#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 1.37 3.43 7.63 0.00 -1.26 -5.07 105.19 111.29 1yho n GLY 2 Ca 0.00 -0.22 -0.40 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.23 5.73 -0.26 1.61 0.01 -1.26 -4.98 113.70 112.32 1yho s SER 3 Ca 0.00 -0.73 -0.04 0.00 1.31 0.00 0.00 55.95 56.49 1yho s SER 3 Cb 0.00 -2.04 0.01 0.00 0.21 0.00 0.00 66.02 64.20 1yho s SER 3 CO 0.00 -0.30 0.00 -0.76 0.41 0.00 0.00 173.24 172.60 1yho s LEU 4 N 1.61 3.43 -0.03 2.44 1.02 -1.26 -1.20 118.68 124.69 1yho s LEU 4 Ca 0.04 -0.72 0.05 0.00 0.02 0.00 0.00 54.13 53.52 1yho s LEU 4 Cb -0.18 -1.77 -0.03 0.00 0.02 0.00 0.00 46.19 44.23 1yho s LEU 4 CO 0.07 -0.14 -0.16 0.20 0.02 0.00 0.00 176.35 176.35 1yho s ASN 5 N 1.43 3.91 0.04 2.29 0.01 0.21 -2.22 114.94 120.60 1yho s ASN 5 Ca 0.02 -0.26 0.07 0.00 -0.71 0.00 0.00 52.86 51.98 1yho s ASN 5 Cb -0.16 -0.76 -0.02 0.00 0.41 0.00 0.00 41.25 40.71 1yho s ASN 5 CO -0.01 0.32 -0.20 0.00 -1.51 0.00 0.00 177.10 175.70 1yho s ILE 7 N -0.77 -0.39 -0.07 0.00 2.07 -0.83 0.77 121.20 121.97 1yho s ILE 7 Ca 0.07 0.26 -0.13 0.00 -1.41 0.00 0.00 60.65 59.44 1yho s ILE 7 Cb -0.09 -0.46 0.03 0.00 0.13 0.00 0.00 42.46 42.07 1yho s ILE 7 CO 0.01 0.11 0.32 0.68 -1.91 0.00 0.00 174.94 174.16 1yho s VAL 8 N 2.32 0.03 -0.13 4.00 -7.23 0.41 -4.43 120.40 115.36 1yho s VAL 8 Ca -0.00 -0.22 -0.07 0.00 -1.81 0.00 0.00 61.98 59.88 1yho s VAL 8 Cb -0.12 -0.54 -0.04 0.00 0.56 0.00 0.00 36.38 36.24 1yho s VAL 8 CO -0.09 -0.12 0.12 0.00 -0.31 0.00 0.00 175.10 174.69 1yho s ALA 9 N -0.52 3.75 0.02 1.32 0.00 -1.26 -1.56 121.76 123.50 1yho s ALA 9 Ca -0.06 -0.68 0.02 0.00 0.00 0.00 0.00 51.96 51.24 1yho s ALA 9 Cb -0.04 -1.93 -0.02 0.00 0.00 0.00 0.00 23.12 21.14 1yho s ALA 9 CO 0.02 0.53 -0.07 0.14 0.00 0.00 0.00 175.76 176.38 1yho s VAL 10 N -0.74 0.47 0.79 0.00 -7.23 0.22 -4.67 120.40 109.25 1yho s VAL 10 Ca 0.13 -0.76 -0.12 0.00 -1.81 0.00 0.00 61.98 59.43 1yho s VAL 10 Cb -0.12 -0.49 0.07 0.00 0.56 0.00 0.00 36.38 36.40 1yho s VAL 10 CO 0.03 -0.21 1.15 -0.94 -0.31 0.00 0.00 175.10 174.82 1yho s SER 11 N -1.04 4.63 0.64 4.85 1.04 0.21 -0.75 113.70 123.28 1yho s SER 11 Ca -0.06 0.91 0.43 0.00 0.48 0.00 0.00 55.95 57.71 1yho s SER 11 Cb -0.07 -1.50 2.30 0.00 0.10 0.00 0.00 66.02 66.85 1yho s SER 11 CO 0.00 -1.84 2.31 -0.61 0.98 0.00 0.00 173.24 174.08 1yho h GLN 12 N -1.01 0.00 -0.78 4.02 4.15 -1.17 -0.64 115.11 119.67 1yho h GLN 12 Ca -0.46 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 58.84 1yho h GLN 12 Cb 1.31 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 28.93 1yho h GLN 12 CO 0.65 0.00 0.15 -1.71 -1.93 0.00 0.00 178.83 175.99 1yho n ASN 13 N -3.03 4.24 -2.53 -0.69 2.85 -1.26 -4.87 115.26 109.97 1yho n ASN 13 Ca -0.03 -2.85 -0.21 0.00 -0.11 0.00 0.00 54.58 51.38 1yho n ASN 13 Cb 0.08 -0.67 -0.00 0.00 1.24 0.00 0.00 39.78 40.43 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 0.10 -2.35 -4.06 1.20 2.81 -0.25 -4.91 117.12 109.67 1yho n MET 14 Ca 0.28 1.00 -0.30 0.00 -1.81 0.00 0.00 57.70 56.87 1yho n MET 14 Cb 1.09 -5.71 -0.07 0.00 -0.71 0.00 0.00 33.22 27.82 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 -2.19 1.99 -0.11 3.03 0.00 -1.24 -0.14 107.32 108.66 1yho s GLY 15 Ca 0.06 -1.04 0.01 0.00 0.00 0.00 0.00 44.72 43.76 1yho s GLY 15 CO 0.08 -1.02 -0.09 0.29 0.00 0.00 0.00 173.10 172.36 1yho n ILE 16 N 0.41 0.64 -3.61 0.90 -5.35 -0.95 0.64 119.36 112.05 1yho n ILE 16 Ca -0.09 -0.25 -0.07 0.00 -0.27 0.00 0.00 62.75 62.07 1yho n ILE 16 Cb 0.52 -0.89 -0.05 0.00 -1.74 0.00 0.00 39.64 37.48 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 -5.03 -0.11 -0.14 3.28 0.00 -1.26 -4.68 107.32 99.39 1yho s GLY 17 Ca -0.14 2.39 -0.01 0.00 0.00 0.00 0.00 44.72 46.95 1yho s GLY 17 CO 0.26 1.06 -0.11 1.25 0.00 0.00 0.00 173.10 175.57 1yho s LYS 18 N -1.07 3.44 -1.56 2.90 2.36 0.29 -1.89 119.74 124.21 1yho s LYS 18 Ca 0.03 -0.65 -0.00 0.00 -2.55 0.00 0.00 55.97 52.80 1yho s LYS 18 Cb -0.01 -2.71 0.00 0.00 -1.05 0.00 0.00 37.83 34.06 1yho s LYS 18 CO -0.03 0.18 0.04 0.09 1.55 0.00 0.00 175.35 177.19 1yho n ASN 19 N 3.63 -5.35 -0.36 1.43 4.13 -1.26 -1.64 115.26 115.85 1yho n ASN 19 Ca -0.18 -0.04 -0.04 0.00 1.68 0.00 0.00 54.58 56.00 1yho n ASN 19 Cb 0.52 -4.39 -0.02 0.00 -1.54 0.00 0.00 39.78 34.35 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 -1.05 0.69 3.12 7.41 0.00 -1.26 -5.02 105.19 109.07 1yho n GLY 20 Ca -0.21 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.94 0.09 0.36 1.61 1.01 -0.65 -4.95 116.67 111.20 1yho s ASP 21 Ca 0.00 -0.37 -0.27 0.00 0.71 0.00 0.00 52.55 52.62 1yho s ASP 21 Cb 0.00 0.23 -0.10 0.00 1.01 0.00 0.00 42.92 44.06 1yho s ASP 21 CO 0.00 -0.46 1.28 -0.76 0.21 0.00 0.00 175.17 175.45 1yho s LEU 22 N -1.79 4.33 0.09 1.23 1.43 -1.26 0.10 118.68 122.81 1yho s LEU 22 Ca -0.09 2.63 -0.14 0.00 -1.03 0.00 0.00 54.13 55.49 1yho s LEU 22 Cb -0.04 -3.78 -0.14 0.00 0.03 0.00 0.00 46.19 42.27 1yho s LEU 22 CO -0.02 -0.65 1.33 1.55 0.23 0.00 0.00 176.35 178.79 1yho h PRO 23 N 3.07 0.74 -7.08 1.29 0.13 -1.85 -3.45 132.00 124.86 1yho h PRO 23 Ca -0.49 -0.54 -0.46 0.00 -0.87 0.00 0.00 66.00 63.64 1yho h PRO 23 Cb 1.23 0.09 0.01 0.00 0.13 0.00 0.00 31.00 32.47 1yho h PRO 23 CO 0.64 1.16 0.37 1.67 -0.23 0.00 0.00 178.00 181.61 1yho s TRP 24 N -3.91 3.09 1.19 1.56 -2.14 -1.26 -5.04 118.94 112.43 1yho s TRP 24 Ca -0.11 1.58 -0.15 0.00 2.66 0.00 0.00 56.10 60.08 1yho s TRP 24 Cb 0.08 -3.00 0.29 0.00 -3.10 0.00 0.00 33.47 27.74 1yho s TRP 24 CO 0.87 -0.63 1.03 -1.25 -2.66 0.00 0.00 176.95 174.31 1yho s PRO 25 N -3.26 -1.15 -0.13 3.25 0.04 -1.26 -4.86 135.00 127.63 1yho s PRO 25 Ca 0.66 0.52 -0.34 0.00 0.04 0.00 0.00 61.00 61.87 1yho s PRO 25 Cb -0.14 -1.55 -0.12 0.00 0.04 0.00 0.00 34.50 32.73 1yho s PRO 25 CO 0.19 -3.79 1.91 -0.35 0.04 0.00 0.00 177.00 174.99 1yho n PRO 26 N -4.92 2.04 -3.70 0.56 -0.04 -1.26 -4.95 135.00 122.72 1yho n PRO 26 Ca 0.06 0.73 -0.38 0.00 -0.04 0.00 0.00 63.50 63.88 1yho n PRO 26 Cb 0.57 -2.62 -0.12 0.00 -0.04 0.00 0.00 33.50 31.28 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 4.46 3.82 0.27 1.53 2.96 -1.26 -4.97 118.68 125.48 1yho s LEU 27 Ca 0.95 -0.39 0.06 0.00 -0.22 0.00 0.00 54.13 54.52 1yho s LEU 27 Cb -0.71 -1.97 0.36 0.00 0.50 0.00 0.00 46.19 44.38 1yho s LEU 27 CO 0.52 -0.12 1.64 0.03 -1.32 0.00 0.00 176.35 177.09 1yho h ARG 28 N 8.30 0.23 -0.16 1.98 -0.00 -1.99 -2.31 114.38 120.42 1yho h ARG 28 Ca -0.35 -0.13 -0.16 0.00 -0.50 0.00 0.00 59.98 58.84 1yho h ARG 28 Cb 1.16 0.01 0.01 0.00 0.00 0.00 0.00 29.97 31.14 1yho h ARG 28 CO 0.60 0.68 -0.53 -0.91 0.00 0.00 0.00 179.97 179.81 1yho h ASN 29 N 0.18 0.74 -0.50 7.04 4.21 -1.97 0.27 115.58 125.55 1yho h ASN 29 Ca 0.01 -0.60 -0.04 0.00 1.21 0.00 0.00 56.30 56.88 1yho h ASN 29 Cb 0.95 -0.22 -0.02 0.00 -1.12 0.00 0.00 38.32 37.91 1yho h ASN 29 CO 0.08 1.22 0.17 -0.08 -1.29 0.00 0.00 177.43 177.52 1yho h GLU 30 N 0.31 0.77 -0.16 0.81 4.57 -1.97 0.65 114.58 119.58 1yho h GLU 30 Ca -0.02 -0.16 -0.14 0.00 -1.18 0.00 0.00 59.36 57.86 1yho h GLU 30 Cb 1.15 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 29.63 1yho h GLU 30 CO 0.11 0.71 -0.46 0.74 -1.18 0.00 0.00 179.01 178.94 1yho h PHE 31 N 0.68 0.77 -0.20 0.92 -1.00 -1.45 -1.87 116.94 114.78 1yho h PHE 31 Ca 0.16 -0.30 -0.05 0.00 2.81 0.00 0.00 57.97 60.59 1yho h PHE 31 Cb 0.25 -0.13 -0.01 0.00 3.61 0.00 0.00 35.95 39.67 1yho h PHE 31 CO 0.01 1.07 -0.09 -0.09 -1.61 0.00 0.00 178.31 177.61 1yho h ARG 32 N 0.24 0.42 -0.74 1.51 2.43 -0.85 -1.63 114.38 115.76 1yho h ARG 32 Ca -0.01 -0.18 -0.02 0.00 -0.81 0.00 0.00 59.98 58.96 1yho h ARG 32 Cb 1.08 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 30.58 1yho h ARG 32 CO 0.10 0.70 0.38 -0.92 -1.51 0.00 0.00 179.97 178.72 1yho h TYR 33 N 0.12 1.03 -0.16 2.20 3.20 0.26 -0.72 116.97 122.90 1yho h TYR 33 Ca 0.05 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.86 1yho h TYR 33 Cb 0.57 -0.33 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 1yho h TYR 33 CO 0.06 0.73 -0.02 0.35 -1.64 0.00 0.00 178.16 177.64 1yho h PHE 34 N 1.04 0.32 -0.60 -3.82 3.04 -1.26 -2.02 116.94 113.65 1yho h PHE 34 Ca 0.26 -0.07 -0.01 0.00 3.98 0.00 0.00 57.97 62.14 1yho h PHE 34 Cb 0.06 -0.08 -0.03 0.00 2.56 0.00 0.00 35.95 38.46 1yho h PHE 34 CO 0.01 0.55 0.34 0.37 -2.02 0.00 0.00 178.31 177.56 1yho h GLN 35 N 0.00 0.83 -0.31 1.11 4.15 -1.05 -1.39 115.11 118.46 1yho h GLN 35 Ca 0.04 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.37 1yho h GLN 35 Cb 0.44 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.95 1yho h GLN 35 CO 0.01 0.62 0.20 -0.09 -1.93 0.00 0.00 178.83 177.64 1yho h ARG 36 N 0.81 0.40 -0.12 1.69 1.12 -1.10 0.39 114.38 117.59 1yho h ARG 36 Ca 0.21 -0.03 0.00 0.00 -1.11 0.00 0.00 59.98 59.06 1yho h ARG 36 Cb 0.02 -0.09 -0.01 0.00 -0.01 0.00 0.00 29.97 29.88 1yho h ARG 36 CO -0.04 0.28 0.08 1.98 -3.11 0.00 0.00 179.97 179.16 1yho h MET 37 N 0.41 0.16 -0.41 0.20 4.05 -1.12 0.64 114.93 118.85 1yho h MET 37 Ca 0.11 -0.01 -0.09 0.00 -0.28 0.00 0.00 59.70 59.43 1yho h MET 37 Cb -0.04 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.71 1yho h MET 37 CO -0.02 0.12 -0.11 1.79 0.23 0.00 0.00 176.91 178.91 1yho h THR 38 N 0.15 1.25 -0.17 -0.77 1.35 -1.07 -3.07 112.91 110.59 1yho h THR 38 Ca 0.04 -1.14 -0.15 0.00 -0.55 0.00 0.00 66.41 64.62 1yho h THR 38 Cb -0.00 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.48 1yho h THR 38 CO -0.01 0.39 -0.47 0.74 -0.25 0.00 0.00 175.52 175.92 1yho h THR 39 N 0.66 1.33 -1.97 6.82 2.02 0.12 -3.41 112.91 118.48 1yho h THR 39 Ca 0.11 -1.72 -0.50 0.00 0.77 0.00 0.00 66.41 65.07 1yho h THR 39 Cb 0.57 1.97 -0.03 0.00 -1.74 0.00 0.00 68.15 68.93 1yho h THR 39 CO 0.04 0.53 1.39 0.42 0.37 0.00 0.00 175.52 178.26 1yho s THR 40 N -3.91 3.31 0.11 3.16 -4.23 0.22 -4.96 115.64 109.34 1yho s THR 40 Ca -0.12 0.19 0.02 0.00 -1.18 0.00 0.00 61.69 60.59 1yho s THR 40 Cb 0.07 -3.80 -0.04 0.00 1.34 0.00 0.00 72.50 70.07 1yho s THR 40 CO 0.84 -0.76 0.24 -0.55 -0.54 0.00 0.00 174.62 173.84 1yho s SER 41 N 8.55 6.28 -0.03 3.99 0.15 -1.26 -4.88 113.70 126.50 1yho s SER 41 Ca 0.72 0.19 0.05 0.00 0.70 0.00 0.00 55.95 57.61 1yho s SER 41 Cb -0.14 -1.89 -0.24 0.00 -1.71 0.00 0.00 66.02 62.04 1yho s SER 41 CO 0.22 0.11 0.72 -1.28 1.20 0.00 0.00 173.24 174.21 1yho h SER 42 N 2.61 0.16 -3.63 5.45 0.87 -1.97 -3.44 113.55 113.59 1yho h SER 42 Ca -0.47 -0.29 -0.65 0.00 -1.23 0.00 0.00 61.79 59.16 1yho h SER 42 Cb 1.18 -0.05 -0.16 0.00 -0.44 0.00 0.00 62.40 62.93 1yho h SER 42 CO 0.71 1.25 -0.15 -0.69 -0.53 0.00 0.00 176.83 177.42 1yho s VAL 43 N -2.61 5.09 0.23 2.23 1.01 -1.26 -5.05 120.40 120.03 1yho s VAL 43 Ca -0.08 0.25 -0.30 0.00 0.00 0.00 0.00 61.98 61.85 1yho s VAL 43 Cb 0.08 -3.89 -0.09 0.00 0.00 0.00 0.00 36.38 32.48 1yho s VAL 43 CO 0.82 -0.14 1.12 -0.70 0.00 0.00 0.00 175.10 176.20 1yho s GLU 44 N 2.22 4.60 0.00 2.72 -6.30 -1.26 -3.02 118.70 117.66 1yho s GLU 44 Ca 0.16 1.79 0.00 0.00 -2.50 0.00 0.00 54.97 54.42 1yho s GLU 44 Cb -0.16 -3.23 0.00 0.00 0.00 0.00 0.00 34.13 30.74 1yho s GLU 44 CO 0.12 0.11 0.00 0.41 0.02 0.00 0.00 175.26 175.92 1yho n GLY 45 N 1.67 1.72 3.81 -1.50 0.00 -1.26 -5.03 105.19 104.59 1yho n GLY 45 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.40 2.80 0.24 1.61 1.02 -1.17 -5.07 119.74 118.78 1yho s LYS 46 Ca 0.00 -1.16 0.10 0.00 0.02 0.00 0.00 55.97 54.93 1yho s LYS 46 Cb 0.00 -2.49 -0.04 0.00 -0.52 0.00 0.00 37.83 34.77 1yho s LYS 46 CO 0.00 0.33 -0.06 -0.65 -0.92 0.00 0.00 175.35 174.05 1yho s GLN 47 N -3.86 2.13 -0.10 1.68 -0.21 -0.63 -4.95 119.66 113.73 1yho s GLN 47 Ca 0.34 -1.42 -0.03 0.00 0.02 0.00 0.00 55.36 54.27 1yho s GLN 47 Cb -0.07 -2.10 -0.03 0.00 1.00 0.00 0.00 33.01 31.80 1yho s GLN 47 CO 0.25 0.38 0.03 -0.80 -2.12 0.00 0.00 175.29 173.03 1yho s ASN 48 N -3.40 5.49 -0.22 5.90 0.01 -1.26 -3.15 114.94 118.31 1yho s ASN 48 Ca 0.29 0.21 -0.05 0.00 -0.71 0.00 0.00 52.86 52.59 1yho s ASN 48 Cb -0.07 -1.63 -0.02 0.00 0.41 0.00 0.00 41.25 39.94 1yho s ASN 48 CO 0.18 0.37 0.01 -0.22 -1.51 0.00 0.00 177.10 175.93 1yho s LEU 49 N -0.84 3.24 0.03 0.60 0.20 -0.93 -1.47 118.68 119.51 1yho s LEU 49 Ca 0.13 -0.24 0.02 0.00 0.69 0.00 0.00 54.13 54.73 1yho s LEU 49 Cb -0.12 -1.84 -0.04 0.00 -0.43 0.00 0.00 46.19 43.77 1yho s LEU 49 CO 0.03 0.02 0.02 0.68 -0.29 0.00 0.00 176.35 176.81 1yho s VAL 50 N 1.25 4.23 -0.06 1.68 -7.23 -0.24 -0.91 120.40 119.12 1yho s VAL 50 Ca 0.04 -0.69 0.04 0.00 -1.81 0.00 0.00 61.98 59.56 1yho s VAL 50 Cb -0.15 -2.94 -0.02 0.00 0.56 0.00 0.00 36.38 33.83 1yho s VAL 50 CO 0.01 0.28 -0.17 -0.63 -0.31 0.00 0.00 175.10 174.28 1yho s ILE 51 N -1.19 2.77 0.04 -0.62 1.01 -0.02 -1.21 121.20 121.98 1yho s ILE 51 Ca 0.23 -0.82 0.00 0.00 0.00 0.00 0.00 60.65 60.06 1yho s ILE 51 Cb -0.12 -2.07 -0.03 0.00 0.01 0.00 0.00 42.46 40.25 1yho s ILE 51 CO 0.14 0.58 -0.04 -0.04 0.00 0.00 0.00 174.94 175.58 1yho s MET 52 N -0.47 0.48 0.69 2.79 -1.94 0.50 -1.11 119.30 120.24 1yho s MET 52 Ca 0.06 -0.89 -0.05 0.00 -1.71 0.00 0.00 55.69 53.10 1yho s MET 52 Cb -0.12 0.05 0.07 0.00 2.01 0.00 0.00 34.83 36.84 1yho s MET 52 CO 0.01 -0.05 0.98 0.20 -0.01 0.00 0.00 175.02 176.15 1yho s GLY 53 N -2.07 1.73 0.17 -0.03 0.00 -1.02 -1.58 107.32 104.52 1yho s GLY 53 Ca -0.05 -1.11 -0.14 0.00 0.00 0.00 0.00 44.72 43.41 1yho s GLY 53 CO -0.04 -0.69 1.82 1.70 0.00 0.00 0.00 173.10 175.88 1yho h LYS 54 N -0.51 0.59 -0.24 2.90 3.64 -1.95 0.68 116.57 121.68 1yho h LYS 54 Ca -0.43 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 58.90 1yho h LYS 54 Cb 1.30 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.98 1yho h LYS 54 CO 0.55 0.39 0.08 -0.22 -2.27 0.00 0.00 179.45 177.98 1yho h LYS 55 N 0.60 0.37 -0.55 1.90 1.63 -1.94 -2.09 116.57 116.49 1yho h LYS 55 Ca 0.19 -0.07 -0.00 0.00 -0.85 0.00 0.00 60.65 59.91 1yho h LYS 55 Cb -0.02 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 31.53 1yho h LYS 55 CO -0.07 0.43 0.34 1.15 -3.45 0.00 0.00 179.45 177.85 1yho h THR 56 N 0.23 1.16 -0.95 1.00 2.02 -1.88 -0.11 112.91 114.39 1yho h THR 56 Ca 0.08 -0.34 0.03 0.00 0.77 0.00 0.00 66.41 66.94 1yho h THR 56 Cb 0.21 0.40 -0.05 0.00 -1.74 0.00 0.00 68.15 66.97 1yho h THR 56 CO -0.00 0.16 0.63 -0.25 0.37 0.00 0.00 175.52 176.42 1yho h TRP 57 N 0.74 1.17 0.00 3.16 2.91 -0.74 -0.81 115.95 122.38 1yho h TRP 57 Ca 0.20 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.25 1yho h TRP 57 Cb -0.03 -0.39 0.00 0.00 -0.51 0.00 0.00 29.16 28.23 1yho h TRP 57 CO -0.03 0.69 0.00 0.74 -1.03 0.00 0.00 178.44 178.82 1yho h PHE 58 N 1.22 0.00 0.00 2.65 -1.00 -0.90 -3.17 116.94 115.75 1yho h PHE 58 Ca 0.37 0.00 -0.17 0.00 2.81 0.00 0.00 57.97 60.98 1yho h PHE 58 Cb -0.03 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.50 1yho h PHE 58 CO -0.00 0.00 -0.91 0.77 -1.61 0.00 0.00 178.31 176.56 1yho h SER 59 N 0.00 0.00 -2.91 2.17 0.02 0.33 -3.45 113.55 109.71 1yho h SER 59 Ca 0.00 0.00 -0.55 0.00 -0.84 0.00 0.00 61.79 60.40 1yho h SER 59 Cb 0.86 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.39 1yho h SER 59 CO 0.00 0.74 0.84 -0.63 -1.14 0.00 0.00 176.83 176.64 1yho s ILE 60 N -2.83 3.79 0.78 3.27 1.01 -0.57 -4.98 121.20 121.68 1yho s ILE 60 Ca 0.01 1.15 -0.15 0.00 0.00 0.00 0.00 60.65 61.66 1yho s ILE 60 Cb 0.09 -3.74 0.01 0.00 0.01 0.00 0.00 42.46 38.82 1yho s ILE 60 CO 0.79 -0.01 0.71 -2.65 0.00 0.00 0.00 174.94 173.77 1yho n PRO 61 N 5.51 0.19 0.14 2.79 -0.02 -1.26 -4.84 135.00 137.51 1yho n PRO 61 Ca 0.13 0.12 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 1yho n PRO 61 Cb 0.44 -2.02 0.13 0.00 -0.02 0.00 0.00 33.50 32.03 1yho n PRO 61 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1yho h GLU 62 N -0.69 0.00 -0.73 -0.52 4.81 -1.94 -2.52 114.58 112.99 1yho h GLU 62 Ca -0.45 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 58.88 1yho h GLU 62 Cb 1.32 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.65 1yho h GLU 62 CO 0.42 0.60 0.48 0.87 -0.73 0.00 0.00 179.01 180.66 1yho h LYS 63 N 0.00 0.58 0.00 1.92 1.79 -1.99 -2.14 116.57 116.73 1yho h LYS 63 Ca -0.01 -0.03 -0.29 0.00 -2.18 0.00 0.00 60.65 58.14 1yho h LYS 63 Cb 1.25 -0.13 -0.05 0.00 -1.58 0.00 0.00 32.23 31.71 1yho h LYS 63 CO 0.08 0.38 -1.90 0.09 -1.08 0.00 0.00 179.45 177.02 1yho n ASN 64 N -4.49 0.56 -4.75 0.86 3.02 -1.20 -4.91 115.26 104.35 1yho n ASN 64 Ca 0.12 0.26 -0.40 0.00 -0.03 0.00 0.00 54.58 54.54 1yho n ASN 64 Cb 0.36 0.37 -0.06 0.00 -0.61 0.00 0.00 39.78 39.85 1yho n ASN 64 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1yho s ARG 65 N -2.63 4.78 0.67 3.52 3.52 -0.80 -2.68 118.95 125.32 1yho s ARG 65 Ca -0.06 1.43 -0.15 0.00 -0.13 0.00 0.00 55.73 56.82 1yho s ARG 65 Cb 0.08 -3.31 0.01 0.00 -1.56 0.00 0.00 34.95 30.17 1yho s ARG 65 CO 0.83 0.44 1.12 -1.25 -0.81 0.00 0.00 175.30 175.62 1yho s PRO 66 N -0.83 2.69 0.72 5.12 0.04 -1.26 -4.79 135.00 136.69 1yho s PRO 66 Ca 0.42 1.41 -0.11 0.00 0.04 0.00 0.00 61.00 62.76 1yho s PRO 66 Cb -0.25 -1.93 0.02 0.00 0.04 0.00 0.00 34.50 32.38 1yho s PRO 66 CO 0.31 -1.34 1.09 -0.51 0.04 0.00 0.00 177.00 176.58 1yho s LEU 67 N -4.97 2.88 0.17 -3.56 1.02 -1.09 -5.09 118.68 108.04 1yho s LEU 67 Ca 0.67 1.23 0.07 0.00 0.02 0.00 0.00 54.13 56.12 1yho s LEU 67 Cb -0.21 -4.02 -0.04 0.00 0.02 0.00 0.00 46.19 41.94 1yho s LEU 67 CO 0.43 -1.43 -0.15 -0.54 0.02 0.00 0.00 176.35 174.68 1yho s LYS 68 N -5.28 1.22 0.00 1.70 3.01 -1.26 -4.79 119.74 114.35 1yho s LYS 68 Ca 0.58 -1.47 0.00 0.00 -1.01 0.00 0.00 55.97 54.08 1yho s LYS 68 Cb -0.12 -1.05 0.00 0.00 -1.01 0.00 0.00 37.83 35.65 1yho s LYS 68 CO 0.53 0.18 0.00 0.41 0.51 0.00 0.00 175.35 176.98 1yho n GLY 69 N -0.05 2.77 3.06 -3.33 0.00 -1.26 -4.98 105.19 101.41 1yho n GLY 69 Ca -0.11 -0.44 -0.11 0.00 0.00 0.00 0.00 46.02 45.36 1yho n GLY 69 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1yho s ARG 70 N 0.00 0.53 -0.07 1.61 3.03 -1.26 -4.62 118.95 118.17 1yho s ARG 70 Ca 0.00 -0.88 -0.30 0.00 2.03 0.00 0.00 55.73 56.59 1yho s ARG 70 Cb 0.00 -0.10 -0.03 0.00 -1.03 0.00 0.00 34.95 33.79 1yho s ARG 70 CO 0.00 -0.01 1.21 0.42 -1.13 0.00 0.00 175.30 175.79 1yho s ILE 71 N -2.12 4.26 -0.19 4.99 -1.09 -0.54 -4.90 121.20 121.61 1yho s ILE 71 Ca -0.06 1.58 -0.17 0.00 -2.23 0.00 0.00 60.65 59.77 1yho s ILE 71 Cb -0.05 -4.01 -0.04 0.00 -1.58 0.00 0.00 42.46 36.78 1yho s ILE 71 CO -0.02 -0.02 0.46 0.20 -1.23 0.00 0.00 174.94 174.33 1yho s ASN 72 N 1.54 6.53 0.03 3.58 -0.87 -1.26 -1.08 114.94 123.41 1yho s ASN 72 Ca 0.56 0.63 0.07 0.00 -1.57 0.00 0.00 52.86 52.55 1yho s ASN 72 Cb -0.24 -2.27 -0.02 0.00 -0.02 0.00 0.00 41.25 38.70 1yho s ASN 72 CO 0.21 -0.11 -0.22 -0.22 -2.57 0.00 0.00 177.10 174.19 1yho s LEU 73 N 1.34 2.14 0.09 0.60 0.20 -0.35 -1.06 118.68 121.64 1yho s LEU 73 Ca 0.22 -0.50 0.10 0.00 0.69 0.00 0.00 54.13 54.64 1yho s LEU 73 Cb -0.15 -1.06 -0.03 0.00 -0.43 0.00 0.00 46.19 44.52 1yho s LEU 73 CO 0.09 0.20 -0.26 -0.69 -0.29 0.00 0.00 176.35 175.40 1yho s VAL 74 N -0.73 2.12 -0.31 1.68 1.01 -0.64 -0.37 120.40 123.17 1yho s VAL 74 Ca 0.08 -1.56 -0.03 0.00 0.00 0.00 0.00 61.98 60.47 1yho s VAL 74 Cb -0.09 -1.86 0.05 0.00 0.00 0.00 0.00 36.38 34.48 1yho s VAL 74 CO 0.01 0.19 0.02 -0.76 0.00 0.00 0.00 175.10 174.56 1yho s LEU 75 N -1.68 3.97 -0.05 3.92 1.43 -0.62 -1.59 118.68 124.05 1yho s LEU 75 Ca 0.12 -1.21 -0.03 0.00 -1.03 0.00 0.00 54.13 51.97 1yho s LEU 75 Cb -0.10 -1.75 0.03 0.00 0.03 0.00 0.00 46.19 44.40 1yho s LEU 75 CO 0.04 -0.27 0.13 -0.55 0.23 0.00 0.00 176.35 175.93 1yho s SER 76 N 1.30 -0.10 -0.19 2.29 0.15 0.53 -3.82 113.70 113.86 1yho s SER 76 Ca -0.04 0.26 0.16 0.00 0.70 0.00 0.00 55.95 57.03 1yho s SER 76 Cb -0.20 0.19 -0.24 0.00 -1.71 0.00 0.00 66.02 64.06 1yho s SER 76 CO -0.00 -0.11 0.11 -1.14 1.20 0.00 0.00 173.24 173.29 1yho n ARG 77 N 3.79 0.68 0.05 5.44 0.63 -1.25 -3.69 116.66 122.30 1yho n ARG 77 Ca -0.22 0.03 -0.12 0.00 -0.92 0.00 0.00 57.85 56.62 1yho n ARG 77 Cb 0.54 -1.55 -0.01 0.00 0.45 0.00 0.00 32.46 31.89 1yho n ARG 77 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1yho h GLU 78 N 0.00 0.46 -6.97 -0.14 4.39 -1.95 -3.45 114.58 106.92 1yho h GLU 78 Ca -0.53 -0.42 -0.48 0.00 0.34 0.00 0.00 59.36 58.27 1yho h GLU 78 Cb 2.20 0.10 0.02 0.00 -0.10 0.00 0.00 28.75 30.97 1yho h GLU 78 CO 0.03 1.06 0.41 -0.51 -1.16 0.00 0.00 179.01 178.84 1yho s LEU 79 N -7.93 4.13 -0.20 1.33 1.43 -1.26 -4.97 118.68 111.20 1yho s LEU 79 Ca -0.06 2.04 0.16 0.00 -1.03 0.00 0.00 54.13 55.24 1yho s LEU 79 Cb 0.10 -4.20 -0.24 0.00 0.03 0.00 0.00 46.19 41.88 1yho s LEU 79 CO 0.86 -0.51 0.06 0.29 0.23 0.00 0.00 176.35 177.28 1yho n LYS 80 N -0.11 0.68 -4.42 1.70 5.02 -1.26 -4.95 118.16 114.83 1yho n LYS 80 Ca 0.05 0.01 -0.24 0.00 -2.02 0.00 0.00 58.31 56.12 1yho n LYS 80 Cb 0.50 -1.53 -0.13 0.00 -0.02 0.00 0.00 35.03 33.85 1yho n LYS 80 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1yho s GLU 81 N -2.50 1.19 0.54 1.97 2.02 -1.26 -5.12 118.70 115.55 1yho s GLU 81 Ca -0.12 -1.04 -0.20 0.00 0.02 0.00 0.00 54.97 53.63 1yho s GLU 81 Cb 0.06 -1.37 -0.07 0.00 0.10 0.00 0.00 34.13 32.86 1yho s GLU 81 CO 0.81 0.33 0.98 -2.30 0.02 0.00 0.00 175.26 175.10 1yho n PRO 82 N 1.44 1.08 -1.87 0.39 -0.02 -1.26 -4.97 135.00 129.80 1yho n PRO 82 Ca -0.19 0.41 -0.32 0.00 -2.02 0.00 0.00 63.50 61.37 1yho n PRO 82 Cb 0.54 -2.13 0.03 0.00 -0.02 0.00 0.00 33.50 31.92 1yho n PRO 82 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1yho s PRO 83 N -2.48 3.08 0.08 0.52 0.04 -1.26 -4.94 135.00 130.03 1yho s PRO 83 Ca 0.71 1.22 -0.32 0.00 0.04 0.00 0.00 61.00 62.65 1yho s PRO 83 Cb -0.46 -2.00 -0.11 0.00 0.04 0.00 0.00 34.50 31.97 1yho s PRO 83 CO 0.51 -1.01 1.83 0.94 0.04 0.00 0.00 177.00 179.32 1yho n GLN 84 N -2.35 2.60 0.00 4.56 -0.06 -1.26 -1.33 117.38 119.54 1yho n GLN 84 Ca 0.09 0.95 0.00 0.00 -2.00 0.00 0.00 57.00 56.04 1yho n GLN 84 Cb 0.53 -2.83 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 4.20 3.14 3.79 1.69 0.00 -1.26 -4.95 105.19 111.80 1yho n GLY 85 Ca 0.19 0.00 -0.36 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 -2.87 3.10 -0.02 4.61 0.00 -0.44 -4.62 121.76 121.52 1yho s ALA 86 Ca 0.00 0.55 -0.18 0.00 0.00 0.00 0.00 51.96 52.33 1yho s ALA 86 Cb 0.00 -3.21 -0.33 0.00 0.00 0.00 0.00 23.12 19.58 1yho s ALA 86 CO 0.00 0.01 0.90 0.45 0.00 0.00 0.00 175.76 177.12 1yho h HIS 87 N 2.51 0.76 -3.49 0.00 3.86 -1.40 -3.46 115.15 113.94 1yho h HIS 87 Ca -0.48 -0.56 -0.07 0.00 -1.16 0.00 0.00 60.37 58.11 1yho h HIS 87 Cb 1.20 -0.03 -0.14 0.00 1.06 0.00 0.00 27.41 29.50 1yho h HIS 87 CO 0.60 1.47 -0.18 -0.06 0.86 0.00 0.00 177.93 180.63 1yho s PHE 88 N -2.52 -0.09 0.01 2.45 0.08 -1.19 -5.05 117.98 111.66 1yho s PHE 88 Ca -0.12 -0.23 0.02 0.00 0.12 0.00 0.00 56.93 56.72 1yho s PHE 88 Cb 0.03 0.15 -0.01 0.00 -0.57 0.00 0.00 43.02 42.62 1yho s PHE 88 CO 0.88 -0.63 -0.06 -1.17 -0.10 0.00 0.00 175.22 174.14 1yho s LEU 89 N -2.72 2.08 0.14 -0.37 2.96 -1.26 -1.62 118.68 117.90 1yho s LEU 89 Ca 0.02 -0.23 0.07 0.00 -0.22 0.00 0.00 54.13 53.77 1yho s LEU 89 Cb 0.02 -0.23 -0.04 0.00 0.50 0.00 0.00 46.19 46.44 1yho s LEU 89 CO -0.11 -0.02 -0.15 -0.44 -1.32 0.00 0.00 176.35 174.32 1yho s SER 90 N -0.56 2.21 -0.10 3.68 0.01 -0.62 -4.92 113.70 113.40 1yho s SER 90 Ca -0.02 -0.87 -0.17 0.00 1.31 0.00 0.00 55.95 56.20 1yho s SER 90 Cb -0.04 -0.09 -0.28 0.00 0.21 0.00 0.00 66.02 65.82 1yho s SER 90 CO -0.00 -0.14 0.61 0.03 0.41 0.00 0.00 173.24 174.15 1yho h ARG 91 N 3.26 0.24 -4.92 12.44 -0.00 -1.90 0.15 114.38 123.65 1yho h ARG 91 Ca -0.40 -0.41 -0.34 0.00 -0.50 0.00 0.00 59.98 58.33 1yho h ARG 91 Cb 1.20 0.15 -0.14 0.00 0.00 0.00 0.00 29.97 31.18 1yho h ARG 91 CO 0.53 1.20 -0.65 -1.12 0.00 0.00 0.00 179.97 179.93 1yho s SER 92 N -7.00 1.43 0.46 7.04 0.01 -1.26 -3.90 113.70 110.48 1yho s SER 92 Ca -0.19 -1.25 0.12 0.00 1.31 0.00 0.00 55.95 55.94 1yho s SER 92 Cb 0.04 0.09 1.04 0.00 0.21 0.00 0.00 66.02 67.40 1yho s SER 92 CO 0.77 -0.60 2.08 0.25 0.41 0.00 0.00 173.24 176.16 1yho h LEU 93 N 2.53 0.20 -0.85 2.44 5.85 -1.99 -1.73 115.31 121.76 1yho h LEU 93 Ca -0.38 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.25 1yho h LEU 93 Cb 1.22 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.18 1yho h LEU 93 CO 0.63 0.18 -0.04 -0.78 -0.34 0.00 0.00 178.44 178.10 1yho h ASP 94 N 0.23 0.80 -0.08 1.25 1.82 -1.99 -1.43 116.42 117.04 1yho h ASP 94 Ca 0.06 -0.21 -0.03 0.00 -0.39 0.00 0.00 57.03 56.46 1yho h ASP 94 Cb 0.04 -0.21 -0.00 0.00 0.68 0.00 0.00 39.33 39.83 1yho h ASP 94 CO -0.01 0.89 -0.06 -0.78 -1.61 0.00 0.00 179.24 177.67 1yho h ASP 95 N 0.76 0.18 -0.93 2.28 3.58 -1.74 -1.85 116.42 118.70 1yho h ASP 95 Ca 0.14 -0.46 0.01 0.00 0.42 0.00 0.00 57.03 57.13 1yho h ASP 95 Cb 0.51 -0.05 -0.05 0.00 1.72 0.00 0.00 39.33 41.46 1yho h ASP 95 CO 0.03 0.61 0.61 0.00 -2.88 0.00 0.00 179.24 177.61 1yho h ALA 96 N 0.58 1.32 -0.37 -0.78 0.00 -1.37 -1.72 119.26 116.92 1yho h ALA 96 Ca 0.01 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1yho h ALA 96 Cb 0.55 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1yho h ALA 96 CO 0.02 0.63 -0.24 -0.07 0.00 0.00 0.00 179.25 179.58 1yho h LEU 97 N 1.27 0.76 -0.53 0.00 3.38 -1.24 -2.37 115.31 116.58 1yho h LEU 97 Ca 0.34 -0.28 -0.05 0.00 0.09 0.00 0.00 57.88 57.98 1yho h LEU 97 Cb -0.13 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 1yho h LEU 97 CO -0.07 0.97 0.12 0.11 0.09 0.00 0.00 178.44 179.66 1yho h LYS 98 N 0.65 0.85 -0.25 1.13 1.57 -0.71 -0.89 116.57 118.93 1yho h LYS 98 Ca 0.09 -0.21 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 1yho h LYS 98 Cb 0.75 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.94 1yho h LYS 98 CO 0.06 0.82 0.09 -0.07 -0.57 0.00 0.00 179.45 179.78 1yho h LEU 99 N 0.74 0.35 -1.65 2.94 3.38 -1.23 0.22 115.31 120.06 1yho h LEU 99 Ca 0.16 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1yho h LEU 99 Cb 0.35 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1yho h LEU 99 CO 0.00 0.43 -0.20 0.74 0.09 0.00 0.00 178.44 179.51 1yho h THR 100 N 0.24 0.85 0.00 0.22 2.02 -1.33 -2.26 112.91 112.66 1yho h THR 100 Ca 0.08 -0.76 -0.03 0.00 0.77 0.00 0.00 66.41 66.47 1yho h THR 100 Cb 0.20 1.45 -0.00 0.00 -1.74 0.00 0.00 68.15 68.05 1yho h THR 100 CO -0.01 0.19 -0.79 -0.08 0.37 0.00 0.00 175.52 175.21 1yho h GLU 101 N 0.00 0.00 -7.09 6.66 4.81 -0.73 -3.36 114.58 114.87 1yho h GLU 101 Ca -0.00 0.00 -0.53 0.00 -0.13 0.00 0.00 59.36 58.69 1yho h GLU 101 Cb 0.43 0.00 0.12 0.00 0.63 0.00 0.00 28.75 29.93 1yho h GLU 101 CO 0.03 0.07 0.49 -0.65 -0.73 0.00 0.00 179.01 178.21 1yho s GLN 102 N -3.25 2.92 0.42 1.92 -0.21 0.74 -4.75 119.66 117.45 1yho s GLN 102 Ca 0.01 1.89 0.18 0.00 0.02 0.00 0.00 55.36 57.47 1yho s GLN 102 Cb 0.08 -1.94 0.92 0.00 1.00 0.00 0.00 33.01 33.08 1yho s GLN 102 CO 0.76 -1.26 1.88 -1.00 -2.12 0.00 0.00 175.29 173.55 1yho h PRO 103 N 0.88 0.00 -0.59 2.91 0.13 -1.90 0.75 132.00 134.18 1yho h PRO 103 Ca -0.51 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.58 1yho h PRO 103 Cb 1.30 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.41 1yho h PRO 103 CO 0.55 0.29 0.20 1.49 -0.23 0.00 0.00 178.00 180.30 1yho h GLU 104 N 0.00 0.88 0.00 0.86 4.57 -1.91 -3.01 114.58 115.96 1yho h GLU 104 Ca -0.00 -0.16 -0.29 0.00 -1.18 0.00 0.00 59.36 57.73 1yho h GLU 104 Cb 0.62 -0.14 -0.06 0.00 -0.16 0.00 0.00 28.75 29.01 1yho h GLU 104 CO 0.04 0.75 -2.17 1.28 -1.18 0.00 0.00 179.01 177.73 1yho n LEU 105 N -4.30 0.00 0.13 1.64 4.77 -1.10 -4.38 117.00 113.77 1yho n LEU 105 Ca 0.05 0.00 0.18 0.00 -0.03 0.00 0.00 56.01 56.21 1yho n LEU 105 Cb 0.19 0.40 0.77 0.00 -2.33 0.00 0.00 43.42 42.45 1yho n LEU 105 CO 0.39 0.40 1.16 0.00 -1.33 0.00 0.00 177.39 178.01 1yho h ALA 106 N 0.92 2.04 -0.00 -1.18 0.00 0.52 0.30 119.26 121.86 1yho h ALA 106 Ca -0.44 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.34 1yho h ALA 106 Cb 1.98 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.78 1yho h ALA 106 CO 0.02 -0.45 -0.59 -0.91 0.00 0.00 0.00 179.25 177.32 1yho h ASN 107 N 0.00 0.01 0.09 0.00 4.21 -1.73 -3.29 115.58 114.87 1yho h ASN 107 Ca 0.15 -0.01 -0.35 0.00 1.21 0.00 0.00 56.30 57.30 1yho h ASN 107 Cb 0.73 -0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.90 1yho h ASN 107 CO -0.00 0.59 -1.93 0.29 -1.29 0.00 0.00 177.43 175.09 1yho n LYS 108 N -3.84 0.71 -4.57 0.81 5.02 0.53 -4.89 118.16 111.93 1yho n LYS 108 Ca -0.01 0.31 -0.28 0.00 -2.02 0.00 0.00 58.31 56.31 1yho n LYS 108 Cb 0.59 -1.69 -0.14 0.00 -0.02 0.00 0.00 35.03 33.77 1yho n LYS 108 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1yho s VAL 109 N -2.52 2.02 0.00 -0.18 -7.23 0.76 -1.61 120.40 111.65 1yho s VAL 109 Ca -0.25 -1.51 0.00 0.00 -1.81 0.00 0.00 61.98 58.40 1yho s VAL 109 Cb 0.07 -1.77 0.00 0.00 0.56 0.00 0.00 36.38 35.24 1yho s VAL 109 CO 0.71 0.16 0.00 -0.67 -0.31 0.00 0.00 175.10 174.99 1yho n ASP 110 N 1.36 0.42 -4.93 4.85 -0.08 -1.19 -3.97 116.55 113.01 1yho n ASP 110 Ca -0.18 0.00 -0.27 0.00 -1.51 0.00 0.00 54.79 52.83 1yho n ASP 110 Cb 0.53 0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.96 1yho n ASP 110 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 1yho s MET 111 N -1.96 3.46 0.09 -0.67 -1.94 -1.26 -4.11 119.30 112.91 1yho s MET 111 Ca 0.00 -0.50 0.10 0.00 -1.71 0.00 0.00 55.69 53.58 1yho s MET 111 Cb 0.00 -2.95 -0.03 0.00 2.01 0.00 0.00 34.83 33.85 1yho s MET 111 CO 0.00 0.51 -0.27 0.08 -0.01 0.00 0.00 175.02 175.34 1yho s VAL 112 N -1.72 2.21 -0.09 -6.03 1.01 -0.34 -2.20 120.40 113.25 1yho s VAL 112 Ca 0.36 -1.58 -0.01 0.00 0.00 0.00 0.00 61.98 60.75 1yho s VAL 112 Cb -0.11 -1.92 0.03 0.00 0.00 0.00 0.00 36.38 34.37 1yho s VAL 112 CO 0.28 0.22 -0.04 0.26 0.00 0.00 0.00 175.10 175.83 1yho s TRP 113 N -0.94 1.06 -0.23 5.22 0.52 -0.09 -0.62 118.94 123.86 1yho s TRP 113 Ca 0.13 -0.43 -0.23 0.00 0.02 0.00 0.00 56.10 55.59 1yho s TRP 113 Cb -0.10 -0.98 -0.01 0.00 -1.15 0.00 0.00 33.47 31.22 1yho s TRP 113 CO 0.04 -0.39 0.75 0.42 0.02 0.00 0.00 176.95 177.79 1yho s ILE 114 N 1.71 4.91 -0.39 2.03 -1.09 0.10 -0.84 121.20 127.62 1yho s ILE 114 Ca 0.03 1.40 0.05 0.00 -2.23 0.00 0.00 60.65 59.90 1yho s ILE 114 Cb -0.13 -4.05 0.46 0.00 -1.58 0.00 0.00 42.46 37.17 1yho s ILE 114 CO -0.06 -0.01 1.44 0.52 -1.23 0.00 0.00 174.94 175.61 1yho n VAL 115 N 5.10 2.84 0.00 2.92 0.31 -0.27 -1.96 118.33 127.27 1yho n VAL 115 Ca 0.03 -3.77 0.00 0.00 -0.01 0.00 0.00 64.34 60.59 1yho n VAL 115 Cb 0.48 -1.09 0.00 0.00 -0.91 0.00 0.00 33.84 32.32 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 -0.80 -0.91 0.00 2.92 0.00 -1.26 -4.75 105.19 100.39 1yho n GLY 116 Ca 0.48 -1.67 0.00 0.00 0.00 0.00 0.00 46.02 44.83 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 -1.01 1.58 0.28 -0.02 0.00 -1.26 -2.43 105.19 102.33 1yho n GLY 117 Ca 0.00 -1.76 0.01 0.00 0.00 0.00 0.00 46.02 44.26 1yho n GLY 117 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1yho h SER 118 N 0.00 0.48 -0.58 1.61 0.87 -1.99 -2.28 113.55 111.66 1yho h SER 118 Ca 0.00 -0.08 0.01 0.00 -1.23 0.00 0.00 61.79 60.50 1yho h SER 118 Cb 0.00 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 61.80 1yho h SER 118 CO 0.00 0.52 0.37 -1.28 -0.53 0.00 0.00 176.83 175.91 1yho h SER 119 N 0.51 0.63 -0.31 6.23 0.87 -1.99 0.65 113.55 120.14 1yho h SER 119 Ca 0.11 -0.01 -0.12 0.00 -1.23 0.00 0.00 61.79 60.55 1yho h SER 119 Cb 0.26 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1yho h SER 119 CO 0.00 0.45 -0.23 0.58 -0.53 0.00 0.00 176.83 177.10 1yho h VAL 120 N 0.75 1.27 -0.46 2.23 2.07 -1.76 -2.45 116.25 117.90 1yho h VAL 120 Ca 0.22 -1.35 -0.10 0.00 0.82 0.00 0.00 66.70 66.29 1yho h VAL 120 Cb -0.05 1.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1yho h VAL 120 CO -0.06 0.45 -0.11 0.22 0.02 0.00 0.00 177.57 178.09 1yho h TYR 121 N 0.69 0.93 0.05 1.57 5.03 -0.91 -1.85 116.97 122.47 1yho h TYR 121 Ca 0.09 -0.18 -0.00 0.00 2.58 0.00 0.00 58.73 61.23 1yho h TYR 121 Cb 0.75 -0.24 0.00 0.00 1.55 0.00 0.00 36.73 38.79 1yho h TYR 121 CO 0.04 0.90 -0.02 -0.22 -1.32 0.00 0.00 178.16 177.54 1yho h LYS 122 N 0.76 -0.06 -0.97 1.82 3.64 -0.72 -1.10 116.57 119.94 1yho h LYS 122 Ca 0.13 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1yho h LYS 122 Cb 0.61 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 32.40 1yho h LYS 122 CO 0.04 0.19 0.64 1.49 -2.27 0.00 0.00 179.45 179.54 1yho h GLU 123 N -0.31 1.26 0.00 1.90 4.57 -1.40 -1.68 114.58 118.92 1yho h GLU 123 Ca -0.01 -0.08 -0.08 0.00 -1.18 0.00 0.00 59.36 58.02 1yho h GLU 123 Cb 0.28 -0.28 -0.01 0.00 -0.16 0.00 0.00 28.75 28.57 1yho h GLU 123 CO 0.01 0.83 -0.37 0.00 -1.18 0.00 0.00 179.01 178.31 1yho h ALA 124 N 1.36 1.32 0.00 2.92 0.00 -1.23 -2.50 119.26 121.13 1yho h ALA 124 Ca 0.36 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1yho h ALA 124 Cb -0.13 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1yho h ALA 124 CO -0.08 0.46 0.00 0.52 0.00 0.00 0.00 179.25 180.14 1yho h MET 125 N 0.00 0.00 -0.73 0.00 2.86 -0.21 -1.11 114.93 115.74 1yho h MET 125 Ca -0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 1yho h MET 125 Cb 0.68 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.32 1yho h MET 125 CO 0.05 0.00 0.04 0.09 1.06 0.00 0.00 176.91 178.15 1yho n ASN 126 N -2.83 4.28 -4.72 1.22 3.02 -0.94 -4.93 115.26 110.36 1yho n ASN 126 Ca -0.02 -2.70 -0.41 0.00 -0.03 0.00 0.00 54.58 51.42 1yho n ASN 126 Cb 0.11 -0.64 -0.04 0.00 -0.61 0.00 0.00 39.78 38.60 1yho n ASN 126 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1yho s HIS 127 N -2.25 3.72 0.08 3.10 3.76 -0.42 -4.96 115.29 118.31 1yho s HIS 127 Ca 0.39 1.72 -0.10 0.00 -0.15 0.00 0.00 55.06 56.92 1yho s HIS 127 Cb 0.30 -3.12 -0.22 0.00 1.11 0.00 0.00 32.58 30.65 1yho s HIS 127 CO 0.11 -0.03 1.18 -1.00 -0.85 0.00 0.00 174.74 174.15 1yho h PRO 128 N 5.96 0.50 -7.65 8.40 0.13 -1.92 -3.47 132.00 133.96 1yho h PRO 128 Ca -0.42 -0.64 -0.46 0.00 -0.87 0.00 0.00 66.00 63.61 1yho h PRO 128 Cb 1.21 0.21 0.13 0.00 0.13 0.00 0.00 31.00 32.68 1yho h PRO 128 CO 0.73 1.26 0.39 0.20 -0.23 0.00 0.00 178.00 180.35 1yho s GLY 129 N -4.46 1.64 0.35 1.56 0.00 -1.26 -4.56 107.32 100.59 1yho s GLY 129 Ca -0.07 -0.80 -0.29 0.00 0.00 0.00 0.00 44.72 43.56 1yho s GLY 129 CO 0.90 -0.21 1.46 -1.58 0.00 0.00 0.00 173.10 173.67 1yho s HIS 130 N -3.61 2.73 -0.06 1.90 2.46 -1.26 -4.86 115.29 112.59 1yho s HIS 130 Ca 0.66 1.17 -0.09 0.00 0.47 0.00 0.00 55.06 57.26 1yho s HIS 130 Cb -0.09 -3.94 0.02 0.00 -0.13 0.00 0.00 32.58 28.43 1yho s HIS 130 CO 0.51 -2.81 0.23 -1.17 -2.47 0.00 0.00 174.74 169.03 1yho s LEU 131 N -1.74 1.15 -0.06 8.88 0.20 -1.26 -4.63 118.68 121.21 1yho s LEU 131 Ca 0.54 0.25 -0.05 0.00 0.69 0.00 0.00 54.13 55.56 1yho s LEU 131 Cb -0.45 0.87 -0.04 0.00 -0.43 0.00 0.00 46.19 46.14 1yho s LEU 131 CO 0.58 -0.21 0.15 -0.54 -0.29 0.00 0.00 176.35 176.04 1yho s LYS 132 N -0.47 3.41 -0.21 1.98 3.01 -0.94 -1.88 119.74 124.64 1yho s LYS 132 Ca -0.06 -0.24 -0.03 0.00 -1.01 0.00 0.00 55.97 54.64 1yho s LYS 132 Cb -0.04 -3.12 0.06 0.00 -1.01 0.00 0.00 37.83 33.72 1yho s LYS 132 CO 0.01 0.72 0.04 -0.51 0.51 0.00 0.00 175.35 176.12 1yho s LEU 133 N -1.47 1.32 -0.39 3.17 1.43 0.26 -1.13 118.68 121.87 1yho s LEU 133 Ca 0.21 -0.91 -0.16 0.00 -1.03 0.00 0.00 54.13 52.24 1yho s LEU 133 Cb -0.12 -0.64 0.01 0.00 0.03 0.00 0.00 46.19 45.46 1yho s LEU 133 CO 0.11 -0.31 0.41 -0.36 0.23 0.00 0.00 176.35 176.43 1yho s PHE 134 N 1.82 3.19 -0.11 0.29 0.40 0.23 0.10 117.98 123.90 1yho s PHE 134 Ca -0.00 -0.21 0.01 0.00 -0.60 0.00 0.00 56.93 56.13 1yho s PHE 134 Cb -0.17 -2.80 -0.02 0.00 0.51 0.00 0.00 43.02 40.54 1yho s PHE 134 CO -0.10 -0.58 -0.14 0.08 0.70 0.00 0.00 175.22 175.18 1yho s VAL 135 N 2.09 2.97 -0.28 -0.44 1.01 0.46 -0.44 120.40 125.77 1yho s VAL 135 Ca 0.12 -0.71 -0.07 0.00 0.00 0.00 0.00 61.98 61.33 1yho s VAL 135 Cb -0.17 -2.22 -0.00 0.00 0.00 0.00 0.00 36.38 33.99 1yho s VAL 135 CO 0.13 0.54 0.07 -0.89 0.00 0.00 0.00 175.10 174.95 1yho s THR 136 N 0.09 4.06 -0.35 3.92 2.01 -0.60 0.35 115.64 125.12 1yho s THR 136 Ca -0.06 -0.52 -0.18 0.00 0.31 0.00 0.00 61.69 61.24 1yho s THR 136 Cb -0.15 -3.02 -0.00 0.00 0.01 0.00 0.00 72.50 69.33 1yho s THR 136 CO 0.05 0.17 0.52 -0.13 -0.69 0.00 0.00 174.62 174.54 1yho s ARG 137 N 1.54 3.64 -0.42 4.92 0.52 -0.55 0.71 118.95 129.31 1yho s ARG 137 Ca 0.04 -0.13 -0.22 0.00 -0.52 0.00 0.00 55.73 54.90 1yho s ARG 137 Cb -0.16 -3.80 0.02 0.00 0.52 0.00 0.00 34.95 31.53 1yho s ARG 137 CO 0.03 -0.63 0.72 0.42 0.02 0.00 0.00 175.30 175.85 1yho s ILE 138 N 2.40 4.74 -1.19 1.52 -1.09 0.07 -1.51 121.20 126.15 1yho s ILE 138 Ca 0.19 0.41 -0.21 0.00 -2.23 0.00 0.00 60.65 58.81 1yho s ILE 138 Cb -0.15 -4.24 -0.04 0.00 -1.58 0.00 0.00 42.46 36.44 1yho s ILE 138 CO 0.13 -0.59 1.89 0.23 -1.23 0.00 0.00 174.94 175.37 1yho n MET 139 N 6.46 2.10 -3.56 2.79 2.81 0.57 -0.88 117.12 127.41 1yho n MET 139 Ca 0.01 -2.65 0.01 0.00 -1.81 0.00 0.00 57.70 53.25 1yho n MET 139 Cb 0.48 -3.57 -0.06 0.00 -0.71 0.00 0.00 33.22 29.36 1yho n MET 139 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1yho s GLN 140 N 5.56 0.19 -0.06 0.03 -1.52 -1.26 -4.26 119.66 118.34 1yho s GLN 140 Ca 0.62 0.36 -0.30 0.00 -1.95 0.00 0.00 55.36 54.10 1yho s GLN 140 Cb 0.03 0.09 -0.06 0.00 -0.22 0.00 0.00 33.01 32.84 1yho s GLN 140 CO 0.11 -0.05 1.83 0.34 -0.25 0.00 0.00 175.29 177.28 1yho s ASP 141 N 1.43 6.42 -0.07 5.90 -1.08 -1.26 -4.17 116.67 123.84 1yho s ASP 141 Ca -0.07 2.29 -0.03 0.00 -0.52 0.00 0.00 52.55 54.22 1yho s ASP 141 Cb -0.03 -2.53 0.04 0.00 -1.46 0.00 0.00 42.92 38.94 1yho s ASP 141 CO -0.13 -1.13 0.16 -0.36 0.52 0.00 0.00 175.17 174.23 1yho s PHE 142 N 4.80 -0.19 0.21 -5.34 0.08 -1.26 -5.10 117.98 111.18 1yho s PHE 142 Ca 0.82 0.53 -0.30 0.00 0.12 0.00 0.00 56.93 58.10 1yho s PHE 142 Cb -0.36 -0.07 -0.09 0.00 -0.57 0.00 0.00 43.02 41.93 1yho s PHE 142 CO 0.35 -0.18 1.32 -1.21 -0.10 0.00 0.00 175.22 175.39 1yho s GLU 143 N 1.22 4.38 0.09 0.44 2.02 -1.26 -4.80 118.70 120.79 1yho s GLU 143 Ca -0.09 2.08 0.02 0.00 0.02 0.00 0.00 54.97 57.00 1yho s GLU 143 Cb -0.11 -3.18 -0.04 0.00 0.10 0.00 0.00 34.13 30.90 1yho s GLU 143 CO -0.06 -0.25 -0.08 -1.12 0.02 0.00 0.00 175.26 173.76 1yho s SER 144 N 0.28 1.16 -0.19 -0.19 0.01 -1.26 -4.52 113.70 108.99 1yho s SER 144 Ca 0.56 -0.86 0.06 0.00 1.31 0.00 0.00 55.95 57.02 1yho s SER 144 Cb -0.37 0.06 -0.22 0.00 0.21 0.00 0.00 66.02 65.70 1yho s SER 144 CO 0.39 -0.36 0.08 -0.67 0.41 0.00 0.00 173.24 173.09 1yho n ASP 145 N 0.41 1.31 -4.41 2.44 2.03 -0.80 -4.88 116.55 112.67 1yho n ASP 145 Ca -0.15 0.03 -0.36 0.00 0.52 0.00 0.00 54.79 54.83 1yho n ASP 145 Cb 0.59 -0.06 -0.13 0.00 -0.72 0.00 0.00 41.12 40.80 1yho n ASP 145 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1yho s THR 146 N -2.53 4.09 -0.06 5.18 2.01 -1.09 -5.03 115.64 118.21 1yho s THR 146 Ca -0.22 -0.26 -0.10 0.00 0.31 0.00 0.00 61.69 61.42 1yho s THR 146 Cb 0.08 -2.91 -0.05 0.00 0.01 0.00 0.00 72.50 69.63 1yho s THR 146 CO 0.72 0.35 0.26 -0.36 -0.69 0.00 0.00 174.62 174.90 1yho s PHE 147 N 1.58 3.65 0.06 4.92 0.40 -1.26 -2.23 117.98 125.10 1yho s PHE 147 Ca 0.06 0.71 -0.22 0.00 -0.60 0.00 0.00 56.93 56.88 1yho s PHE 147 Cb -0.15 -2.08 -0.06 0.00 0.51 0.00 0.00 43.02 41.24 1yho s PHE 147 CO 0.02 0.69 0.65 0.12 0.70 0.00 0.00 175.22 177.40 1yho s PHE 148 N -1.09 3.78 0.54 0.36 5.36 0.80 -4.98 117.98 122.75 1yho s PHE 148 Ca 0.20 1.36 -0.19 0.00 -0.96 0.00 0.00 56.93 57.34 1yho s PHE 148 Cb -0.14 -2.65 -0.06 0.00 -0.34 0.00 0.00 43.02 39.84 1yho s PHE 148 CO 0.09 0.44 1.11 -1.25 -1.46 0.00 0.00 175.22 174.15 1yho s PRO 149 N -0.64 3.41 -0.28 10.12 0.04 -1.26 -4.95 135.00 141.44 1yho s PRO 149 Ca 0.33 1.55 -0.29 0.00 0.04 0.00 0.00 61.00 62.62 1yho s PRO 149 Cb -0.20 -2.02 0.01 0.00 0.04 0.00 0.00 34.50 32.33 1yho s PRO 149 CO 0.21 -0.79 1.14 -2.00 0.04 0.00 0.00 177.00 175.59 1yho s GLU 150 N -3.33 4.09 0.23 4.56 2.12 -1.26 -5.00 118.70 120.12 1yho s GLU 150 Ca 0.71 1.23 -0.30 0.00 0.36 0.00 0.00 54.97 56.98 1yho s GLU 150 Cb -0.22 -3.75 -0.09 0.00 0.26 0.00 0.00 34.13 30.33 1yho s GLU 150 CO 0.26 -0.87 1.26 0.42 -0.54 0.00 0.00 175.26 175.80 1yho s ILE 151 N 3.69 3.22 0.18 -3.70 1.01 -1.26 -4.98 121.20 119.37 1yho s ILE 151 Ca 0.48 1.07 -0.30 0.00 0.00 0.00 0.00 60.65 61.90 1yho s ILE 151 Cb -0.15 -3.68 -0.08 0.00 0.01 0.00 0.00 42.46 38.56 1yho s ILE 151 CO 0.15 0.19 1.28 -1.81 0.00 0.00 0.00 174.94 174.75 1yho s ASP 152 N 0.01 6.94 0.21 3.58 1.01 -1.26 -4.93 116.67 122.23 1yho s ASP 152 Ca 0.53 2.34 0.12 0.00 0.71 0.00 0.00 52.55 56.25 1yho s ASP 152 Cb -0.36 -2.61 -0.05 0.00 1.01 0.00 0.00 42.92 40.92 1yho s ASP 152 CO 0.41 -0.50 1.35 -0.07 0.21 0.00 0.00 175.17 176.57 1yho h LEU 153 N 5.50 0.00 -1.39 1.23 3.38 -1.94 -0.33 115.31 121.75 1yho h LEU 153 Ca -0.44 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 1yho h LEU 153 Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 1yho h LEU 153 CO 0.77 0.69 -0.26 -0.33 0.09 0.00 0.00 178.44 179.41 1yho h GLU 154 N 0.00 0.07 0.00 1.13 5.08 -2.02 -3.24 114.58 115.60 1yho h GLU 154 Ca -0.02 -0.02 -0.38 0.00 -1.00 0.00 0.00 59.36 57.94 1yho h GLU 154 Cb 1.54 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 30.71 1yho h GLU 154 CO 0.09 0.33 -2.44 1.63 -1.00 0.00 0.00 179.01 177.62 1yho n LYS 155 N -4.21 0.65 -4.06 2.33 4.01 -1.23 -4.97 118.16 110.69 1yho n LYS 155 Ca -0.02 0.13 -0.33 0.00 -0.51 0.00 0.00 58.31 57.59 1yho n LYS 155 Cb 0.33 -1.51 -0.06 0.00 -0.51 0.00 0.00 35.03 33.27 1yho n LYS 155 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 1yho s TYR 156 N -2.51 3.32 -0.24 2.13 1.51 -0.14 -2.07 117.35 119.36 1yho s TYR 156 Ca -0.32 0.21 -0.07 0.00 -1.01 0.00 0.00 57.07 55.89 1yho s TYR 156 Cb 0.09 -1.74 -0.03 0.00 -0.11 0.00 0.00 41.96 40.17 1yho s TYR 156 CO 0.61 0.56 0.05 0.21 -1.11 0.00 0.00 175.55 175.88 1yho s LYS 157 N -1.89 3.63 -0.06 -0.62 2.36 0.10 -4.20 119.74 119.06 1yho s LYS 157 Ca 0.25 -0.49 -0.30 0.00 -2.55 0.00 0.00 55.97 52.88 1yho s LYS 157 Cb -0.12 -3.28 -0.05 0.00 -1.05 0.00 0.00 37.83 33.34 1yho s LYS 157 CO 0.16 -0.17 1.52 -1.17 1.55 0.00 0.00 175.35 177.25 1yho s LEU 158 N 1.53 4.29 -0.54 5.43 0.20 -1.26 -2.18 118.68 126.15 1yho s LEU 158 Ca 0.06 2.11 0.01 0.00 0.69 0.00 0.00 54.13 57.00 1yho s LEU 158 Cb -0.15 -3.54 0.14 0.00 -0.43 0.00 0.00 46.19 42.21 1yho s LEU 158 CO 0.03 -0.85 0.31 -0.76 -0.29 0.00 0.00 176.35 174.79 1yho s LEU 159 N 3.51 4.78 0.04 -0.68 1.02 0.19 -4.96 118.68 122.59 1yho s LEU 159 Ca 0.68 -2.82 -0.20 0.00 0.02 0.00 0.00 54.13 51.80 1yho s LEU 159 Cb -0.31 -1.74 -0.14 0.00 0.02 0.00 0.00 46.19 44.02 1yho s LEU 159 CO 0.26 -0.32 1.36 1.55 0.02 0.00 0.00 176.35 179.22 1yho h PRO 160 N 6.90 0.34 -4.62 1.29 0.13 -1.93 -0.73 132.00 133.37 1yho h PRO 160 Ca -0.05 -0.17 -0.70 0.00 -0.87 0.00 0.00 66.00 64.21 1yho h PRO 160 Cb 0.94 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 31.78 1yho h PRO 160 CO 0.69 0.70 -0.57 -1.21 -0.23 0.00 0.00 178.00 177.37 1yho s GLU 161 N -4.39 2.61 -0.03 0.86 2.02 -1.26 -4.64 118.70 113.87 1yho s GLU 161 Ca -0.14 -1.24 0.06 0.00 0.02 0.00 0.00 54.97 53.67 1yho s GLU 161 Cb 0.05 -3.54 -0.01 0.00 0.10 0.00 0.00 34.13 30.73 1yho s GLU 161 CO 0.75 -0.73 -0.22 -0.47 0.02 0.00 0.00 175.26 174.60 1yho s TYR 162 N 1.41 2.01 0.34 1.61 5.04 -1.26 -5.09 117.35 121.41 1yho s TYR 162 Ca -0.00 -0.44 -0.28 0.00 -2.44 0.00 0.00 57.07 53.91 1yho s TYR 162 Cb -0.20 -1.31 -0.10 0.00 0.35 0.00 0.00 41.96 40.70 1yho s TYR 162 CO 0.03 -0.08 1.26 -1.25 -1.34 0.00 0.00 175.55 174.17 1yho s PRO 163 N -0.40 4.33 0.00 4.97 0.04 -1.26 -3.06 135.00 139.62 1yho s PRO 163 Ca 0.05 2.10 0.00 0.00 0.04 0.00 0.00 61.00 63.20 1yho s PRO 163 Cb -0.10 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.43 1yho s PRO 163 CO 0.00 -0.16 0.00 0.41 0.04 0.00 0.00 177.00 177.29 1yho n GLY 164 N 0.83 2.96 3.53 0.56 0.00 -1.26 -5.02 105.19 106.80 1yho n GLY 164 Ca 0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.40 3.65 0.37 1.61 0.11 -1.17 -5.09 120.40 117.48 1yho s VAL 165 Ca 0.00 -0.48 -0.28 0.00 -2.93 0.00 0.00 61.98 58.29 1yho s VAL 165 Cb 0.00 -2.52 -0.11 0.00 -1.53 0.00 0.00 36.38 32.22 1yho s VAL 165 CO 0.00 0.56 1.51 0.18 -3.33 0.00 0.00 175.10 174.03 1yho n LEU 166 N 2.70 4.79 -0.07 2.54 4.77 -1.26 -4.63 117.00 125.84 1yho n LEU 166 Ca -0.18 1.22 -0.06 0.00 -0.03 0.00 0.00 56.01 56.96 1yho n LEU 166 Cb 0.53 -1.63 -0.13 0.00 -2.33 0.00 0.00 43.42 39.86 1yho n LEU 166 CO 0.29 0.19 -1.00 -1.54 -1.33 0.00 0.00 177.39 174.00 1yho n SER 167 N 0.66 0.96 -4.76 -1.43 3.41 -1.26 -4.53 113.62 106.67 1yho n SER 167 Ca 0.02 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.25 1yho n SER 167 Cb 0.39 0.99 0.03 0.00 -0.26 0.00 0.00 64.21 65.35 1yho n SER 167 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1yho s ASP 168 N -4.92 5.49 -0.18 4.04 1.01 -1.26 -4.70 116.67 116.15 1yho s ASP 168 Ca -0.08 2.59 -0.29 0.00 0.71 0.00 0.00 52.55 55.48 1yho s ASP 168 Cb 0.05 -2.62 -0.01 0.00 1.01 0.00 0.00 42.92 41.35 1yho s ASP 168 CO 0.68 -1.41 1.24 -0.69 0.21 0.00 0.00 175.17 175.20 1yho s VAL 169 N -1.40 4.31 0.28 -1.27 1.01 -1.26 -4.75 120.40 117.33 1yho s VAL 169 Ca 0.70 1.59 -0.16 0.00 0.00 0.00 0.00 61.98 64.10 1yho s VAL 169 Cb -0.36 -4.03 -0.09 0.00 0.00 0.00 0.00 36.38 31.90 1yho s VAL 169 CO 0.42 -0.15 0.72 -1.10 0.00 0.00 0.00 175.10 175.00 1yho s GLN 170 N 3.49 4.08 -0.07 2.72 1.11 -0.54 -4.86 119.66 125.60 1yho s GLN 170 Ca 0.54 0.72 0.01 0.00 0.01 0.00 0.00 55.36 56.64 1yho s GLN 170 Cb -0.21 -2.60 0.02 0.00 -1.01 0.00 0.00 33.01 29.21 1yho s GLN 170 CO 0.14 0.25 -0.08 -2.00 0.01 0.00 0.00 175.29 173.60 1yho s GLU 171 N -2.62 1.36 -0.04 2.91 2.12 -1.26 -1.00 118.70 120.17 1yho s GLU 171 Ca 0.50 -0.26 -0.02 0.00 0.36 0.00 0.00 54.97 55.55 1yho s GLU 171 Cb -0.12 -1.26 0.03 0.00 0.26 0.00 0.00 34.13 33.03 1yho s GLU 171 CO 0.19 -0.09 0.08 -1.21 -0.54 0.00 0.00 175.26 173.69 1yho s GLU 172 N 1.04 -0.01 -1.72 4.30 0.41 0.74 -4.83 118.70 118.62 1yho s GLU 172 Ca -0.08 0.33 -0.01 0.00 -0.41 0.00 0.00 54.97 54.80 1yho s GLU 172 Cb -0.14 -0.31 0.00 0.00 -1.78 0.00 0.00 34.13 31.90 1yho s GLU 172 CO -0.00 -0.23 0.09 1.63 -0.49 0.00 0.00 175.26 176.26 1yho n LYS 173 N 4.64 -2.20 -0.65 1.61 5.02 -1.26 -0.79 118.16 124.53 1yho n LYS 173 Ca -0.18 0.98 0.00 0.00 -2.02 0.00 0.00 58.31 57.09 1yho n LYS 173 Cb 0.50 -5.68 0.00 0.00 -0.02 0.00 0.00 35.03 29.84 1yho n LYS 173 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1yho n GLY 174 N -1.09 1.10 3.61 0.72 0.00 -1.26 -5.02 105.19 103.25 1yho n GLY 174 Ca -0.22 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.43 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 -3.42 5.15 -0.07 -0.61 1.01 0.03 -5.09 121.20 118.20 1yho s ILE 175 Ca 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 60.65 60.75 1yho s ILE 175 Cb 0.00 -3.41 -0.03 0.00 0.01 0.00 0.00 42.46 39.03 1yho s ILE 175 CO 0.00 0.33 0.01 -1.59 0.00 0.00 0.00 174.94 173.69 1yho s LYS 176 N 1.27 2.96 -0.02 2.79 -2.85 -1.26 -0.19 119.74 122.44 1yho s LYS 176 Ca 0.07 -0.44 -0.21 0.00 -1.00 0.00 0.00 55.97 54.38 1yho s LYS 176 Cb -0.14 -2.78 0.04 0.00 -2.06 0.00 0.00 37.83 32.89 1yho s LYS 176 CO 0.06 0.69 0.46 1.52 0.10 0.00 0.00 175.35 178.17 1yho s TYR 177 N -0.94 -0.37 0.21 1.78 1.13 -0.17 -0.32 117.35 118.67 1yho s TYR 177 Ca 0.15 0.58 0.11 0.00 -1.41 0.00 0.00 57.07 56.50 1yho s TYR 177 Cb -0.11 0.23 -0.05 0.00 -1.10 0.00 0.00 41.96 40.93 1yho s TYR 177 CO 0.04 -0.49 -0.22 0.21 -2.51 0.00 0.00 175.55 172.58 1yho s LYS 178 N -1.39 1.58 -0.27 -3.49 2.20 -0.57 -1.46 119.74 116.35 1yho s LYS 178 Ca -0.12 -1.56 -0.11 0.00 -0.36 0.00 0.00 55.97 53.82 1yho s LYS 178 Cb -0.03 -1.85 -0.05 0.00 -1.51 0.00 0.00 37.83 34.39 1yho s LYS 178 CO 0.06 0.39 0.20 -0.06 -0.36 0.00 0.00 175.35 175.57 1yho s PHE 179 N -1.84 3.25 -0.07 4.03 0.40 -1.26 -1.48 117.98 121.00 1yho s PHE 179 Ca 0.23 0.17 0.01 0.00 -0.60 0.00 0.00 56.93 56.73 1yho s PHE 179 Cb -0.07 -2.37 -0.03 0.00 0.51 0.00 0.00 43.02 41.06 1yho s PHE 179 CO 0.11 -0.11 -0.06 -2.00 0.70 0.00 0.00 175.22 173.86 1yho s GLU 180 N 1.62 2.79 -0.11 0.44 2.56 0.15 -4.88 118.70 121.27 1yho s GLU 180 Ca 0.08 -0.54 -0.01 0.00 0.00 0.00 0.00 54.97 54.50 1yho s GLU 180 Cb -0.15 -2.61 -0.03 0.00 2.00 0.00 0.00 34.13 33.34 1yho s GLU 180 CO 0.09 0.66 -0.06 0.08 -0.56 0.00 0.00 175.26 175.47 1yho s VAL 181 N -0.78 3.73 -0.07 3.70 1.01 -0.28 -0.41 120.40 127.30 1yho s VAL 181 Ca 0.12 -0.44 0.03 0.00 0.00 0.00 0.00 61.98 61.69 1yho s VAL 181 Cb -0.11 -2.58 0.01 0.00 0.00 0.00 0.00 36.38 33.70 1yho s VAL 181 CO 0.02 0.55 -0.16 -0.31 0.00 0.00 0.00 175.10 175.20 1yho s TYR 182 N -0.20 1.74 -0.01 5.22 2.02 0.28 0.57 117.35 126.97 1yho s TYR 182 Ca 0.03 -0.63 0.07 0.00 -0.37 0.00 0.00 57.07 56.17 1yho s TYR 182 Cb -0.13 -1.22 -0.02 0.00 -0.40 0.00 0.00 41.96 40.19 1yho s TYR 182 CO 0.03 -0.28 -0.23 -1.21 -1.57 0.00 0.00 175.55 172.28 1yho s GLU 183 N 0.45 2.13 -0.17 -0.62 8.01 -0.93 0.92 118.70 128.48 1yho s GLU 183 Ca -0.13 -0.92 -0.08 0.00 0.01 0.00 0.00 54.97 53.85 1yho s GLU 183 Cb -0.15 -2.10 -0.04 0.00 -4.31 0.00 0.00 34.13 27.52 1yho s GLU 183 CO 0.04 0.56 0.10 0.21 0.01 0.00 0.00 175.26 176.19 1yho s LYS 184 N -0.79 3.93 -0.11 1.61 2.36 -0.79 0.00 119.74 125.95 1yho s LYS 184 Ca 0.11 -0.25 -0.08 0.00 -2.55 0.00 0.00 55.97 53.20 1yho s LYS 184 Cb -0.10 -3.28 -0.04 0.00 -1.05 0.00 0.00 37.83 33.36 1yho s LYS 184 CO 0.00 0.40 0.16 -0.80 1.55 0.00 0.00 175.35 176.66 1yho s ASN 185 N 0.05 6.42 0.00 1.43 -0.87 -0.88 -4.04 114.94 117.05 1yho s ASN 185 Ca 0.08 0.50 0.18 0.00 -1.57 0.00 0.00 52.86 52.04 1yho s ASN 185 Cb -0.12 -2.08 1.05 0.00 -0.02 0.00 0.00 41.25 40.08 1yho s ASN 185 CO -0.00 0.40 1.45 0.47 -2.57 0.00 0.00 177.10 176.85