75 1yho h PHE 31 Ca 0.12 -0.22 -0.08 0.00 2.81 0.00 0.00 57.97 60.60 1yho h PHE 31 Cb 0.46 -0.17 -0.01 0.00 3.61 0.00 0.00 35.95 39.84 1yho h PHE 31 CO 0.03 0.94 -0.08 0.00 -1.61 0.00 0.00 178.31 177.60 1yho h ARG 32 N 0.42 0.70 -0.48 1.51 3.08 -1.18 -1.99 114.38 116.44 1yho h ARG 32 Ca 0.05 -0.26 -0.11 0.00 0.07 0.00 0.00 59.98 59.73 1yho h ARG 32 Cb 0.78 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 1yho h ARG 32 CO 0.06 0.85 -0.14 -0.92 -1.07 0.00 0.00 179.97 178.75 1yho h TYR 33 N 0.50 1.06 -0.20 3.04 3.20 -0.55 0.13 116.97 124.15 1yho h TYR 33 Ca 0.09 -0.24 0.00 0.00 3.14 0.00 0.00 58.73 61.73 1yho h TYR 33 Cb 0.59 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 1yho h TYR 33 CO 0.05 1.03 0.13 0.35 -1.64 0.00 0.00 178.16 178.07 1yho h PHE 34 N 0.78 0.25 -0.27 -3.82 3.04 -0.87 -0.22 116.94 115.84 1yho h PHE 34 Ca 0.12 0.00 -0.18 0.00 3.98 0.00 0.00 57.97 61.89 1yho h PHE 34 Cb 0.70 -0.09 -0.00 0.00 2.56 0.00 0.00 35.95 39.12 1yho h PHE 34 CO 0.05 0.17 -0.54 0.37 -2.02 0.00 0.00 178.31 176.35 1yho h GLN 35 N 0.26 0.79 -0.94 1.11 4.15 -1.32 -2.34 115.11 116.82 1yho h GLN 35 Ca 0.07 -0.49 0.00 0.00 0.77 0.00 0.00 58.65 59.00 1yho h GLN 35 Cb -0.01 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 27.68 1yho h GLN 35 CO -0.02 1.12 0.59 -0.09 -1.93 0.00 0.00 178.83 178.51 1yho h ARG 36 N 0.61 1.26 0.09 1.69 1.12 -0.51 0.21 114.38 118.85 1yho h ARG 36 Ca 0.02 -0.10 -0.00 0.00 -1.11 0.00 0.00 59.98 58.78 1yho h ARG 36 Cb 1.12 -0.27 0.00 0.00 -0.01 0.00 0.00 29.97 30.81 1yho h ARG 36 CO 0.11 0.86 -0.05 1.98 -3.11 0.00 0.00 179.97 179.77 1yho h MET 37 N 1.29 -0.12 -0.90 0.20 4.05 -0.99 -1.68 114.93 116.77 1yho h MET 37 Ca 0.34 0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.78 1yho h MET 37 Cb -0.10 0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 30.69 1yho h MET 37 CO -0.07 0.31 0.60 1.79 0.23 0.00 0.00 176.91 179.77 1yho h THR 38 N -0.61 1.23 -0.40 -0.77 1.35 -1.29 -2.17 112.91 110.26 1yho h THR 38 Ca -0.01 -0.42 -0.10 0.00 -0.55 0.00 0.00 66.41 65.33 1yho h THR 38 Cb 0.49 -0.10 -0.02 0.00 -1.73 0.00 0.00 68.15 66.80 1yho h THR 38 CO 0.02 0.22 -0.18 0.74 -0.25 0.00 0.00 175.52 176.07 1yho h THR 39 N 1.22 1.26 -0.61 6.82 2.02 -0.58 -3.38 112.91 119.66 1yho h THR 39 Ca 0.33 -1.26 -0.27 0.00 0.77 0.00 0.00 66.41 65.98 1yho h THR 39 Cb -0.13 1.15 -0.04 0.00 -1.74 0.00 0.00 68.15 67.39 1yho h THR 39 CO -0.07 0.42 0.73 -0.89 0.37 0.00 0.00 175.52 176.08 1yho s THR 40 N -4.67 3.42 0.25 3.16 2.01 -0.64 -4.94 115.64 114.23 1yho s THR 40 Ca -0.09 -0.46 -0.16 0.00 0.31 0.00 0.00 61.69 61.29 1yho s THR 40 Cb 0.13 -4.06 -0.08 0.00 0.01 0.00 0.00 72.50 68.51 1yho s THR 40 CO 0.83 -0.85 0.68 -0.44 -0.69 0.00 0.00 174.62 174.14 1yho s SER 41 N 7.92 6.86 0.07 3.53 0.01 -1.26 -4.96 113.70 125.87 1yho s SER 41 Ca 0.72 1.25 0.03 0.00 1.31 0.00 0.00 55.95 59.26 1yho s SER 41 Cb -0.06 -2.36 -0.24 0.00 0.21 0.00 0.00 66.02 63.57 1yho s SER 41 CO 0.04 -0.06 1.10 0.77 0.41 0.00 0.00 173.24 175.50 1yho h SER 42 N 2.88 0.17 -3.39 2.44 4.64 -1.96 -3.45 113.55 114.88 1yho h SER 42 Ca -0.48 -0.20 -0.65 0.00 -0.47 0.00 0.00 61.79 59.99 1yho h SER 42 Cb 1.18 -0.05 -0.20 0.00 -0.31 0.00 0.00 62.40 63.02 1yho h SER 42 CO 0.66 1.16 -0.67 0.68 -0.87 0.00 0.00 176.83 177.79 1yho s VAL 43 N -2.67 3.90 0.07 0.95 -7.23 -1.26 -5.11 120.40 109.06 1yho s VAL 43 Ca -0.03 -0.37 -0.19 0.00 -1.81 0.00 0.00 61.98 59.59 1yho s VAL 43 Cb 0.09 -2.67 -0.07 0.00 0.56 0.00 0.00 36.38 34.29 1yho s VAL 43 CO 0.84 0.53 0.55 -1.61 -0.31 0.00 0.00 175.10 175.11 1yho s GLU 44 N -0.08 4.17 0.00 4.82 8.01 -1.26 -4.03 118.70 130.32 1yho s GLU 44 Ca 0.02 0.70 0.00 0.00 0.01 0.00 0.00 54.97 55.70 1yho s GLU 44 Cb -0.13 -3.23 0.00 0.00 -4.31 0.00 0.00 34.13 26.46 1yho s GLU 44 CO 0.03 0.64 0.00 0.41 0.01 0.00 0.00 175.26 176.35 1yho n GLY 45 N 1.72 0.73 3.40 -1.39 0.00 -1.26 -5.07 105.19 103.32 1yho n GLY 45 Ca -0.11 -0.21 -0.21 0.00 0.00 0.00 0.00 46.02 45.50 1yho n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yho s LYS 46 N -0.69 1.49 -0.04 1.61 -0.14 -1.26 -5.12 119.74 115.60 1yho s LYS 46 Ca 0.00 -1.68 0.05 0.00 -1.36 0.00 0.00 55.97 52.98 1yho s LYS 46 Cb 0.00 -1.41 -0.02 0.00 -1.68 0.00 0.00 37.83 34.71 1yho s LYS 46 CO 0.00 0.24 -0.18 -0.65 -0.76 0.00 0.00 175.35 174.01 1yho s GLN 47 N -3.59 2.37 -0.10 1.68 -0.21 -1.24 -5.04 119.66 113.54 1yho s GLN 47 Ca 0.26 -0.77 -0.09 0.00 0.02 0.00 0.00 55.36 54.78 1yho s GLN 47 Cb -0.02 -2.27 -0.04 0.00 1.00 0.00 0.00 33.01 31.67 1yho s GLN 47 CO 0.11 0.60 0.21 -0.80 -2.12 0.00 0.00 175.29 173.29 1yho s ASN 48 N -0.72 6.48 -0.18 5.90 -0.87 -1.26 -2.68 114.94 121.61 1yho s ASN 48 Ca 0.11 0.57 -0.04 0.00 -1.57 0.00 0.00 52.86 51.93 1yho s ASN 48 Cb -0.10 -2.12 -0.03 0.00 -0.02 0.00 0.00 41.25 38.98 1yho s ASN 48 CO 0.00 0.37 -0.02 -0.22 -2.57 0.00 0.00 177.10 174.66 1yho s LEU 49 N -0.91 3.25 -0.09 0.60 0.20 -0.90 -1.16 118.68 119.67 1yho s LEU 49 Ca 0.17 -0.17 -0.00 0.00 0.69 0.00 0.00 54.13 54.82 1yho s LEU 49 Cb -0.13 -1.80 -0.03 0.00 -0.43 0.00 0.00 46.19 43.80 1yho s LEU 49 CO 0.06 0.12 -0.05 0.68 -0.29 0.00 0.00 176.35 176.86 1yho s VAL 50 N 0.67 3.82 -0.14 1.68 -7.23 0.82 0.11 120.40 120.14 1yho s VAL 50 Ca -0.01 -0.43 -0.02 0.00 -1.81 0.00 0.00 61.98 59.71 1yho s VAL 50 Cb -0.14 -2.59 -0.03 0.00 0.56 0.00 0.00 36.38 34.18 1yho s VAL 50 CO 0.02 0.58 -0.06 -0.63 -0.31 0.00 0.00 175.10 174.71 1yho s ILE 51 N -0.62 3.71 0.08 -0.62 1.01 0.12 -0.45 121.20 124.43 1yho s ILE 51 Ca 0.10 -0.43 0.02 0.00 0.00 0.00 0.00 60.65 60.33 1yho s ILE 51 Cb -0.12 -2.60 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 1yho s ILE 51 CO 0.02 0.52 -0.06 -0.04 0.00 0.00 0.00 174.94 175.37 1yho s MET 52 N 0.15 0.75 0.67 2.79 -1.94 0.10 -0.65 119.30 121.17 1yho s MET 52 Ca -0.03 -1.20 -0.04 0.00 -1.71 0.00 0.00 55.69 52.71 1yho s MET 52 Cb -0.14 -0.19 0.06 0.00 2.01 0.00 0.00 34.83 36.57 1yho s MET 52 CO 0.03 -0.01 0.95 0.20 -0.01 0.00 0.00 175.02 176.18 1yho s GLY 53 N -2.71 1.73 0.29 -0.03 0.00 -0.90 -1.74 107.32 103.96 1yho s GLY 53 Ca 0.07 -1.10 -0.03 0.00 0.00 0.00 0.00 44.72 43.66 1yho s GLY 53 CO -0.04 -0.70 1.96 1.70 0.00 0.00 0.00 173.10 176.02 1yho h LYS 54 N -0.43 1.13 -0.54 2.90 3.64 -1.94 -1.27 116.57 120.05 1yho h LYS 54 Ca -0.43 -0.07 -0.12 0.00 -1.27 0.00 0.00 60.65 58.76 1yho h LYS 54 Cb 1.31 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 32.85 1yho h LYS 54 CO 0.56 0.74 -0.12 0.87 -2.27 0.00 0.00 179.45 179.24 1yho h LYS 55 N 1.16 1.03 -0.30 1.90 1.79 -1.95 -2.00 116.57 118.20 1yho h LYS 55 Ca 0.32 -0.39 -0.03 0.00 -2.18 0.00 0.00 60.65 58.37 1yho h LYS 55 Cb -0.12 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 30.45 1yho h LYS 55 CO -0.07 1.08 0.07 1.15 -1.08 0.00 0.00 179.45 180.60 1yho h THR 56 N 0.91 1.22 -0.66 -0.16 2.02 -1.79 0.29 112.91 114.73 1yho h THR 56 Ca 0.14 -0.73 -0.03 0.00 0.77 0.00 0.00 66.41 66.56 1yho h THR 56 Cb 0.69 1.12 -0.03 0.00 -1.74 0.00 0.00 68.15 68.19 1yho h THR 56 CO 0.05 0.24 0.29 -0.25 0.37 0.00 0.00 175.52 176.23 1yho h TRP 57 N 0.33 0.95 0.00 3.16 2.91 -1.20 -1.36 115.95 120.74 1yho h TRP 57 Ca 0.10 -0.04 -0.00 0.00 1.13 0.00 0.00 58.89 60.07 1yho h TRP 57 Cb 0.29 -0.29 -0.00 0.00 -0.51 0.00 0.00 29.16 28.65 1yho h TRP 57 CO 0.01 0.71 -0.01 0.74 -1.03 0.00 0.00 178.44 178.86 1yho h PHE 58 N 0.94 0.00 0.00 2.65 -1.00 -1.15 -3.17 116.94 115.21 1yho h PHE 58 Ca 0.23 0.00 -0.21 0.00 2.81 0.00 0.00 57.97 60.79 1yho h PHE 58 Cb 0.13 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.66 1yho h PHE 58 CO 0.01 0.01 -1.10 0.77 -1.61 0.00 0.00 178.31 176.39 1yho h SER 59 N 0.00 0.00 -3.25 2.17 0.02 -0.08 -3.45 113.55 108.96 1yho h SER 59 Ca -0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.42 1yho h SER 59 Cb 0.89 0.00 0.02 0.00 0.14 0.00 0.00 62.40 63.44 1yho h SER 59 CO 0.00 0.92 0.61 -0.63 -1.14 0.00 0.00 176.83 176.59 1yho s ILE 60 N -2.73 3.63 0.51 3.27 1.01 -0.60 -5.01 121.20 121.29 1yho s ILE 60 Ca 0.00 1.24 -0.20 0.00 0.00 0.00 0.00 60.65 61.69 1yho s ILE 60 Cb 0.09 -3.79 -0.07 0.00 0.01 0.00 0.00 42.46 38.70 1yho s ILE 60 CO 0.81 0.14 1.07 -2.16 0.00 0.00 0.00 174.94 174.80 1yho s PRO 61 N 0.55 3.63 0.57 2.79 0.04 -1.26 -4.89 135.00 136.43 1yho s PRO 61 Ca 0.58 1.43 0.27 0.00 0.04 0.00 0.00 61.00 63.32 1yho s PRO 61 Cb -0.33 -2.06 1.70 0.00 0.04 0.00 0.00 34.50 33.85 1yho s PRO 61 CO 0.33 -0.59 2.22 1.49 0.04 0.00 0.00 177.00 180.49 1yho h GLU 62 N 1.37 0.00 -0.39 4.56 4.81 -1.95 -1.60 114.58 121.38 1yho h GLU 62 Ca -0.49 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 58.85 1yho h GLU 62 Cb 1.23 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.60 1yho h GLU 62 CO 0.58 0.02 0.28 0.87 -0.73 0.00 0.00 179.01 180.03 1yho h LYS 63 N 0.00 0.01 0.00 1.92 1.57 -2.02 -2.37 116.57 115.68 1yho h LYS 63 Ca -0.00 -0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.42 1yho h LYS 63 Cb 0.04 -0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.28 1yho h LYS 63 CO 0.00 0.00 -2.34 0.09 -0.57 0.00 0.00 179.45 176.64 1yho n ASN 64 N -4.42 0.45 -4.76 0.86 3.02 -0.66 -4.96 115.26 104.79 1yho n ASN 64 Ca 0.06 -0.02 -0.39 0.00 -0.03 0.00 0.00 54.58 54.21 1yho n ASN 64 Cb 0.47 0.81 -0.06 0.00 -0.61 0.00 0.00 39.78 40.39 1yho n ASN 64 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1yho s ARG 65 N -2.47 4.73 0.12 3.52 0.52 -0.86 -2.69 118.95 121.81 1yho s ARG 65 Ca -0.12 1.39 -0.30 0.00 -0.52 0.00 0.00 55.73 56.17 1yho s ARG 65 Cb 0.06 -3.12 -0.07 0.00 0.52 0.00 0.00 34.95 32.35 1yho s ARG 65 CO 0.77 0.45 1.20 -1.25 0.02 0.00 0.00 175.30 176.48 1yho s PRO 66 N -1.47 4.46 -0.73 3.54 0.04 -1.26 -4.77 135.00 134.81 1yho s PRO 66 Ca 0.43 1.82 -0.26 0.00 0.04 0.00 0.00 61.00 63.03 1yho s PRO 66 Cb -0.23 -3.30 -0.08 0.00 0.04 0.00 0.00 34.50 30.93 1yho s PRO 66 CO 0.29 -0.18 2.19 -0.51 0.04 0.00 0.00 177.00 178.83 1yho s LEU 67 N 0.49 3.12 1.02 -3.56 2.01 -1.09 -4.94 118.68 115.73 1yho s LEU 67 Ca 0.56 0.10 -0.14 0.00 0.01 0.00 0.00 54.13 54.66 1yho s LEU 67 Cb -0.31 -2.54 0.20 0.00 0.01 0.00 0.00 46.19 43.55 1yho s LEU 67 CO 0.32 -3.13 1.12 -0.54 1.01 0.00 0.00 176.35 175.14 1yho s LYS 68 N 7.95 0.22 0.00 1.70 1.02 -1.26 -4.09 119.74 125.28 1yho s LYS 68 Ca 0.83 0.24 0.00 0.00 0.02 0.00 0.00 55.97 57.07 1yho s LYS 68 Cb -0.12 -1.74 0.00 0.00 -0.52 0.00 0.00 37.83 35.45 1yho s LYS 68 CO 0.11 -2.81 0.00 0.41 -0.92 0.00 0.00 175.35 172.14 1yho n GLY 69 N -1.55 2.76 3.04 -3.33 0.00 -1.26 -4.98 105.19 99.88 1yho n GLY 69 Ca 0.08 -0.45 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 1yho n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yho s ARG 70 N 0.00 0.45 -0.02 1.61 0.52 -1.26 -4.79 118.95 115.46 1yho s ARG 70 Ca 0.00 -0.76 -0.30 0.00 -0.52 0.00 0.00 55.73 54.15 1yho s ARG 70 Cb 0.00 0.17 -0.05 0.00 0.52 0.00 0.00 34.95 35.59 1yho s ARG 70 CO 0.00 -0.09 1.41 0.42 0.02 0.00 0.00 175.30 177.06 1yho s ILE 71 N -2.25 3.77 -0.13 1.52 -1.09 -0.31 -4.89 121.20 117.82 1yho s ILE 71 Ca -0.08 1.11 -0.18 0.00 -2.23 0.00 0.00 60.65 59.27 1yho s ILE 71 Cb -0.04 -3.72 -0.04 0.00 -1.58 0.00 0.00 42.46 37.08 1yho s ILE 71 CO -0.04 -0.02 0.46 0.20 -1.23 0.00 0.00 174.94 174.32 1yho s ASN 72 N 2.03 6.64 -0.06 3.58 0.01 -1.26 -0.12 114.94 125.76 1yho s ASN 72 Ca 0.64 0.77 0.01 0.00 -0.71 0.00 0.00 52.86 53.56 1yho s ASN 72 Cb -0.30 -2.28 0.02 0.00 0.41 0.00 0.00 41.25 39.10 1yho s ASN 72 CO 0.25 -0.01 -0.07 -0.22 -1.51 0.00 0.00 177.10 175.54 1yho s LEU 73 N 0.73 1.33 -0.01 0.60 0.20 0.41 -0.53 118.68 121.41 1yho s LEU 73 Ca 0.25 -0.21 0.00 0.00 0.69 0.00 0.00 54.13 54.86 1yho s LEU 73 Cb -0.15 -0.63 -0.04 0.00 -0.43 0.00 0.00 46.19 44.94 1yho s LEU 73 CO 0.10 -0.05 0.04 -0.69 -0.29 0.00 0.00 176.35 175.45 1yho s VAL 74 N 1.07 4.45 -0.34 1.68 1.01 -0.61 0.00 120.40 127.66 1yho s VAL 74 Ca -0.08 -0.47 -0.00 0.00 0.00 0.00 0.00 61.98 61.43 1yho s VAL 74 Cb -0.14 -3.00 0.08 0.00 0.00 0.00 0.00 36.38 33.32 1yho s VAL 74 CO -0.01 0.39 0.06 -0.76 0.00 0.00 0.00 175.10 174.78 1yho s LEU 75 N -1.58 4.48 -0.03 3.92 1.43 -0.71 -1.91 118.68 124.29 1yho s LEU 75 Ca 0.20 -1.74 -0.01 0.00 -1.03 0.00 0.00 54.13 51.56 1yho s LEU 75 Cb -0.12 -1.71 0.03 0.00 0.03 0.00 0.00 46.19 44.42 1yho s LEU 75 CO 0.11 -0.37 0.04 -0.55 0.23 0.00 0.00 176.35 175.81 1yho s SER 76 N 1.33 0.44 0.01 2.29 0.15 -0.56 -4.19 113.70 113.17 1yho s SER 76 Ca 0.02 0.05 0.10 0.00 0.70 0.00 0.00 55.95 56.83 1yho s SER 76 Cb -0.21 -0.10 -0.23 0.00 -1.71 0.00 0.00 66.02 63.78 1yho s SER 76 CO -0.04 -0.17 0.85 -0.09 1.20 0.00 0.00 173.24 174.99 1yho h ARG 77 N 7.67 0.01 0.04 5.44 2.43 -1.76 -3.34 114.38 124.86 1yho h ARG 77 Ca -0.35 -0.01 -0.24 0.00 -0.81 0.00 0.00 59.98 58.57 1yho h ARG 77 Cb 1.12 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 1yho h ARG 77 CO 0.37 0.67 -1.03 0.93 -1.51 0.00 0.00 179.97 179.40 1yho h GLU 78 N 0.00 0.39 -6.81 0.20 4.39 -1.96 -3.45 114.58 107.35 1yho h GLU 78 Ca -0.20 -0.47 -0.49 0.00 0.34 0.00 0.00 59.36 58.53 1yho h GLU 78 Cb 1.94 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 30.74 1yho h GLU 78 CO 0.10 1.15 0.41 -0.51 -1.16 0.00 0.00 179.01 179.00 1yho s LEU 79 N -7.60 4.53 -0.20 1.33 1.43 -1.26 -4.96 118.68 111.95 1yho s LEU 79 Ca -0.06 2.10 0.11 0.00 -1.03 0.00 0.00 54.13 55.25 1yho s LEU 79 Cb 0.08 -3.70 -0.20 0.00 0.03 0.00 0.00 46.19 42.40 1yho s LEU 79 CO 0.87 -0.06 -0.03 1.17 0.23 0.00 0.00 176.35 178.54 1yho n LYS 80 N 1.13 0.90 -4.86 1.70 4.81 -1.26 -4.88 118.16 115.70 1yho n LYS 80 Ca -0.01 0.04 -0.33 0.00 -0.87 0.00 0.00 58.31 57.14 1yho n LYS 80 Cb 0.46 -1.46 -0.13 0.00 0.02 0.00 0.00 35.03 33.93 1yho n LYS 80 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1yho s GLU 81 N -2.44 2.57 0.53 1.64 2.56 -1.26 -5.08 118.70 117.21 1yho s GLU 81 Ca -0.16 -0.68 -0.22 0.00 0.00 0.00 0.00 54.97 53.90 1yho s GLU 81 Cb 0.06 -2.41 -0.05 0.00 2.00 0.00 0.00 34.13 33.73 1yho s GLU 81 CO 0.66 0.61 1.35 -1.25 -0.56 0.00 0.00 175.26 176.07 1yho s PRO 82 N -0.69 3.26 0.62 4.30 0.04 -1.26 -4.99 135.00 136.29 1yho s PRO 82 Ca 0.10 2.22 -0.15 0.00 0.04 0.00 0.00 61.00 63.21 1yho s PRO 82 Cb -0.11 -2.32 -0.02 0.00 0.04 0.00 0.00 34.50 32.09 1yho s PRO 82 CO 0.01 -1.09 1.08 -1.25 0.04 0.00 0.00 177.00 175.79 1yho s PRO 83 N -2.83 3.10 0.22 0.56 0.04 -1.26 -4.96 135.00 129.86 1yho s PRO 83 Ca 0.69 1.26 -0.32 0.00 0.04 0.00 0.00 61.00 62.68 1yho s PRO 83 Cb -0.40 -2.00 -0.12 0.00 0.04 0.00 0.00 34.50 32.02 1yho s PRO 83 CO 0.48 -1.00 1.70 0.94 0.04 0.00 0.00 177.00 179.16 1yho n GLN 84 N -2.24 2.74 0.00 4.56 -0.06 -1.26 -1.85 117.38 119.27 1yho n GLN 84 Ca 0.09 0.99 0.00 0.00 -2.00 0.00 0.00 57.00 56.08 1yho n GLN 84 Cb 0.53 -2.82 0.00 0.00 -4.06 0.00 0.00 30.24 23.88 1yho n GLN 84 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1yho n GLY 85 N 3.74 3.19 3.82 1.69 0.00 -1.26 -4.98 105.19 111.40 1yho n GLY 85 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 1yho n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yho s ALA 86 N -2.92 2.93 -0.13 4.61 0.00 -0.77 -4.76 121.76 120.72 1yho s ALA 86 Ca 0.00 0.30 0.05 0.00 0.00 0.00 0.00 51.96 52.31 1yho s ALA 86 Cb 0.00 -3.17 -0.23 0.00 0.00 0.00 0.00 23.12 19.71 1yho s ALA 86 CO 0.00 -0.44 0.30 0.72 0.00 0.00 0.00 175.76 176.35 1yho n HIS 87 N -1.66 0.75 -3.63 0.00 8.25 0.31 -4.93 115.22 114.32 1yho n HIS 87 Ca 0.08 0.21 -0.13 0.00 -0.26 0.00 0.00 57.72 57.61 1yho n HIS 87 Cb 0.53 -1.12 -0.06 0.00 1.12 0.00 0.00 29.99 30.47 1yho n HIS 87 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1yho s PHE 88 N -2.55 -0.34 -0.00 4.41 0.08 -1.03 -5.03 117.98 113.51 1yho s PHE 88 Ca -0.17 0.37 0.01 0.00 0.12 0.00 0.00 56.93 57.25 1yho s PHE 88 Cb 0.07 0.27 0.00 0.00 -0.57 0.00 0.00 43.02 42.79 1yho s PHE 88 CO 0.77 -0.59 -0.03 -1.17 -0.10 0.00 0.00 175.22 174.10 1yho s LEU 89 N -1.91 1.94 0.07 -0.37 2.96 -1.26 -1.57 118.68 118.53 1yho s LEU 89 Ca -0.06 -0.05 0.07 0.00 -0.22 0.00 0.00 54.13 53.87 1yho s LEU 89 Cb -0.01 -0.15 -0.03 0.00 0.50 0.00 0.00 46.19 46.50 1yho s LEU 89 CO -0.01 0.02 -0.18 -0.44 -1.32 0.00 0.00 176.35 174.42 1yho s SER 90 N 0.02 2.20 0.18 3.68 0.01 -0.80 -4.95 113.70 114.04 1yho s SER 90 Ca 0.00 -0.57 0.01 0.00 1.31 0.00 0.00 55.95 56.70 1yho s SER 90 Cb -0.02 -0.14 0.04 0.00 0.21 0.00 0.00 66.02 66.11 1yho s SER 90 CO -0.00 0.07 1.41 0.03 0.41 0.00 0.00 173.24 175.16 1yho h ARG 91 N 4.54 0.26 -4.08 12.44 3.08 -1.90 -1.50 114.38 127.22 1yho h ARG 91 Ca -0.42 -0.25 -0.13 0.00 0.07 0.00 0.00 59.98 59.24 1yho h ARG 91 Cb 1.18 0.06 -0.13 0.00 0.08 0.00 0.00 29.97 31.16 1yho h ARG 91 CO 0.42 0.94 -0.43 0.45 -1.07 0.00 0.00 179.97 180.28 1yho s SER 92 N -6.95 0.12 0.33 7.04 0.15 -1.26 -3.12 113.70 110.01 1yho s SER 92 Ca -0.04 -1.02 0.01 0.00 0.70 0.00 0.00 55.95 55.61 1yho s SER 92 Cb 0.10 0.40 0.57 0.00 -1.71 0.00 0.00 66.02 65.39 1yho s SER 92 CO 0.83 -0.86 1.97 0.25 1.20 0.00 0.00 173.24 176.62 1yho h LEU 93 N 2.62 0.75 -1.03 3.45 5.85 -1.99 -2.10 115.31 122.85 1yho h LEU 93 Ca -0.33 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.36 1yho h LEU 93 Cb 1.22 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 42.01 1yho h LEU 93 CO 0.51 0.59 0.66 0.44 -0.34 0.00 0.00 178.44 180.29 1yho h ASP 94 N 0.86 1.13 -0.10 1.25 5.19 -1.98 0.13 116.42 122.89 1yho h ASP 94 Ca 0.22 -0.03 -0.03 0.00 -0.62 0.00 0.00 57.03 56.58 1yho h ASP 94 Cb -0.01 -0.28 -0.00 0.00 0.18 0.00 0.00 39.33 39.22 1yho h ASP 94 CO -0.04 0.81 -0.04 0.44 -3.12 0.00 0.00 179.24 177.29 1yho h ASP 95 N 1.33 0.22 -0.47 6.45 5.19 -1.81 -1.54 116.42 125.78 1yho h ASP 95 Ca 0.37 -0.41 -0.04 0.00 -0.62 0.00 0.00 57.03 56.33 1yho h ASP 95 Cb -0.14 -0.06 -0.02 0.00 0.18 0.00 0.00 39.33 39.29 1yho h ASP 95 CO -0.08 0.57 0.16 0.00 -3.12 0.00 0.00 179.24 176.77 1yho h ALA 96 N 0.65 1.30 -0.19 3.45 0.00 -1.16 -1.91 119.26 121.39 1yho h ALA 96 Ca 0.02 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.63 1yho h ALA 96 Cb 0.49 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1yho h ALA 96 CO 0.01 0.50 -0.44 -0.07 0.00 0.00 0.00 179.25 179.26 1yho h LEU 97 N 0.76 0.50 -0.60 0.00 3.38 -0.69 -2.34 115.31 116.32 1yho h LEU 97 Ca 0.18 -0.23 -0.14 0.00 0.09 0.00 0.00 57.88 57.78 1yho h LEU 97 Cb 0.23 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1yho h LEU 97 CO -0.01 0.87 -0.35 0.50 0.09 0.00 0.00 178.44 179.55 1yho h LYS 98 N 0.38 0.73 -0.19 1.13 3.64 -0.79 -1.14 116.57 120.33 1yho h LYS 98 Ca 0.03 -0.35 -0.05 0.00 -1.27 0.00 0.00 60.65 59.01 1yho h LYS 98 Cb 0.92 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.73 1yho h LYS 98 CO 0.08 0.97 -0.06 -0.07 -2.27 0.00 0.00 179.45 178.10 1yho h LEU 99 N 0.61 0.38 -1.34 5.20 3.38 -1.25 0.16 115.31 122.45 1yho h LEU 99 Ca 0.06 -0.38 -0.06 0.00 0.09 0.00 0.00 57.88 57.59 1yho h LEU 99 Cb 0.88 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1yho h LEU 99 CO 0.08 0.67 -0.30 0.00 0.09 0.00 0.00 178.44 178.98 1yho h THR 100 N 0.08 0.96 0.00 0.22 1.03 -1.40 -2.70 112.91 111.09 1yho h THR 100 Ca 0.05 -1.14 -0.12 0.00 -0.01 0.00 0.00 66.41 65.19 1yho h THR 100 Cb 0.52 1.66 -0.02 0.00 -1.07 0.00 0.00 68.15 69.24 1yho h THR 100 CO 0.02 0.30 -0.93 -0.08 -0.01 0.00 0.00 175.52 174.81 1yho h GLU 101 N 0.00 0.00 -6.87 0.00 4.81 -1.04 -3.36 114.58 108.12 1yho h GLU 101 Ca -0.00 0.00 -0.53 0.00 -0.13 0.00 0.00 59.36 58.70 1yho h GLU 101 Cb 0.64 0.00 0.07 0.00 0.63 0.00 0.00 28.75 30.09 1yho h GLU 101 CO 0.04 0.35 0.70 -1.14 -0.73 0.00 0.00 179.01 178.22 1yho s GLN 102 N -2.99 4.28 0.59 1.92 0.74 0.55 -4.77 119.66 119.98 1yho s GLN 102 Ca 0.01 2.31 0.29 0.00 0.05 0.00 0.00 55.36 58.02 1yho s GLN 102 Cb 0.08 -3.06 1.73 0.00 1.10 0.00 0.00 33.01 32.87 1yho s GLN 102 CO 0.78 -0.31 2.18 -1.00 -0.55 0.00 0.00 175.29 176.39 1yho h PRO 103 N 3.65 0.00 -0.63 1.67 0.13 -1.90 0.42 132.00 135.34 1yho h PRO 103 Ca -0.49 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.62 1yho h PRO 103 Cb 1.23 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 1yho h PRO 103 CO 0.68 0.00 0.31 0.93 -0.23 0.00 0.00 178.00 179.69 1yho h GLU 104 N 0.00 0.88 0.00 0.86 5.08 -1.90 -3.10 114.58 116.40 1yho h GLU 104 Ca 0.04 -0.11 -0.17 0.00 -1.00 0.00 0.00 59.36 58.13 1yho h GLU 104 Cb 0.22 -0.17 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 1yho h GLU 104 CO -0.00 0.67 -2.01 1.28 -1.00 0.00 0.00 179.01 177.95 1yho n LEU 105 N -4.36 0.00 0.14 1.33 4.32 -0.61 -4.39 117.00 113.43 1yho n LEU 105 Ca 0.06 0.00 0.18 0.00 -0.02 0.00 0.00 56.01 56.23 1yho n LEU 105 Cb 0.12 0.23 0.77 0.00 -1.62 0.00 0.00 43.42 42.92 1yho n LEU 105 CO 0.38 0.23 1.16 0.00 -1.22 0.00 0.00 177.39 177.94 1yho h ALA 106 N 1.22 2.02 0.00 -1.18 0.00 -0.15 0.83 119.26 122.01 1yho h ALA 106 Ca -0.25 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.49 1yho h ALA 106 Cb 1.49 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.28 1yho h ALA 106 CO 0.01 -0.46 -0.76 -0.91 0.00 0.00 0.00 179.25 177.13 1yho h ASN 107 N 0.00 0.00 0.18 0.00 2.35 -1.74 -3.32 115.58 113.04 1yho h ASN 107 Ca 0.15 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.55 1yho h ASN 107 Cb 0.75 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.07 1yho h ASN 107 CO -0.00 0.76 -2.12 0.29 -1.65 0.00 0.00 177.43 174.71 1yho n LYS 108 N -3.48 0.68 -4.20 0.81 5.02 0.49 -4.94 118.16 112.53 1yho n LYS 108 Ca -0.00 0.17 -0.31 0.00 -2.02 0.00 0.00 58.31 56.14 1yho n LYS 108 Cb 0.78 -1.64 -0.08 0.00 -0.02 0.00 0.00 35.03 34.06 1yho n LYS 108 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1yho s VAL 109 N -2.54 4.07 0.03 -0.18 1.01 0.26 -3.72 120.40 119.31 1yho s VAL 109 Ca -0.15 -0.82 -0.01 0.00 0.00 0.00 0.00 61.98 61.00 1yho s VAL 109 Cb 0.07 -2.88 -0.00 0.00 0.00 0.00 0.00 36.38 33.57 1yho s VAL 109 CO 0.77 0.23 -0.02 -0.67 0.00 0.00 0.00 175.10 175.42 1yho n ASP 110 N 0.94 0.53 -4.43 3.32 2.03 -1.09 -4.42 116.55 113.43 1yho n ASP 110 Ca -0.12 0.07 -0.27 0.00 0.52 0.00 0.00 54.79 54.99 1yho n ASP 110 Cb 0.52 -0.21 -0.12 0.00 -0.72 0.00 0.00 41.12 40.59 1yho n ASP 110 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1yho s MET 111 N -1.49 1.54 0.08 -0.67 -1.94 -1.26 -2.48 119.30 113.07 1yho s MET 111 Ca -0.02 -1.55 0.05 0.00 -1.71 0.00 0.00 55.69 52.45 1yho s MET 111 Cb 0.00 -1.84 -0.04 0.00 2.01 0.00 0.00 34.83 34.97 1yho s MET 111 CO 0.03 0.39 -0.01 0.08 -0.01 0.00 0.00 175.02 175.50 1yho s VAL 112 N -1.76 3.95 -0.10 -6.03 1.01 -0.50 -2.13 120.40 114.84 1yho s VAL 112 Ca 0.22 -0.96 -0.00 0.00 0.00 0.00 0.00 61.98 61.24 1yho s VAL 112 Cb -0.08 -2.86 0.02 0.00 0.00 0.00 0.00 36.38 33.47 1yho s VAL 112 CO 0.10 0.17 -0.06 0.26 0.00 0.00 0.00 175.10 175.57 1yho s TRP 113 N -1.26 1.34 -0.24 5.22 0.52 0.12 -1.11 118.94 123.52 1yho s TRP 113 Ca 0.24 -0.63 -0.22 0.00 0.02 0.00 0.00 56.10 55.51 1yho s TRP 113 Cb -0.12 -1.15 -0.01 0.00 -1.15 0.00 0.00 33.47 31.04 1yho s TRP 113 CO 0.16 -0.47 0.71 0.42 0.02 0.00 0.00 176.95 177.79 1yho s ILE 114 N 1.71 4.93 -0.30 2.03 1.09 0.10 0.11 121.20 130.87 1yho s ILE 114 Ca 0.04 1.30 0.07 0.00 -1.10 0.00 0.00 60.65 60.96 1yho s ILE 114 Cb -0.13 -4.00 0.46 0.00 -1.06 0.00 0.00 42.46 37.73 1yho s ILE 114 CO -0.07 -0.00 1.22 0.52 -0.10 0.00 0.00 174.94 176.50 1yho n VAL 115 N 5.17 2.56 0.00 2.92 0.31 0.18 -2.27 118.33 127.19 1yho n VAL 115 Ca 0.02 -4.14 0.00 0.00 -0.01 0.00 0.00 64.34 60.20 1yho n VAL 115 Cb 0.48 -1.11 0.00 0.00 -0.91 0.00 0.00 33.84 32.31 1yho n VAL 115 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1yho n GLY 116 N -0.73 0.14 0.00 2.92 0.00 -1.25 -4.71 105.19 101.56 1yho n GLY 116 Ca 0.44 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1yho n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yho n GLY 117 N 0.23 1.59 0.26 -0.02 0.00 -1.26 -2.12 105.19 103.87 1yho n GLY 117 Ca 0.00 -1.76 -0.09 0.00 0.00 0.00 0.00 46.02 44.18 1yho n GLY 117 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1yho h SER 118 N 0.00 0.83 -0.49 1.61 0.02 -1.99 -2.25 113.55 111.28 1yho h SER 118 Ca 0.00 -0.24 0.04 0.00 -0.84 0.00 0.00 61.79 60.75 1yho h SER 118 Cb 0.00 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.28 1yho h SER 118 CO 0.00 0.86 0.25 -1.28 -1.14 0.00 0.00 176.83 175.52 1yho h SER 119 N 0.77 0.36 -0.65 3.07 0.87 -2.00 -0.20 113.55 115.77 1yho h SER 119 Ca 0.17 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.71 1yho h SER 119 Cb 0.37 -0.04 -0.03 0.00 -0.44 0.00 0.00 62.40 62.25 1yho h SER 119 CO 0.01 0.25 0.27 0.58 -0.53 0.00 0.00 176.83 177.41 1yho h VAL 120 N 0.49 1.23 -0.52 2.23 2.07 -1.82 -2.46 116.25 117.47 1yho h VAL 120 Ca 0.21 -0.73 -0.10 0.00 0.82 0.00 0.00 66.70 66.90 1yho h VAL 120 Cb 0.11 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 1yho h VAL 120 CO -0.14 0.29 -0.06 0.22 0.02 0.00 0.00 177.57 177.90 1yho h TYR 121 N 0.98 1.01 0.36 1.57 5.03 -0.75 -1.33 116.97 123.84 1yho h TYR 121 Ca 0.23 -0.18 -0.02 0.00 2.58 0.00 0.00 58.73 61.34 1yho h TYR 121 Cb 0.19 -0.26 0.00 0.00 1.55 0.00 0.00 36.73 38.21 1yho h TYR 121 CO 0.02 0.94 -0.17 -0.22 -1.32 0.00 0.00 178.16 177.40 1yho h LYS 122 N 0.84 -0.47 -0.29 1.82 3.64 -0.63 0.38 116.57 121.87 1yho h LYS 122 Ca 0.14 0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1yho h LYS 122 Cb 0.58 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.49 1yho h LYS 122 CO 0.04 -0.30 0.17 0.93 -2.27 0.00 0.00 179.45 178.02 1yho h GLU 123 N -0.50 0.39 0.00 1.90 3.07 -1.42 -2.18 114.58 115.83 1yho h GLU 123 Ca -0.05 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 58.74 1yho h GLU 123 Cb 0.38 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 1yho h GLU 123 CO 0.08 0.31 -0.18 0.00 -1.40 0.00 0.00 179.01 177.83 1yho h ALA 124 N 1.06 1.33 -0.01 3.43 0.00 -1.14 -2.36 119.26 121.56 1yho h ALA 124 Ca 0.10 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1yho h ALA 124 Cb 0.02 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1yho h ALA 124 CO -0.02 0.22 0.05 1.98 0.00 0.00 0.00 179.25 181.49 1yho h MET 125 N 0.00 0.00 -0.74 0.00 -1.53 0.45 0.33 114.93 113.43 1yho h MET 125 Ca -0.00 0.00 -0.05 0.00 -3.44 0.00 0.00 59.70 56.21 1yho h MET 125 Cb 0.42 0.00 -0.03 0.00 -0.55 0.00 0.00 31.60 31.45 1yho h MET 125 CO 0.02 0.00 0.06 0.09 0.14 0.00 0.00 176.91 177.22 1yho n ASN 126 N -3.19 4.27 -4.61 1.39 4.13 -0.89 -4.92 115.26 111.45 1yho n ASN 126 Ca -0.03 -2.72 -0.43 0.00 1.68 0.00 0.00 54.58 53.08 1yho n ASN 126 Cb 0.12 -0.65 -0.02 0.00 -1.54 0.00 0.00 39.78 37.69 1yho n ASN 126 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 1yho s HIS 127 N -2.26 2.19 0.21 3.10 3.76 0.10 -4.89 115.29 117.51 1yho s HIS 127 Ca 0.39 0.65 -0.04 0.00 -0.15 0.00 0.00 55.06 55.91 1yho s HIS 127 Cb 0.30 -4.14 0.19 0.00 1.11 0.00 0.00 32.58 30.04 1yho s HIS 127 CO 0.11 -2.45 1.62 -1.35 -0.85 0.00 0.00 174.74 171.82 1yho h PRO 128 N 11.16 0.75 0.00 8.40 0.11 -1.91 -3.45 132.00 147.05 1yho h PRO 128 Ca -0.31 -0.31 -0.27 0.00 0.11 0.00 0.00 66.00 65.22 1yho h PRO 128 Cb 1.13 -0.03 0.12 0.00 0.11 0.00 0.00 31.00 32.34 1yho h PRO 128 CO 1.04 0.92 0.15 0.41 -0.21 0.00 0.00 178.00 180.31 1yho n GLY 129 N -0.20 -2.21 3.71 -0.55 0.00 -1.26 -4.42 105.19 100.27 1yho n GLY 129 Ca -0.00 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 1yho n GLY 129 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yho s HIS 130 N -2.51 2.69 -0.09 1.61 3.76 -1.26 -4.87 115.29 114.62 1yho s HIS 130 Ca 0.47 0.28 -0.08 0.00 -0.15 0.00 0.00 55.06 55.59 1yho s HIS 130 Cb -0.03 -4.11 0.02 0.00 1.11 0.00 0.00 32.58 29.57 1yho s HIS 130 CO 0.35 -4.30 0.23 -1.17 -0.85 0.00 0.00 174.74 169.00 1yho s LEU 131 N 1.70 1.06 -0.07 0.89 2.96 -1.26 -4.21 118.68 119.76 1yho s LEU 131 Ca 0.76 0.47 0.02 0.00 -0.22 0.00 0.00 54.13 55.15 1yho s LEU 131 Cb -0.47 0.78 -0.03 0.00 0.50 0.00 0.00 46.19 46.97 1yho s LEU 131 CO 0.33 -0.09 -0.10 -0.54 -1.32 0.00 0.00 176.35 174.64 1yho s LYS 132 N 0.22 2.73 -0.16 1.98 1.02 -0.81 -0.98 119.74 123.74 1yho s LYS 132 Ca -0.01 -0.61 -0.01 0.00 0.02 0.00 0.00 55.97 55.37 1yho s LYS 132 Cb -0.02 -2.53 0.04 0.00 -0.52 0.00 0.00 37.83 34.80 1yho s LYS 132 CO -0.00 0.61 -0.05 -0.51 -0.92 0.00 0.00 175.35 174.47 1yho s LEU 133 N -0.67 1.59 -0.35 3.17 1.43 0.24 0.26 118.68 124.34 1yho s LEU 133 Ca 0.10 -0.65 -0.10 0.00 -1.03 0.00 0.00 54.13 52.45 1yho s LEU 133 Cb -0.11 -0.90 0.02 0.00 0.03 0.00 0.00 46.19 45.22 1yho s LEU 133 CO 0.01 -0.18 0.19 -0.36 0.23 0.00 0.00 176.35 176.24 1yho s PHE 134 N 1.64 3.22 -0.09 0.29 0.40 0.28 0.10 117.98 123.83 1yho s PHE 134 Ca 0.01 -0.84 -0.01 0.00 -0.60 0.00 0.00 56.93 55.48 1yho s PHE 134 Cb -0.15 -2.41 -0.03 0.00 0.51 0.00 0.00 43.02 40.94 1yho s PHE 134 CO -0.08 -0.59 -0.03 0.14 0.70 0.00 0.00 175.22 175.37 1yho s VAL 135 N 1.57 4.04 -0.18 -0.44 -7.23 -0.39 -0.02 120.40 117.75 1yho s VAL 135 Ca 0.03 -0.35 -0.04 0.00 -1.81 0.00 0.00 61.98 59.82 1yho s VAL 135 Cb -0.18 -2.69 -0.02 0.00 0.56 0.00 0.00 36.38 34.05 1yho s VAL 135 CO 0.06 0.59 -0.04 -0.89 -0.31 0.00 0.00 175.10 174.51 1yho s THR 136 N -0.71 3.63 -0.39 5.32 2.01 -0.44 -0.69 115.64 124.38 1yho s THR 136 Ca 0.11 -0.43 -0.14 0.00 0.31 0.00 0.00 61.69 61.54 1yho s THR 136 Cb -0.11 -2.61 0.01 0.00 0.01 0.00 0.00 72.50 69.80 1yho s THR 136 CO 0.02 0.46 0.26 -0.13 -0.69 0.00 0.00 174.62 174.54 1yho s ARG 137 N 0.84 3.04 -0.43 4.92 0.52 -0.60 0.10 118.95 127.35 1yho s ARG 137 Ca -0.01 -0.96 -0.21 0.00 -0.52 0.00 0.00 55.73 54.03 1yho s ARG 137 Cb -0.15 -3.88 0.02 0.00 0.52 0.00 0.00 34.95 31.47 1yho s ARG 137 CO 0.02 -0.67 0.69 0.42 0.02 0.00 0.00 175.30 175.77 1yho s ILE 138 N 1.66 4.78 -1.36 1.52 -1.09 -0.14 -0.05 121.20 126.51 1yho s ILE 138 Ca 0.05 0.29 -0.15 0.00 -2.23 0.00 0.00 60.65 58.60 1yho s ILE 138 Cb -0.19 -4.22 0.00 0.00 -1.58 0.00 0.00 42.46 36.47 1yho s ILE 138 CO 0.09 -0.59 2.23 0.80 -1.23 0.00 0.00 174.94 176.24 1yho n MET 139 N 6.37 2.69 -3.63 2.79 1.56 0.46 -0.99 117.12 126.38 1yho n MET 139 Ca -0.00 -2.44 -0.04 0.00 -0.27 0.00 0.00 57.70 54.94 1yho n MET 139 Cb 0.48 -3.19 -0.06 0.00 2.15 0.00 0.00 33.22 32.60 1yho n MET 139 CO 0.00 0.00 0.00 -1.14 -0.73 0.00 0.00 175.97 174.10 1yho s GLN 140 N 3.41 0.60 0.00 2.12 2.00 -1.26 -4.42 119.66 122.11 1yho s GLN 140 Ca 0.50 1.16 -0.30 0.00 -2.00 0.00 0.00 55.36 54.72 1yho s GLN 140 Cb 0.14 0.32 -0.07 0.00 0.80 0.00 0.00 33.01 34.20 1yho s GLN 140 CO -0.06 -0.15 1.80 0.16 -0.50 0.00 0.00 175.29 176.55 1yho s ASP 141 N 1.93 6.56 -0.08 6.67 -4.77 -1.26 -4.43 116.67 121.29 1yho s ASP 141 Ca -0.08 2.47 -0.11 0.00 -3.30 0.00 0.00 52.55 51.53 1yho s ASP 141 Cb -0.06 -2.53 0.02 0.00 -1.09 0.00 0.00 42.92 39.25 1yho s ASP 141 CO -0.19 -0.98 0.28 -0.36 0.70 0.00 0.00 175.17 174.62 1yho s PHE 142 N 4.11 -0.25 0.26 2.11 0.08 -1.26 -5.09 117.98 117.93 1yho s PHE 142 Ca 0.81 0.57 -0.30 0.00 0.12 0.00 0.00 56.93 58.13 1yho s PHE 142 Cb -0.38 0.09 -0.09 0.00 -0.57 0.00 0.00 43.02 42.06 1yho s PHE 142 CO 0.35 -0.22 1.21 -1.21 -0.10 0.00 0.00 175.22 175.26 1yho s GLU 143 N -0.32 4.49 0.04 0.44 2.02 -1.26 -4.89 118.70 119.21 1yho s GLU 143 Ca -0.04 1.97 0.01 0.00 0.02 0.00 0.00 54.97 56.92 1yho s GLU 143 Cb -0.03 -3.17 -0.03 0.00 0.10 0.00 0.00 34.13 31.00 1yho s GLU 143 CO 0.01 -0.04 -0.05 -1.12 0.02 0.00 0.00 175.26 174.09 1yho s SER 144 N -0.33 0.58 -0.22 -0.19 0.01 -1.26 -4.61 113.70 107.68 1yho s SER 144 Ca 0.50 -0.66 -0.06 0.00 1.31 0.00 0.00 55.95 57.04 1yho s SER 144 Cb -0.35 0.10 -0.12 0.00 0.21 0.00 0.00 66.02 65.86 1yho s SER 144 CO 0.42 -0.34 -0.25 -0.67 0.41 0.00 0.00 173.24 172.82 1yho n ASP 145 N 1.11 1.93 -4.81 2.44 -0.08 -0.85 -4.92 116.55 111.36 1yho n ASP 145 Ca -0.20 0.11 -0.36 0.00 -1.51 0.00 0.00 54.79 52.82 1yho n ASP 145 Cb 0.57 -0.52 -0.07 0.00 2.34 0.00 0.00 41.12 43.44 1yho n ASP 145 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1yho s THR 146 N -2.42 5.46 0.00 5.18 2.01 -1.02 -5.04 115.64 119.81 1yho s THR 146 Ca -0.30 0.22 -0.01 0.00 0.31 0.00 0.00 61.69 61.90 1yho s THR 146 Cb 0.10 -3.44 -0.04 0.00 0.01 0.00 0.00 72.50 69.13 1yho s THR 146 CO 0.44 0.54 0.14 -0.36 -0.69 0.00 0.00 174.62 174.69 1yho s PHE 147 N -0.42 3.44 -0.10 4.92 0.08 -1.26 -2.22 117.98 122.42 1yho s PHE 147 Ca 0.12 0.28 -0.21 0.00 0.12 0.00 0.00 56.93 57.24 1yho s PHE 147 Cb -0.12 -1.78 -0.04 0.00 -0.57 0.00 0.00 43.02 40.52 1yho s PHE 147 CO 0.02 0.60 0.60 0.12 -0.10 0.00 0.00 175.22 176.46 1yho s PHE 148 N -1.30 3.54 0.63 0.36 5.36 -0.17 -4.92 117.98 121.48 1yho s PHE 148 Ca 0.27 1.08 -0.18 0.00 -0.96 0.00 0.00 56.93 57.14 1yho s PHE 148 Cb -0.12 -2.69 -0.04 0.00 -0.34 0.00 0.00 43.02 39.82 1yho s PHE 148 CO 0.18 0.11 0.86 -2.30 -1.46 0.00 0.00 175.22 172.61 1yho n PRO 149 N 3.79 0.71 -2.47 10.12 -0.02 -1.26 -4.93 135.00 140.93 1yho n PRO 149 Ca -0.04 0.28 -0.41 0.00 -2.02 0.00 0.00 63.50 61.32 1yho n PRO 149 Cb 0.51 -2.08 -0.04 0.00 -0.02 0.00 0.00 33.50 31.87 1yho n PRO 149 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1yho s GLU 150 N -2.77 4.59 0.17 -0.52 2.02 -1.26 -5.02 118.70 115.91 1yho s GLU 150 Ca 0.74 1.78 -0.20 0.00 0.02 0.00 0.00 54.97 57.31 1yho s GLU 150 Cb -0.40 -3.24 -0.08 0.00 0.10 0.00 0.00 34.13 30.51 1yho s GLU 150 CO 0.49 0.09 0.69 0.42 0.02 0.00 0.00 175.26 176.97 1yho s ILE 151 N -0.53 4.58 -0.25 -1.63 -1.09 -1.26 -5.06 121.20 115.96 1yho s ILE 151 Ca 0.48 1.33 -0.10 0.00 -2.23 0.00 0.00 60.65 60.12 1yho s ILE 151 Cb -0.31 -3.92 -0.05 0.00 -1.58 0.00 0.00 42.46 36.60 1yho s ILE 151 CO 0.37 0.35 0.17 -1.81 -1.23 0.00 0.00 174.94 172.79 1yho s ASP 152 N -1.43 6.02 0.29 3.58 1.11 -1.26 -4.97 116.67 120.01 1yho s ASP 152 Ca 0.38 0.05 0.13 0.00 0.18 0.00 0.00 52.55 53.29 1yho s ASP 152 Cb -0.19 -2.10 0.36 0.00 1.07 0.00 0.00 42.92 42.07 1yho s ASP 152 CO 0.22 0.02 1.59 -0.07 1.18 0.00 0.00 175.17 178.11 1yho h LEU 153 N 7.86 0.00 -1.40 1.23 3.38 -1.98 0.61 115.31 125.02 1yho h LEU 153 Ca -0.37 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.54 1yho h LEU 153 Cb 1.18 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1yho h LEU 153 CO 0.61 0.57 -0.26 -0.08 0.09 0.00 0.00 178.44 179.38 1yho h GLU 154 N 0.00 0.06 0.00 1.13 4.57 -2.02 -3.21 114.58 115.11 1yho h GLU 154 Ca -0.01 -0.02 -0.27 0.00 -1.18 0.00 0.00 59.36 57.89 1yho h GLU 154 Cb 1.15 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.68 1yho h GLU 154 CO 0.07 0.32 -2.02 1.63 -1.18 0.00 0.00 179.01 177.83 1yho n LYS 155 N -4.21 1.46 -4.24 1.92 5.02 -1.16 -5.00 118.16 111.96 1yho n LYS 155 Ca -0.02 0.01 -0.29 0.00 -2.02 0.00 0.00 58.31 55.99 1yho n LYS 155 Cb 0.33 -1.38 -0.10 0.00 -0.02 0.00 0.00 35.03 33.86 1yho n LYS 155 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1yho s TYR 156 N -2.36 2.72 -0.07 2.13 1.51 0.21 -2.04 117.35 119.44 1yho s TYR 156 Ca -0.09 -0.17 -0.03 0.00 -1.01 0.00 0.00 57.07 55.77 1yho s TYR 156 Cb 0.05 -1.41 -0.04 0.00 -0.11 0.00 0.00 41.96 40.45 1yho s TYR 156 CO 0.58 0.44 0.07 0.15 -1.11 0.00 0.00 175.55 175.68 1yho s LYS 157 N -2.31 3.15 -0.35 -0.62 3.01 -0.00 -3.98 119.74 118.64 1yho s LYS 157 Ca 0.22 -0.34 -0.20 0.00 -1.01 0.00 0.00 55.97 54.63 1yho s LYS 157 Cb -0.11 -2.93 0.00 0.00 -1.01 0.00 0.00 37.83 33.78 1yho s LYS 157 CO 0.14 0.71 0.62 -1.17 0.51 0.00 0.00 175.35 176.16 1yho s LEU 158 N -1.17 4.25 -0.62 3.17 0.20 -1.26 -1.95 118.68 121.29 1yho s LEU 158 Ca 0.17 0.16 -0.04 0.00 0.69 0.00 0.00 54.13 55.11 1yho s LEU 158 Cb -0.12 -2.77 0.16 0.00 -0.43 0.00 0.00 46.19 43.03 1yho s LEU 158 CO 0.06 -0.57 0.45 -0.76 -0.29 0.00 0.00 176.35 175.24 1yho s LEU 159 N 2.67 5.35 0.06 -0.68 2.01 0.24 -4.94 118.68 123.39 1yho s LEU 159 Ca 0.24 -2.78 -0.19 0.00 0.01 0.00 0.00 54.13 51.40 1yho s LEU 159 Cb -0.15 -1.88 -0.12 0.00 0.01 0.00 0.00 46.19 44.05 1yho s LEU 159 CO 0.14 -0.40 1.39 1.55 1.01 0.00 0.00 176.35 180.05 1yho h PRO 160 N 7.16 0.43 -4.59 1.29 0.13 -1.93 -1.40 132.00 133.09 1yho h PRO 160 Ca -0.02 -0.21 -0.70 0.00 -0.87 0.00 0.00 66.00 64.21 1yho h PRO 160 Cb 0.96 -0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.78 1yho h PRO 160 CO 0.72 0.76 -0.58 -1.21 -0.23 0.00 0.00 178.00 177.45 1yho s GLU 161 N -4.45 2.38 -0.11 0.86 2.02 -1.26 -4.72 118.70 113.41 1yho s GLU 161 Ca -0.14 -1.46 0.03 0.00 0.02 0.00 0.00 54.97 53.42 1yho s GLU 161 Cb 0.06 -3.49 0.01 0.00 0.10 0.00 0.00 34.13 30.80 1yho s GLU 161 CO 0.76 -0.84 -0.21 -0.47 0.02 0.00 0.00 175.26 174.52 1yho s TYR 162 N 1.29 2.42 0.40 1.61 6.14 -1.26 -5.11 117.35 122.84 1yho s TYR 162 Ca 0.01 -1.09 -0.26 0.00 0.64 0.00 0.00 57.07 56.38 1yho s TYR 162 Cb -0.21 -1.65 -0.11 0.00 0.42 0.00 0.00 41.96 40.41 1yho s TYR 162 CO -0.01 -0.48 1.16 -2.30 0.64 0.00 0.00 175.55 174.57 1yho n PRO 163 N 3.81 1.70 0.00 4.97 -0.02 -1.26 -2.39 135.00 141.81 1yho n PRO 163 Ca -0.20 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 1yho n PRO 163 Cb 0.52 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 1yho n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yho n GLY 164 N 0.97 2.74 3.84 -1.23 0.00 -1.26 -5.01 105.19 105.24 1yho n GLY 164 Ca 0.08 -0.44 -0.35 0.00 0.00 0.00 0.00 46.02 45.30 1yho n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yho s VAL 165 N -1.34 5.20 0.08 1.61 0.11 -1.01 -5.07 120.40 119.98 1yho s VAL 165 Ca 0.00 -0.04 -0.31 0.00 -2.93 0.00 0.00 61.98 58.70 1yho s VAL 165 Cb 0.00 -3.31 -0.06 0.00 -1.53 0.00 0.00 36.38 31.48 1yho s VAL 165 CO 0.00 0.51 1.27 -0.76 -3.33 0.00 0.00 175.10 172.78 1yho s LEU 166 N -1.33 4.37 -0.04 2.54 1.43 -1.26 -4.66 118.68 119.73 1yho s LEU 166 Ca 0.19 2.12 0.13 0.00 -1.03 0.00 0.00 54.13 55.53 1yho s LEU 166 Cb -0.12 -3.58 -0.23 0.00 0.03 0.00 0.00 46.19 42.29 1yho s LEU 166 CO 0.09 -0.54 0.67 -0.24 0.23 0.00 0.00 176.35 176.56 1yho n SER 167 N 3.98 0.87 -4.75 2.29 2.88 -1.26 -4.42 113.62 113.20 1yho n SER 167 Ca 0.10 0.41 -0.36 0.00 -1.33 0.00 0.00 58.87 57.69 1yho n SER 167 Cb 0.45 -0.05 0.03 0.00 -0.75 0.00 0.00 64.21 63.90 1yho n SER 167 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1yho s ASP 168 N -6.07 5.22 -0.12 -3.46 2.15 -1.26 -4.67 116.67 108.46 1yho s ASP 168 Ca -0.05 2.44 -0.29 0.00 0.43 0.00 0.00 52.55 55.08 1yho s ASP 168 Cb 0.08 -2.60 -0.04 0.00 -0.30 0.00 0.00 42.92 40.06 1yho s ASP 168 CO 0.82 -1.58 1.51 -0.69 -0.17 0.00 0.00 175.17 175.07 1yho s VAL 169 N -1.54 3.85 0.47 1.11 1.01 -1.26 -4.77 120.40 119.27 1yho s VAL 169 Ca 0.76 1.02 -0.09 0.00 0.00 0.00 0.00 61.98 63.67 1yho s VAL 169 Cb -0.32 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.32 1yho s VAL 169 CO 0.35 -0.12 0.83 -1.10 0.00 0.00 0.00 175.10 175.06 1yho s GLN 170 N 3.93 3.68 -0.04 2.72 -0.21 -0.57 -4.88 119.66 124.29 1yho s GLN 170 Ca 0.66 0.46 -0.01 0.00 0.02 0.00 0.00 55.36 56.49 1yho s GLN 170 Cb -0.28 -2.32 0.03 0.00 1.00 0.00 0.00 33.01 31.45 1yho s GLN 170 CO 0.24 -0.20 0.06 -2.00 -2.12 0.00 0.00 175.29 171.28 1yho s GLU 171 N -4.38 -0.04 -0.05 2.91 2.12 -1.26 -1.73 118.70 116.26 1yho s GLU 171 Ca 0.51 0.32 -0.02 0.00 0.36 0.00 0.00 54.97 56.14 1yho s GLU 171 Cb -0.10 -0.36 0.04 0.00 0.26 0.00 0.00 34.13 33.96 1yho s GLU 171 CO 0.39 -0.25 0.09 -2.00 -0.54 0.00 0.00 175.26 172.96 1yho s GLU 172 N 1.67 0.00 -1.64 4.30 2.56 -0.43 -4.84 118.70 120.33 1yho s GLU 172 Ca -0.02 0.35 -0.00 0.00 0.00 0.00 0.00 54.97 55.30 1yho s GLU 172 Cb -0.12 -0.29 0.00 0.00 2.00 0.00 0.00 34.13 35.72 1yho s GLU 172 CO -0.03 -0.23 0.01 1.17 -0.56 0.00 0.00 175.26 175.62 1yho n LYS 173 N 4.66 -1.86 -0.98 4.30 4.81 -1.26 -0.85 118.16 126.97 1yho n LYS 173 Ca -0.18 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 1yho n LYS 173 Cb 0.50 -5.59 0.00 0.00 0.02 0.00 0.00 35.03 29.97 1yho n LYS 173 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1yho n GLY 174 N -0.99 0.41 3.20 3.14 0.00 -1.26 -5.03 105.19 104.66 1yho n GLY 174 Ca -0.22 -0.90 -0.34 0.00 0.00 0.00 0.00 46.02 44.55 1yho n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yho s ILE 175 N -2.00 2.78 -0.08 -0.61 1.01 -0.03 -5.11 121.20 117.16 1yho s ILE 175 Ca 0.00 -0.95 -0.11 0.00 0.00 0.00 0.00 60.65 59.60 1yho s ILE 175 Cb 0.00 -2.36 -0.05 0.00 0.01 0.00 0.00 42.46 40.06 1yho s ILE 175 CO 0.00 0.29 0.25 -0.54 0.00 0.00 0.00 174.94 174.94 1yho s LYS 176 N 1.33 3.73 0.09 2.79 1.02 -1.26 -1.31 119.74 126.14 1yho s LYS 176 Ca 0.02 0.09 -0.17 0.00 0.02 0.00 0.00 55.97 55.92 1yho s LYS 176 Cb -0.16 -3.24 0.04 0.00 -0.52 0.00 0.00 37.83 33.95 1yho s LYS 176 CO -0.06 0.67 0.42 1.52 -0.92 0.00 0.00 175.35 176.98 1yho s TYR 177 N -0.82 -0.24 0.30 3.18 1.13 -0.71 -0.40 117.35 119.79 1yho s TYR 177 Ca 0.18 0.04 0.11 0.00 -1.41 0.00 0.00 57.07 55.99 1yho s TYR 177 Cb -0.14 0.26 -0.06 0.00 -1.10 0.00 0.00 41.96 40.92 1yho s TYR 177 CO 0.07 -0.66 -0.16 0.15 -2.51 0.00 0.00 175.55 172.44 1yho s LYS 178 N -3.29 1.73 -0.23 -3.49 1.02 0.92 -1.51 119.74 114.89 1yho s LYS 178 Ca -0.00 -1.83 -0.04 0.00 0.02 0.00 0.00 55.97 54.12 1yho s LYS 178 Cb 0.01 -1.75 -0.01 0.00 -0.52 0.00 0.00 37.83 35.56 1yho s LYS 178 CO -0.08 0.27 -0.03 -0.06 -0.92 0.00 0.00 175.35 174.52 1yho s PHE 179 N -2.54 2.97 0.02 3.18 0.08 -1.26 -1.55 117.98 118.88 1yho s PHE 179 Ca 0.31 -0.95 0.06 0.00 0.12 0.00 0.00 56.93 56.47 1yho s PHE 179 Cb -0.02 -2.11 -0.03 0.00 -0.57 0.00 0.00 43.02 40.28 1yho s PHE 179 CO 0.16 -0.55 -0.14 -2.00 -0.10 0.00 0.00 175.22 172.58 1yho s GLU 180 N 1.48 2.27 -0.07 0.44 2.56 0.14 -4.87 118.70 120.64 1yho s GLU 180 Ca 0.05 -0.87 0.05 0.00 0.00 0.00 0.00 54.97 54.20 1yho s GLU 180 Cb -0.14 -2.30 -0.01 0.00 2.00 0.00 0.00 34.13 33.67 1yho s GLU 180 CO -0.03 0.57 -0.22 0.08 -0.56 0.00 0.00 175.26 175.10 1yho s VAL 181 N -0.92 2.35 -0.05 3.70 1.01 -0.53 -1.26 120.40 124.71 1yho s VAL 181 Ca 0.15 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.21 1yho s VAL 181 Cb -0.11 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.39 1yho s VAL 181 CO 0.05 0.57 -0.13 -0.31 0.00 0.00 0.00 175.10 175.28 1yho s TYR 182 N -0.12 1.38 0.05 5.22 2.02 0.29 0.82 117.35 127.01 1yho s TYR 182 Ca -0.04 -0.42 0.05 0.00 -0.37 0.00 0.00 57.07 56.28 1yho s TYR 182 Cb -0.14 -0.97 -0.04 0.00 -0.40 0.00 0.00 41.96 40.41 1yho s TYR 182 CO 0.04 -0.18 -0.06 -2.00 -1.57 0.00 0.00 175.55 171.77 1yho s GLU 183 N 0.32 2.42 -0.27 -0.62 2.12 -0.82 0.81 118.70 122.66 1yho s GLU 183 Ca -0.08 -0.84 -0.10 0.00 0.36 0.00 0.00 54.97 54.32 1yho s GLU 183 Cb -0.12 -2.45 -0.04 0.00 0.26 0.00 0.00 34.13 31.77 1yho s GLU 183 CO 0.02 0.56 0.15 0.21 -0.54 0.00 0.00 175.26 175.67 1yho s LYS 184 N -1.83 3.89 -0.10 4.30 2.36 -0.16 -0.82 119.74 127.38 1yho s LYS 184 Ca 0.20 -0.35 0.00 0.00 -2.55 0.00 0.00 55.97 53.27 1yho s LYS 184 Cb -0.11 -3.55 -0.02 0.00 -1.05 0.00 0.00 37.83 33.09 1yho s LYS 184 CO 0.12 -0.14 -0.10 1.21 1.55 0.00 0.00 175.35 177.98 1yho s ASN 185 N 1.61 4.28 0.00 1.43 2.47 -0.87 -4.14 114.94 119.73 1yho s ASN 185 Ca 0.07 -0.20 0.01 0.00 0.42 0.00 0.00 52.86 53.15 1yho s ASN 185 Cb -0.15 -1.38 0.03 0.00 -1.45 0.00 0.00 41.25 38.29 1yho s ASN 185 CO 0.08 0.25 0.53 -0.67 -3.72 0.00 0.00 177.10 173.57