#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 0.36 2.94 7.63 0.00 -1.26 -4.99 105.19 109.86 1yho n GLY 2 Ca 0.00 -0.79 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.88 3.93 -0.32 1.61 0.01 -1.26 -4.99 113.70 109.80 1yho s SER 3 Ca 0.00 -1.26 -0.14 0.00 1.31 0.00 0.00 55.95 55.86 1yho s SER 3 Cb 0.00 -1.20 -0.02 0.00 0.21 0.00 0.00 66.02 65.01 1yho s SER 3 CO 0.00 -0.25 0.29 -0.76 0.41 0.00 0.00 173.24 172.93 1yho s LEU 4 N 1.37 4.35 0.02 2.44 1.02 -1.26 -1.39 118.68 125.23 1yho s LEU 4 Ca -0.04 -0.21 0.09 0.00 0.02 0.00 0.00 54.13 53.99 1yho s LEU 4 Cb -0.19 -2.23 -0.02 0.00 0.02 0.00 0.00 46.19 43.76 1yho s LEU 4 CO -0.07 -0.23 -0.26 0.20 0.02 0.00 0.00 176.35 176.01 1yho s ASN 5 N 1.73 3.05 0.00 2.29 -0.87 0.69 -0.92 114.94 120.90 1yho s ASN 5 Ca 0.09 -0.54 0.01 0.00 -1.57 0.00 0.00 52.86 50.85 1yho s ASN 5 Cb -0.17 -0.30 -0.00 0.00 -0.02 0.00 0.00 41.25 40.76 1yho s ASN 5 CO 0.11 0.27 -0.03 0.00 -2.57 0.00 0.00 177.10 174.89 1yho s ILE 7 N -0.16 -0.10 0.02 0.00 2.07 -0.88 0.26 121.20 122.41 1yho s ILE 7 Ca -0.00 0.07 -0.13 0.00 -1.41 0.00 0.00 60.65 59.18 1yho s ILE 7 Cb -0.02 -0.74 0.02 0.00 0.13 0.00 0.00 42.46 41.86 1yho s ILE 7 CO -0.00 0.03 0.28 0.68 -1.91 0.00 0.00 174.94 174.02 1yho s VAL 8 N 1.62 0.08 0.02 4.00 -7.23 0.33 -4.47 120.40 114.75 1yho s VAL 8 Ca -0.09 -0.66 -0.02 0.00 -1.81 0.00 0.00 61.98 59.40 1yho s VAL 8 Cb -0.08 -0.81 -0.04 0.00 0.56 0.00 0.00 36.38 36.01 1yho s VAL 8 CO -0.15 -0.36 0.21 0.00 -0.31 0.00 0.00 175.10 174.48 1yho s ALA 9 N -2.14 3.96 0.00 1.32 0.00 -1.26 -1.98 121.76 121.67 1yho s ALA 9 Ca -0.08 -0.77 -0.09 0.00 0.00 0.00 0.00 51.96 51.02 1yho s ALA 9 Cb -0.02 -1.89 0.01 0.00 0.00 0.00 0.00 23.12 21.21 1yho s ALA 9 CO -0.01 0.77 0.18 0.14 0.00 0.00 0.00 175.76 176.84 1yho s VAL 10 N -1.40 0.08 0.55 0.00 -7.23 0.26 -4.74 120.40 107.93 1yho s VAL 10 Ca 0.30 -0.67 0.05 0.00 -1.81 0.00 0.00 61.98 59.85 1yho s VAL 10 Cb -0.13 -0.54 0.06 0.00 0.56 0.00 0.00 36.38 36.33 1yho s VAL 10 CO 0.22 -0.37 0.76 -0.94 -0.31 0.00 0.00 175.10 174.47 1yho s SER 11 N -1.46 5.16 0.66 4.85 1.04 -0.97 -0.57 113.70 122.40 1yho s SER 11 Ca -0.13 -0.39 0.41 0.00 0.48 0.00 0.00 55.95 56.32 1yho s SER 11 Cb -0.06 -0.38 2.25 0.00 0.10 0.00 0.00 66.02 67.93 1yho s SER 11 CO 0.02 -1.22 2.30 -0.61 0.98 0.00 0.00 173.24 174.70 1yho h GLN 12 N 0.14 0.00 -0.93 4.02 4.15 -1.40 -0.29 115.11 120.80 1yho h GLN 12 Ca -0.38 0.00 -0.32 0.00 0.77 0.00 0.00 58.65 58.72 1yho h GLN 12 Cb 1.28 0.00 -0.19 0.00 0.21 0.00 0.00 27.48 28.78 1yho h GLN 12 CO 0.45 0.00 0.41 0.09 -1.93 0.00 0.00 178.83 177.85 1yho n ASN 13 N -3.16 3.85 -2.56 -0.69 3.02 -1.26 -4.88 115.26 109.59 1yho n ASN 13 Ca -0.03 -3.16 -0.08 0.00 -0.03 0.00 0.00 54.58 51.28 1yho n ASN 13 Cb 0.12 -0.74 -0.00 0.00 -0.61 0.00 0.00 39.78 38.54 1yho n ASN 13 CO 0.00 0.00 0.00 1.15 -2.62 0.00 0.00 177.26 175.79 1yho n MET 14 N -0.53 -2.60 -3.62 3.52 0.00 -0.12 -4.89 117.12 108.87 1yho n MET 14 Ca 0.42 0.33 -0.29 0.00 0.00 0.00 0.00 57.70 58.15 1yho n MET 14 Cb 1.34 -4.89 -0.04 0.00 0.00 0.00 0.00 33.22 29.64 1yho n MET 14 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 1yho s GLY 15 N -2.08 2.00 -0.06 3.17 0.00 -1.25 -0.40 107.32 108.69 1yho s GLY 15 Ca 0.04 -0.66 -0.00 0.00 0.00 0.00 0.00 44.72 44.09 1yho s GLY 15 CO 0.05 -0.59 -0.06 0.29 0.00 0.00 0.00 173.10 172.79 1yho n ILE 16 N -0.39 0.35 -3.65 0.90 -5.35 -1.12 -2.30 119.36 107.80 1yho n ILE 16 Ca -0.03 -0.13 -0.02 0.00 -0.27 0.00 0.00 62.75 62.30 1yho n ILE 16 Cb 0.53 -0.87 -0.03 0.00 -1.74 0.00 0.00 39.64 37.53 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 -4.69 -0.11 -0.08 3.28 0.00 -1.26 -4.38 107.32 100.08 1yho s GLY 17 Ca -0.08 2.19 0.04 0.00 0.00 0.00 0.00 44.72 46.87 1yho s GLY 17 CO 0.14 0.77 -0.20 1.25 0.00 0.00 0.00 173.10 175.06 1yho s LYS 18 N -1.75 2.49 -1.63 2.90 2.20 0.29 -3.48 119.74 120.76 1yho s LYS 18 Ca 0.11 -0.71 0.00 0.00 -0.36 0.00 0.00 55.97 55.02 1yho s LYS 18 Cb -0.01 -1.94 0.00 0.00 -1.51 0.00 0.00 37.83 34.37 1yho s LYS 18 CO -0.04 0.14 0.00 0.09 -0.36 0.00 0.00 175.35 175.19 1yho n ASN 19 N 3.56 -5.15 0.00 1.43 3.02 -1.26 -1.83 115.26 115.04 1yho n ASN 19 Ca -0.20 0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 1yho n ASN 19 Cb 0.53 -4.22 0.00 0.00 -0.61 0.00 0.00 39.78 35.48 1yho n ASN 19 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yho n GLY 20 N -0.95 0.41 3.05 7.41 0.00 -1.26 -5.05 105.19 108.80 1yho n GLY 20 Ca -0.20 -1.00 -0.09 0.00 0.00 0.00 0.00 46.02 44.73 1yho n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1yho s ASP 21 N -2.96 0.27 0.56 1.61 2.15 -0.76 -4.82 116.67 112.71 1yho s ASP 21 Ca 0.00 -0.61 -0.21 0.00 0.43 0.00 0.00 52.55 52.17 1yho s ASP 21 Cb 0.00 0.16 -0.04 0.00 -0.30 0.00 0.00 42.92 42.74 1yho s ASP 21 CO 0.00 -0.43 1.27 -0.76 -0.17 0.00 0.00 175.17 175.08 1yho s LEU 22 N -1.97 3.79 0.08 -1.34 1.43 -1.26 0.11 118.68 119.51 1yho s LEU 22 Ca -0.08 2.56 -0.15 0.00 -1.03 0.00 0.00 54.13 55.43 1yho s LEU 22 Cb -0.03 -4.41 -0.15 0.00 0.03 0.00 0.00 46.19 41.62 1yho s LEU 22 CO -0.04 -1.52 1.30 1.55 0.23 0.00 0.00 176.35 177.86 1yho h PRO 23 N 1.27 0.69 -7.12 1.29 0.13 -1.83 -3.43 132.00 123.00 1yho h PRO 23 Ca -0.51 -0.52 -0.46 0.00 -0.87 0.00 0.00 66.00 63.64 1yho h PRO 23 Cb 1.30 0.10 0.01 0.00 0.13 0.00 0.00 31.00 32.53 1yho h PRO 23 CO 0.57 1.14 0.37 1.67 -0.23 0.00 0.00 178.00 181.51 1yho s TRP 24 N -3.83 3.25 1.22 1.56 -2.14 -1.26 -4.82 118.94 112.92 1yho s TRP 24 Ca -0.12 1.55 -0.18 0.00 2.66 0.00 0.00 56.10 60.01 1yho s TRP 24 Cb 0.08 -2.90 0.29 0.00 -3.10 0.00 0.00 33.47 27.84 1yho s TRP 24 CO 0.87 -0.47 1.05 -1.25 -2.66 0.00 0.00 176.95 174.48 1yho s PRO 25 N -3.58 -1.33 -0.27 3.25 0.04 -1.26 -4.85 135.00 126.99 1yho s PRO 25 Ca 0.62 0.25 -0.40 0.00 0.04 0.00 0.00 61.00 61.51 1yho s PRO 25 Cb -0.12 -1.56 -0.15 0.00 0.04 0.00 0.00 34.50 32.72 1yho s PRO 25 CO 0.23 -3.85 1.79 -2.30 0.04 0.00 0.00 177.00 172.91 1yho n PRO 26 N -4.91 1.22 -3.85 0.56 -0.02 -1.26 -4.93 135.00 121.81 1yho n PRO 26 Ca 0.09 0.44 -0.34 0.00 -2.02 0.00 0.00 63.50 61.68 1yho n PRO 26 Cb 0.58 -2.16 -0.12 0.00 -0.02 0.00 0.00 33.50 31.78 1yho n PRO 26 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1yho s LEU 27 N 3.83 4.99 0.27 2.45 2.96 -1.26 -4.95 118.68 126.96 1yho s LEU 27 Ca 0.99 -2.39 -0.04 0.00 -0.22 0.00 0.00 54.13 52.46 1yho s LEU 27 Cb -1.04 -1.76 0.34 0.00 0.50 0.00 0.00 46.19 44.23 1yho s LEU 27 CO 0.64 -0.42 1.92 -0.09 -1.32 0.00 0.00 176.35 177.08 1yho h ARG 28 N 7.48 1.17 -0.65 1.98 9.65 -1.98 0.17 114.38 132.21 1yho h ARG 28 Ca -0.08 -0.10 -0.03 0.00 -1.10 0.00 0.00 59.98 58.68 1yho h ARG 28 Cb 1.00 -0.25 -0.03 0.00 -1.39 0.00 0.00 29.97 29.30 1yho h ARG 28 CO 0.66 0.81 0.29 -0.97 2.80 0.00 0.00 179.97 183.56 1yho h ASN 29 N 1.20 0.87 -0.11 -3.80 -1.24 -1.98 0.17 115.58 110.68 1yho h ASN 29 Ca 0.31 -0.15 -0.15 0.00 0.71 0.00 0.00 56.30 57.03 1yho h ASN 29 Cb -0.07 -0.22 0.01 0.00 0.73 0.00 0.00 38.32 38.76 1yho h ASN 29 CO -0.06 0.77 -0.50 -0.08 -1.29 0.00 0.00 177.43 176.27 1yho h GLU 30 N 0.91 0.54 -0.55 6.67 4.22 -1.86 -0.28 114.58 124.22 1yho h GLU 30 Ca 0.22 -0.43 -0.03 0.00 0.08 0.00 0.00 59.36 59.20 1yho h GLU 30 Cb 0.15 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1yho h GLU 30 CO -0.02 1.06 0.22 0.74 -2.18 0.00 0.00 179.01 178.82 1yho h PHE 31 N 0.16 0.84 -0.19 0.92 -1.00 -0.55 0.26 116.94 117.37 1yho h PHE 31 Ca -0.03 -0.06 -0.14 0.00 2.81 0.00 0.00 57.97 60.54 1yho h PHE 31 Cb 1.14 -0.25 0.00 0.00 3.61 0.00 0.00 35.95 40.45 1yho h PHE 31 CO 0.11 0.68 -0.43 -0.09 -1.61 0.00 0.00 178.31 176.98 1yho h ARG 32 N 0.75 0.63 -0.60 1.51 2.43 -0.71 -1.99 114.38 116.40 1yho h ARG 32 Ca 0.18 -0.42 -0.09 0.00 -0.81 0.00 0.00 59.98 58.84 1yho h ARG 32 Cb 0.20 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1yho h ARG 32 CO -0.01 1.04 0.02 -0.92 -1.51 0.00 0.00 179.97 178.58 1yho h TYR 33 N 0.31 1.11 -0.14 2.20 3.20 -0.93 -1.00 116.97 121.72 1yho h TYR 33 Ca 0.00 -0.18 -0.02 0.00 3.14 0.00 0.00 58.73 61.67 1yho h TYR 33 Cb 1.03 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 39.00 1yho h TYR 33 CO 0.09 0.97 -0.01 0.35 -1.64 0.00 0.00 178.16 177.93 1yho h PHE 34 N 0.94 0.28 -0.08 -3.82 3.57 -0.48 -0.91 116.94 116.45 1yho h PHE 34 Ca 0.17 -0.05 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 1yho h PHE 34 Cb 0.52 -0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 1yho h PHE 34 CO 0.04 0.49 0.04 1.96 -2.23 0.00 0.00 178.31 178.61 1yho h GLN 35 N -0.01 0.11 -0.69 1.11 4.20 -1.29 -2.39 115.11 116.15 1yho h GLN 35 Ca 0.04 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 1yho h GLN 35 Cb 0.38 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 1yho h GLN 35 CO 0.01 0.15 0.43 -0.09 -0.67 0.00 0.00 178.83 178.66 1yho h ARG 36 N 0.03 0.93 0.27 1.46 2.43 -1.19 0.52 114.38 118.84 1yho h ARG 36 Ca 0.03 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1yho h ARG 36 Cb 0.08 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.43 1yho h ARG 36 CO -0.00 0.64 -0.16 1.98 -1.51 0.00 0.00 179.97 180.92 1yho h MET 37 N 0.95 -0.40 -0.06 0.20 4.05 -0.84 -0.69 114.93 118.14 1yho h MET 37 Ca 0.25 0.03 -0.10 0.00 -0.28 0.00 0.00 59.70 59.60 1yho h MET 37 Cb -0.05 0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 30.82 1yho h MET 37 CO -0.05 -0.27 -0.41 1.15 0.23 0.00 0.00 176.91 177.57 1yho h THR 38 N -0.42 1.30 -0.02 -0.77 2.02 -1.20 -2.73 112.91 111.10 1yho h THR 38 Ca -0.03 -1.46 -0.07 0.00 0.77 0.00 0.00 66.41 65.61 1yho h THR 38 Cb 0.34 1.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.46 1yho h THR 38 CO 0.03 0.43 -0.33 0.74 0.37 0.00 0.00 175.52 176.76 1yho h THR 39 N 0.11 1.25 -2.25 3.16 2.02 -0.54 -3.40 112.91 113.25 1yho h THR 39 Ca 0.01 -1.18 -0.52 0.00 0.77 0.00 0.00 66.41 65.49 1yho h THR 39 Cb 0.77 1.61 -0.05 0.00 -1.74 0.00 0.00 68.15 68.74 1yho h THR 39 CO 0.06 0.34 1.24 0.42 0.37 0.00 0.00 175.52 177.95 1yho s THR 40 N -4.28 3.52 -0.06 3.16 -4.23 -0.30 -4.98 115.64 108.48 1yho s THR 40 Ca -0.03 0.35 -0.03 0.00 -1.18 0.00 0.00 61.69 60.79 1yho s THR 40 Cb 0.15 -4.22 -0.04 0.00 1.34 0.00 0.00 72.50 69.72 1yho s THR 40 CO 0.73 -1.13 0.12 -0.44 -0.54 0.00 0.00 174.62 173.35 1yho s SER 41 N 6.38 6.04 0.27 3.99 0.01 -1.26 -4.99 113.70 124.13 1yho s SER 41 Ca 0.58 0.31 0.08 0.00 1.31 0.00 0.00 55.95 58.23 1yho s SER 41 Cb -0.12 -1.86 0.37 0.00 0.21 0.00 0.00 66.02 64.62 1yho s SER 41 CO 0.21 0.33 1.63 -1.28 0.41 0.00 0.00 173.24 174.54 1yho h SER 42 N 4.47 0.14 -3.54 2.44 0.87 -1.97 -3.42 113.55 112.54 1yho h SER 42 Ca -0.51 -0.08 -0.64 0.00 -1.23 0.00 0.00 61.79 59.33 1yho h SER 42 Cb 1.20 -0.04 -0.21 0.00 -0.44 0.00 0.00 62.40 62.91 1yho h SER 42 CO 0.61 0.67 -0.62 -0.69 -0.53 0.00 0.00 176.83 176.28 1yho s VAL 43 N -3.81 4.35 0.40 2.23 1.01 -1.26 -5.09 120.40 118.23 1yho s VAL 43 Ca -0.03 -0.17 -0.25 0.00 0.00 0.00 0.00 61.98 61.54 1yho s VAL 43 Cb 0.13 -3.01 -0.09 0.00 0.00 0.00 0.00 36.38 33.41 1yho s VAL 43 CO 0.77 0.38 1.09 -1.61 0.00 0.00 0.00 175.10 175.73 1yho s GLU 44 N 1.24 4.13 -0.23 2.72 2.02 -1.26 -3.20 118.70 124.13 1yho s GLU 44 Ca 0.04 1.63 0.00 0.00 0.02 0.00 0.00 54.97 56.66 1yho s GLU 44 Cb -0.15 -2.60 0.00 0.00 0.10 0.00 0.00 34.13 31.48 1yho s GLU 44 CO 0.03 -0.20 0.00 0.41 0.02 0.00 0.00 175.26 175.53 1yho n GLY 45 N 0.48 0.54 3.66 -1.39 0.00 -1.26 -5.02 105.19 102.20 1yho n GLY 45 Ca 0.05 -0.34 -0.23 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 -1.29 2.32 -0.05 1.61 -0.14 -1.19 -5.11 119.74 115.88 1yho s LYS 46 Ca 0.00 -1.43 0.04 0.00 -1.36 0.00 0.00 55.97 53.22 1yho s LYS 46 Cb 0.00 -2.17 -0.02 0.00 -1.68 0.00 0.00 37.83 33.95 1yho s LYS 46 CO 0.00 0.33 -0.16 -0.65 -0.76 0.00 0.00 175.35 174.11 1yho s GLN 47 N -3.70 2.53 -0.09 1.68 -0.21 -1.20 -5.00 119.66 113.66 1yho s GLN 47 Ca 0.32 -0.73 -0.09 0.00 0.02 0.00 0.00 55.36 54.88 1yho s GLN 47 Cb -0.06 -2.36 -0.04 0.00 1.00 0.00 0.00 33.01 31.55 1yho s GLN 47 CO 0.20 0.58 0.22 -0.80 -2.12 0.00 0.00 175.29 173.37 1yho s ASN 48 N -0.62 6.50 -0.21 5.90 0.01 -1.26 -1.70 114.94 123.56 1yho s ASN 48 Ca 0.09 0.60 -0.05 0.00 -0.71 0.00 0.00 52.86 52.79 1yho s ASN 48 Cb -0.11 -2.12 -0.02 0.00 0.41 0.00 0.00 41.25 39.40 1yho s ASN 48 CO 0.01 0.38 0.01 -0.22 -1.51 0.00 0.00 177.10 175.76 1yho s LEU 49 N -0.98 3.27 0.11 0.60 2.96 -0.91 -0.95 118.68 122.78 1yho s LEU 49 Ca 0.17 -0.21 0.07 0.00 -0.22 0.00 0.00 54.13 53.94 1yho s LEU 49 Cb -0.13 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 1yho s LEU 49 CO 0.06 0.04 -0.09 0.68 -1.32 0.00 0.00 176.35 175.72 1yho s VAL 50 N 1.14 3.41 -0.13 1.68 -7.23 0.68 -0.90 120.40 119.04 1yho s VAL 50 Ca 0.03 -1.29 -0.03 0.00 -1.81 0.00 0.00 61.98 58.88 1yho s VAL 50 Cb -0.14 -2.61 -0.03 0.00 0.56 0.00 0.00 36.38 34.16 1yho s VAL 50 CO 0.02 0.08 -0.05 -0.63 -0.31 0.00 0.00 175.10 174.21 1yho s ILE 51 N -1.28 3.84 0.08 -0.62 -1.09 -0.35 -0.52 121.20 121.26 1yho s ILE 51 Ca 0.22 -0.39 0.04 0.00 -2.23 0.00 0.00 60.65 58.29 1yho s ILE 51 Cb -0.11 -2.66 -0.03 0.00 -1.58 0.00 0.00 42.46 38.08 1yho s ILE 51 CO 0.14 0.52 -0.11 -0.04 -1.23 0.00 0.00 174.94 174.23 1yho s MET 52 N 0.08 0.78 0.68 2.79 -1.94 0.22 -2.02 119.30 119.89 1yho s MET 52 Ca -0.01 -1.03 -0.05 0.00 -1.71 0.00 0.00 55.69 52.89 1yho s MET 52 Cb -0.14 -0.57 0.06 0.00 2.01 0.00 0.00 34.83 36.20 1yho s MET 52 CO 0.03 0.10 0.97 0.20 -0.01 0.00 0.00 175.02 176.31 1yho s GLY 53 N -2.10 1.72 0.19 -0.03 0.00 -1.19 -1.89 107.32 104.02 1yho s GLY 53 Ca 0.01 -1.05 -0.09 0.00 0.00 0.00 0.00 44.72 43.58 1yho s GLY 53 CO 0.01 -0.66 1.69 1.70 0.00 0.00 0.00 173.10 175.84 1yho h LYS 54 N -0.49 1.10 -0.11 2.90 3.11 -1.96 -0.82 116.57 120.30 1yho h LYS 54 Ca -0.44 -0.29 -0.05 0.00 -2.81 0.00 0.00 60.65 57.07 1yho h LYS 54 Cb 1.31 -0.13 -0.00 0.00 -1.00 0.00 0.00 32.23 32.40 1yho h LYS 54 CO 0.57 1.00 -0.13 0.87 -2.81 0.00 0.00 179.45 178.95 1yho h LYS 55 N 1.03 0.29 -0.37 1.90 1.57 -1.94 -2.25 116.57 116.81 1yho h LYS 55 Ca 0.21 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1yho h LYS 55 Cb 0.42 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 1yho h LYS 55 CO 0.01 0.72 0.24 1.15 -0.57 0.00 0.00 179.45 180.99 1yho h THR 56 N -0.12 1.08 -0.59 -0.16 2.02 -1.88 -0.24 112.91 113.03 1yho h THR 56 Ca 0.02 -0.17 0.01 0.00 0.77 0.00 0.00 66.41 67.04 1yho h THR 56 Cb 0.67 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 1yho h THR 56 CO 0.03 0.09 0.39 -0.25 0.37 0.00 0.00 175.52 176.15 1yho h TRP 57 N 0.48 0.74 0.00 3.16 2.91 -1.18 -0.64 115.95 121.43 1yho h TRP 57 Ca 0.14 0.02 -0.01 0.00 1.13 0.00 0.00 58.89 60.16 1yho h TRP 57 Cb -0.05 -0.25 -0.00 0.00 -0.51 0.00 0.00 29.16 28.35 1yho h TRP 57 CO -0.06 0.46 -0.06 0.74 -1.03 0.00 0.00 178.44 178.50 1yho h PHE 58 N 0.80 0.00 0.00 2.65 -1.00 -1.06 -2.75 116.94 115.57 1yho h PHE 58 Ca 0.22 0.00 -0.24 0.00 2.81 0.00 0.00 57.97 60.76 1yho h PHE 58 Cb -0.09 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.43 1yho h PHE 58 CO -0.03 0.06 -1.25 0.77 -1.61 0.00 0.00 178.31 176.25 1yho h SER 59 N 0.00 0.00 -3.10 2.17 0.02 0.06 -3.45 113.55 109.24 1yho h SER 59 Ca -0.00 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.41 1yho h SER 59 Cb 0.51 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.05 1yho h SER 59 CO 0.01 0.99 0.65 -0.63 -1.14 0.00 0.00 176.83 176.71 1yho s ILE 60 N -2.67 3.81 0.53 3.27 1.01 -0.35 -4.98 121.20 121.82 1yho s ILE 60 Ca -0.01 1.28 -0.21 0.00 0.00 0.00 0.00 60.65 61.72 1yho s ILE 60 Cb 0.09 -3.82 -0.07 0.00 0.01 0.00 0.00 42.46 38.67 1yho s ILE 60 CO 0.82 0.08 0.97 -2.65 0.00 0.00 0.00 174.94 174.16 1yho n PRO 61 N 4.19 1.10 0.17 2.79 -0.02 -1.26 -4.90 135.00 137.06 1yho n PRO 61 Ca 0.10 0.41 0.01 0.00 -2.02 0.00 0.00 63.50 62.00 1yho n PRO 61 Cb 0.45 -2.11 0.28 0.00 -0.02 0.00 0.00 33.50 32.09 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 0.92 0.00 -0.30 -0.52 4.22 -1.93 -2.88 114.58 114.09 1yho h GLU 62 Ca -0.47 0.00 0.01 0.00 0.08 0.00 0.00 59.36 58.98 1yho h GLU 62 Cb 1.35 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.59 1yho h GLU 62 CO 0.53 0.48 0.20 1.57 -2.18 0.00 0.00 179.01 179.61 1yho h LYS 63 N 0.00 0.36 -0.80 1.92 2.10 -2.01 -0.84 116.57 117.30 1yho h LYS 63 Ca -0.00 -0.02 -0.26 0.00 -2.00 0.00 0.00 60.65 58.36 1yho h LYS 63 Cb 0.86 -0.08 -0.16 0.00 -0.90 0.00 0.00 32.23 31.95 1yho h LYS 63 CO 0.06 0.24 0.34 0.09 -2.00 0.00 0.00 179.45 178.18 1yho n ASN 64 N -4.49 4.70 -3.87 7.07 3.02 -1.09 -4.91 115.26 115.69 1yho n ASN 64 Ca 0.02 -3.27 -0.12 0.00 -0.03 0.00 0.00 54.58 51.18 1yho n ASN 64 Cb 0.10 -0.76 -0.14 0.00 -0.61 0.00 0.00 39.78 38.36 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 -3.02 0.03 0.64 3.52 0.52 -0.32 -3.84 118.95 116.47 1yho s ARG 65 Ca 0.55 -0.01 -0.15 0.00 -0.52 0.00 0.00 55.73 55.60 1yho s ARG 65 Cb 0.45 0.01 -0.01 0.00 0.52 0.00 0.00 34.95 35.91 1yho s ARG 65 CO 0.13 -0.00 1.09 -1.25 0.02 0.00 0.00 175.30 175.28 1yho s PRO 66 N -0.06 3.00 -0.61 3.54 0.04 -1.26 -4.89 135.00 134.76 1yho s PRO 66 Ca -0.01 1.28 -0.27 0.00 0.04 0.00 0.00 61.00 62.05 1yho s PRO 66 Cb -0.01 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 1yho s PRO 66 CO -0.00 -1.07 1.72 -1.17 0.04 0.00 0.00 177.00 176.52 1yho s LEU 67 N -4.78 3.29 0.34 -3.56 1.98 -1.25 -4.95 118.68 109.74 1yho s LEU 67 Ca 0.65 0.26 -0.29 0.00 -2.89 0.00 0.00 54.13 51.86 1yho s LEU 67 Cb -0.18 -2.64 -0.12 0.00 0.66 0.00 0.00 46.19 43.91 1yho s LEU 67 CO 0.41 -2.19 1.47 0.29 -1.89 0.00 0.00 176.35 174.44 1yho n LYS 68 N 9.13 2.54 0.00 1.98 5.02 -1.26 -2.11 118.16 133.45 1yho n LYS 68 Ca 0.17 0.89 0.00 0.00 -2.02 0.00 0.00 58.31 57.35 1yho n LYS 68 Cb 0.51 -2.61 0.00 0.00 -0.02 0.00 0.00 35.03 32.91 1yho n LYS 68 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1yho n GLY 69 N 1.05 3.03 3.23 0.72 0.00 -1.26 -5.01 105.19 106.95 1yho n GLY 69 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.21 0.97 -0.27 1.61 0.52 -0.90 -4.46 118.95 116.21 1yho s ARG 70 Ca 0.00 -1.08 -0.15 0.00 -0.52 0.00 0.00 55.73 53.98 1yho s ARG 70 Cb 0.00 -1.07 -0.04 0.00 0.52 0.00 0.00 34.95 34.36 1yho s ARG 70 CO 0.00 0.24 0.39 0.42 0.02 0.00 0.00 175.30 176.37 1yho s ILE 71 N -1.34 5.16 -0.22 1.52 -1.09 -0.13 -4.55 121.20 120.55 1yho s ILE 71 Ca 0.03 0.58 -0.12 0.00 -2.23 0.00 0.00 60.65 58.91 1yho s ILE 71 Cb -0.09 -3.72 -0.05 0.00 -1.58 0.00 0.00 42.46 37.02 1yho s ILE 71 CO 0.03 0.14 0.25 0.20 -1.23 0.00 0.00 174.94 174.33 1yho s ASN 72 N 1.64 6.25 -0.08 3.58 0.01 -1.26 -0.23 114.94 124.84 1yho s ASN 72 Ca 0.16 0.28 0.03 0.00 -0.71 0.00 0.00 52.86 52.61 1yho s ASN 72 Cb -0.16 -2.15 -0.02 0.00 0.41 0.00 0.00 41.25 39.33 1yho s ASN 72 CO 0.10 0.03 -0.18 -0.22 -1.51 0.00 0.00 177.10 175.32 1yho s LEU 73 N 1.07 2.50 -0.10 0.60 0.20 0.32 -1.74 118.68 121.54 1yho s LEU 73 Ca 0.12 -0.35 -0.02 0.00 0.69 0.00 0.00 54.13 54.57 1yho s LEU 73 Cb -0.14 -1.51 -0.03 0.00 -0.43 0.00 0.00 46.19 44.08 1yho s LEU 73 CO 0.05 0.25 0.00 -0.69 -0.29 0.00 0.00 176.35 175.68 1yho s VAL 74 N -0.18 4.31 -0.32 1.68 1.01 -0.38 0.69 120.40 127.21 1yho s VAL 74 Ca -0.01 -0.24 -0.07 0.00 0.00 0.00 0.00 61.98 61.66 1yho s VAL 74 Cb -0.13 -2.83 0.02 0.00 0.00 0.00 0.00 36.38 33.44 1yho s VAL 74 CO 0.03 0.59 0.10 -0.76 0.00 0.00 0.00 175.10 175.06 1yho s LEU 75 N -0.68 4.09 -0.14 3.92 2.01 -0.79 -1.85 118.68 125.24 1yho s LEU 75 Ca 0.11 -0.90 -0.15 0.00 0.01 0.00 0.00 54.13 53.21 1yho s LEU 75 Cb -0.12 -1.89 0.04 0.00 0.01 0.00 0.00 46.19 44.24 1yho s LEU 75 CO 0.02 -0.26 0.41 -0.55 1.01 0.00 0.00 176.35 176.98 1yho s SER 76 N 1.47 -0.41 -0.24 2.29 0.15 -0.47 -4.05 113.70 112.43 1yho s SER 76 Ca 0.01 0.74 0.04 0.00 0.70 0.00 0.00 55.95 57.44 1yho s SER 76 Cb -0.18 0.78 -0.17 0.00 -1.71 0.00 0.00 66.02 64.73 1yho s SER 76 CO 0.03 -0.19 -0.18 0.54 1.20 0.00 0.00 173.24 174.63 1yho n ARG 77 N 2.62 0.65 -0.05 5.44 5.12 -1.26 -3.74 116.66 125.45 1yho n ARG 77 Ca -0.14 0.12 0.01 0.00 -1.93 0.00 0.00 57.85 55.91 1yho n ARG 77 Cb 0.57 -1.50 0.32 0.00 -1.16 0.00 0.00 32.46 30.69 1yho n ARG 77 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 1yho h GLU 78 N 0.00 0.63 -6.85 5.56 5.08 -1.97 -3.42 114.58 113.62 1yho h GLU 78 Ca -0.55 -0.09 -0.49 0.00 -1.00 0.00 0.00 59.36 57.23 1yho h GLU 78 Cb 1.91 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 31.05 1yho h GLU 78 CO -0.07 0.53 0.41 -0.51 -1.00 0.00 0.00 179.01 178.37 1yho s LEU 79 N -9.35 4.43 -0.21 1.33 1.43 -1.26 -4.97 118.68 110.08 1yho s LEU 79 Ca -0.09 2.08 0.15 0.00 -1.03 0.00 0.00 54.13 55.24 1yho s LEU 79 Cb 0.16 -3.83 -0.23 0.00 0.03 0.00 0.00 46.19 42.32 1yho s LEU 79 CO 0.76 -0.16 0.01 1.17 0.23 0.00 0.00 176.35 178.36 1yho n LYS 80 N 0.81 0.68 -4.46 1.70 4.81 -1.26 -4.96 118.16 115.48 1yho n LYS 80 Ca 0.01 0.02 -0.25 0.00 -0.87 0.00 0.00 58.31 57.23 1yho n LYS 80 Cb 0.47 -1.52 -0.13 0.00 0.02 0.00 0.00 35.03 33.87 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 -2.50 1.24 0.39 1.64 -6.30 -1.26 -5.12 118.70 106.80 1yho s GLU 81 Ca -0.15 -1.03 -0.26 0.00 -2.50 0.00 0.00 54.97 51.03 1yho s GLU 81 Cb 0.07 -1.42 -0.11 0.00 0.00 0.00 0.00 34.13 32.66 1yho s GLU 81 CO 0.78 0.35 1.08 -2.30 0.02 0.00 0.00 175.26 175.19 1yho n PRO 82 N 1.50 1.52 -1.92 4.30 -0.02 -1.26 -4.96 135.00 134.15 1yho n PRO 82 Ca -0.18 0.54 -0.33 0.00 -2.02 0.00 0.00 63.50 61.51 1yho n PRO 82 Cb 0.53 -2.08 0.02 0.00 -0.02 0.00 0.00 33.50 31.96 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 -1.94 3.15 0.08 0.52 0.04 -1.26 -4.95 135.00 130.64 1yho s PRO 83 Ca 0.61 1.22 -0.32 0.00 0.04 0.00 0.00 61.00 62.55 1yho s PRO 83 Cb -0.58 -2.01 -0.11 0.00 0.04 0.00 0.00 34.50 31.85 1yho s PRO 83 CO 0.58 -0.95 1.85 0.94 0.04 0.00 0.00 177.00 179.46 1yho n GLN 84 N -2.25 2.66 0.00 4.56 -0.06 -1.26 -1.37 117.38 119.66 1yho n GLN 84 Ca 0.09 0.97 0.00 0.00 -2.00 0.00 0.00 57.00 56.06 1yho n GLN 84 Cb 0.53 -2.86 0.00 0.00 -4.06 0.00 0.00 30.24 23.85 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 4.25 3.13 3.76 1.69 0.00 -1.26 -5.04 105.19 111.72 1yho n GLY 85 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 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 3.32 0.07 4.61 0.00 -0.47 -4.31 121.76 122.11 1yho s ALA 86 Ca 0.00 0.72 -0.14 0.00 0.00 0.00 0.00 51.96 52.55 1yho s ALA 86 Cb 0.00 -3.26 -0.24 0.00 0.00 0.00 0.00 23.12 19.62 1yho s ALA 86 CO 0.00 0.01 1.17 0.45 0.00 0.00 0.00 175.76 177.39 1yho h HIS 87 N 3.69 1.03 -2.80 0.00 3.86 -1.65 -3.45 115.15 115.82 1yho h HIS 87 Ca -0.46 -0.58 -0.08 0.00 -1.16 0.00 0.00 60.37 58.09 1yho h HIS 87 Cb 1.21 -0.11 -0.17 0.00 1.06 0.00 0.00 27.41 29.39 1yho h HIS 87 CO 0.60 1.42 -0.05 -0.06 0.86 0.00 0.00 177.93 180.70 1yho s PHE 88 N -3.22 -0.35 -0.03 2.45 0.08 -1.21 -5.05 117.98 110.64 1yho s PHE 88 Ca -0.10 0.44 0.02 0.00 0.12 0.00 0.00 56.93 57.41 1yho s PHE 88 Cb 0.07 0.26 0.01 0.00 -0.57 0.00 0.00 43.02 42.78 1yho s PHE 88 CO 0.92 -0.57 -0.09 -1.17 -0.10 0.00 0.00 175.22 174.22 1yho s LEU 89 N -1.76 1.73 0.07 -0.37 2.96 -1.26 -1.25 118.68 118.79 1yho s LEU 89 Ca -0.08 -0.19 0.06 0.00 -0.22 0.00 0.00 54.13 53.71 1yho s LEU 89 Cb -0.01 -0.55 -0.03 0.00 0.50 0.00 0.00 46.19 46.10 1yho s LEU 89 CO 0.01 0.05 -0.18 -0.44 -1.32 0.00 0.00 176.35 174.47 1yho s SER 90 N 0.31 2.11 -0.07 3.68 0.01 -0.77 -4.88 113.70 114.08 1yho s SER 90 Ca -0.05 -0.59 -0.10 0.00 1.31 0.00 0.00 55.95 56.52 1yho s SER 90 Cb -0.10 -0.12 -0.29 0.00 0.21 0.00 0.00 66.02 65.72 1yho s SER 90 CO 0.01 0.04 0.56 0.03 0.41 0.00 0.00 173.24 174.28 1yho h ARG 91 N 4.46 0.35 -5.97 12.44 3.08 -1.89 -1.25 114.38 125.61 1yho h ARG 91 Ca -0.42 -0.60 -0.52 0.00 0.07 0.00 0.00 59.98 58.51 1yho h ARG 91 Cb 1.18 0.22 -0.21 0.00 0.08 0.00 0.00 29.97 31.24 1yho h ARG 91 CO 0.41 1.29 -0.81 -1.12 -1.07 0.00 0.00 179.97 178.67 1yho s SER 92 N -7.21 2.40 0.46 7.04 0.01 -1.26 -4.37 113.70 110.78 1yho s SER 92 Ca -0.18 -0.71 0.12 0.00 1.31 0.00 0.00 55.95 56.49 1yho s SER 92 Cb 0.06 -0.12 1.06 0.00 0.21 0.00 0.00 66.02 67.22 1yho s SER 92 CO 0.82 0.01 2.09 0.25 0.41 0.00 0.00 173.24 176.83 1yho h LEU 93 N 3.96 0.21 -1.07 2.44 5.85 -1.99 -1.36 115.31 123.35 1yho h LEU 93 Ca -0.44 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.19 1yho h LEU 93 Cb 1.19 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 1yho h LEU 93 CO 0.42 0.17 -0.16 0.44 -0.34 0.00 0.00 178.44 178.97 1yho h ASP 94 N 0.24 0.46 -0.03 1.25 5.19 -1.98 -0.60 116.42 120.95 1yho h ASP 94 Ca 0.06 -0.13 -0.02 0.00 -0.62 0.00 0.00 57.03 56.32 1yho h ASP 94 Cb 0.01 -0.12 0.00 0.00 0.18 0.00 0.00 39.33 39.40 1yho h ASP 94 CO -0.01 0.65 -0.07 -0.78 -3.12 0.00 0.00 179.24 175.90 1yho h ASP 95 N 0.43 0.12 -0.14 6.45 1.82 -1.68 -1.94 116.42 121.48 1yho h ASP 95 Ca 0.08 -0.58 -0.05 0.00 -0.39 0.00 0.00 57.03 56.09 1yho h ASP 95 Cb 0.54 -0.03 -0.02 0.00 0.68 0.00 0.00 39.33 40.50 1yho h ASP 95 CO 0.03 0.68 -0.04 0.00 -1.61 0.00 0.00 179.24 178.31 1yho h ALA 96 N 0.44 1.45 -0.29 -0.78 0.00 -1.37 -1.83 119.26 116.88 1yho h ALA 96 Ca 0.00 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.57 1yho h ALA 96 Cb 0.66 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1yho h ALA 96 CO 0.02 0.39 -0.42 -0.07 0.00 0.00 0.00 179.25 179.17 1yho h LEU 97 N 0.39 0.88 -0.74 0.00 3.38 -1.11 -2.34 115.31 115.78 1yho h LEU 97 Ca 0.09 -0.51 -0.08 0.00 0.09 0.00 0.00 57.88 57.47 1yho h LEU 97 Cb 0.32 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1yho h LEU 97 CO 0.01 1.21 0.09 0.11 0.09 0.00 0.00 178.44 179.95 1yho h LYS 98 N 0.57 1.05 -0.17 1.13 1.57 -1.03 -1.08 116.57 118.62 1yho h LYS 98 Ca 0.03 -0.28 -0.02 0.00 -1.87 0.00 0.00 60.65 58.51 1yho h LYS 98 Cb 1.02 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 1yho h LYS 98 CO 0.10 0.97 0.03 -0.07 -0.57 0.00 0.00 179.45 179.91 1yho h LEU 99 N 0.98 0.26 -1.62 2.94 3.38 -1.31 0.90 115.31 120.84 1yho h LEU 99 Ca 0.19 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.87 1yho h LEU 99 Cb 0.44 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1yho h LEU 99 CO 0.01 0.45 -0.20 0.74 0.09 0.00 0.00 178.44 179.53 1yho h THR 100 N 0.07 0.79 0.00 0.22 2.02 -1.32 -2.27 112.91 112.42 1yho h THR 100 Ca 0.05 -0.80 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1yho h THR 100 Cb 0.30 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.19 1yho h THR 100 CO 0.00 0.20 -0.64 -0.08 0.37 0.00 0.00 175.52 175.37 1yho h GLU 101 N 0.00 0.00 -6.81 6.66 4.81 -0.89 -3.35 114.58 115.00 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 0.47 0.00 0.07 0.00 0.63 0.00 0.00 28.75 29.92 1yho h GLU 101 CO 0.03 0.00 0.75 -1.14 -0.73 0.00 0.00 179.01 177.92 1yho s GLN 102 N -3.30 4.24 0.45 1.92 2.00 0.28 -4.71 119.66 120.55 1yho s GLN 102 Ca 0.02 2.36 0.19 0.00 -2.00 0.00 0.00 55.36 55.93 1yho s GLN 102 Cb 0.08 -3.07 1.15 0.00 0.80 0.00 0.00 33.01 31.97 1yho s GLN 102 CO 0.74 -0.42 1.90 -1.35 -0.50 0.00 0.00 175.29 175.67 1yho h PRO 103 N 4.41 0.31 -0.65 1.67 0.11 -1.90 0.87 132.00 136.82 1yho h PRO 103 Ca -0.47 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.66 1yho h PRO 103 Cb 1.22 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.23 1yho h PRO 103 CO 0.74 0.20 0.43 1.49 -0.21 0.00 0.00 178.00 180.65 1yho h GLU 104 N 0.32 0.72 0.00 1.05 4.57 -1.90 -2.85 114.58 116.49 1yho h GLU 104 Ca 0.40 -0.04 -0.18 0.00 -1.18 0.00 0.00 59.36 58.36 1yho h GLU 104 Cb 1.08 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 29.47 1yho h GLU 104 CO -0.11 0.48 -2.07 1.28 -1.18 0.00 0.00 179.01 177.40 1yho n LEU 105 N -4.47 0.00 0.04 1.64 4.32 -0.08 -4.37 117.00 114.08 1yho n LEU 105 Ca 0.08 0.00 0.19 0.00 -0.02 0.00 0.00 56.01 56.26 1yho n LEU 105 Cb 0.16 0.24 0.69 0.00 -1.62 0.00 0.00 43.42 42.89 1yho n LEU 105 CO 0.35 0.24 1.17 0.00 -1.22 0.00 0.00 177.39 177.93 1yho h ALA 106 N 1.28 2.40 -0.00 -1.18 0.00 0.89 0.89 119.26 123.53 1yho h ALA 106 Ca -0.27 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.47 1yho h ALA 106 Cb 1.55 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.35 1yho h ALA 106 CO 0.01 -0.56 -0.74 -0.91 0.00 0.00 0.00 179.25 177.05 1yho h ASN 107 N 0.00 0.04 0.50 0.00 -0.26 -1.72 -3.24 115.58 110.90 1yho h ASN 107 Ca 0.21 -0.03 -0.22 0.00 -0.56 0.00 0.00 56.30 55.70 1yho h ASN 107 Cb 0.87 -0.01 -0.04 0.00 -1.06 0.00 0.00 38.32 38.08 1yho h ASN 107 CO -0.00 0.77 -1.68 0.29 -1.06 0.00 0.00 177.43 175.75 1yho n LYS 108 N -3.68 0.64 -4.16 0.81 4.01 0.39 -4.91 118.16 111.26 1yho n LYS 108 Ca -0.01 0.18 -0.32 0.00 -0.51 0.00 0.00 58.31 57.65 1yho n LYS 108 Cb 0.72 -1.74 -0.08 0.00 -0.51 0.00 0.00 35.03 33.42 1yho n LYS 108 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1yho s VAL 109 N -2.80 4.40 -0.02 -0.18 1.01 0.28 -3.28 120.40 119.81 1yho s VAL 109 Ca -0.05 -0.62 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 1yho s VAL 109 Cb 0.08 -3.03 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 1yho s VAL 109 CO 0.82 0.28 -0.13 -0.67 0.00 0.00 0.00 175.10 175.40 1yho n ASP 110 N 1.02 1.31 -4.06 3.32 2.03 -0.69 -4.45 116.55 115.03 1yho n ASP 110 Ca -0.12 0.20 -0.09 0.00 0.52 0.00 0.00 54.79 55.30 1yho n ASP 110 Cb 0.52 -0.46 -0.10 0.00 -0.72 0.00 0.00 41.12 40.36 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 -2.32 0.53 -0.11 -0.67 -1.94 -1.26 -2.04 119.30 111.49 1yho s MET 111 Ca -0.12 -0.98 -0.05 0.00 -1.71 0.00 0.00 55.69 52.84 1yho s MET 111 Cb 0.02 0.07 -0.04 0.00 2.01 0.00 0.00 34.83 36.90 1yho s MET 111 CO 0.16 -0.06 0.08 0.08 -0.01 0.00 0.00 175.02 175.27 1yho s VAL 112 N -2.77 4.96 -0.11 -6.03 1.01 -0.48 -2.13 120.40 114.84 1yho s VAL 112 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.96 1yho s VAL 112 Cb -0.00 -3.13 0.02 0.00 0.00 0.00 0.00 36.38 33.26 1yho s VAL 112 CO -0.05 0.61 -0.09 0.26 0.00 0.00 0.00 175.10 175.83 1yho s TRP 113 N -0.90 1.54 -0.22 5.22 0.52 -0.08 -0.22 118.94 124.80 1yho s TRP 113 Ca 0.14 -0.77 -0.23 0.00 0.02 0.00 0.00 56.10 55.26 1yho s TRP 113 Cb -0.12 -1.25 -0.01 0.00 -1.15 0.00 0.00 33.47 30.94 1yho s TRP 113 CO 0.03 -0.51 0.74 0.42 0.02 0.00 0.00 176.95 177.65 1yho s ILE 114 N 1.60 4.92 -0.29 2.03 -1.09 0.15 -1.21 121.20 127.31 1yho s ILE 114 Ca 0.03 1.40 0.09 0.00 -2.23 0.00 0.00 60.65 59.94 1yho s ILE 114 Cb -0.13 -4.04 0.47 0.00 -1.58 0.00 0.00 42.46 37.18 1yho s ILE 114 CO -0.07 0.01 1.18 1.33 -1.23 0.00 0.00 174.94 176.15 1yho n VAL 115 N 5.00 2.36 0.00 2.92 0.24 -0.86 -2.07 118.33 125.92 1yho n VAL 115 Ca 0.02 -4.07 0.00 0.00 -2.04 0.00 0.00 64.34 58.26 1yho n VAL 115 Cb 0.49 -0.82 0.00 0.00 -1.47 0.00 0.00 33.84 32.03 1yho n VAL 115 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1yho n GLY 116 N -0.69 0.35 0.00 7.63 0.00 -1.25 -4.79 105.19 106.44 1yho n GLY 116 Ca 0.39 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.49 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 0.50 1.38 0.20 -0.02 0.00 -1.26 -3.17 105.19 102.81 1yho n GLY 117 Ca 0.00 -1.68 -0.10 0.00 0.00 0.00 0.00 46.02 44.25 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 0.58 -0.45 1.61 0.02 -1.99 -2.04 113.55 111.27 1yho h SER 118 Ca 0.00 -0.25 0.04 0.00 -0.84 0.00 0.00 61.79 60.74 1yho h SER 118 Cb 0.00 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.35 1yho h SER 118 CO 0.00 0.68 0.22 -1.28 -1.14 0.00 0.00 176.83 175.31 1yho h SER 119 N 0.46 0.32 -0.52 3.07 0.87 -2.00 -0.87 113.55 114.88 1yho h SER 119 Ca 0.12 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.68 1yho h SER 119 Cb 0.34 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.24 1yho h SER 119 CO 0.00 0.23 0.24 0.58 -0.53 0.00 0.00 176.83 177.35 1yho h VAL 120 N 0.44 1.20 -0.60 2.23 2.07 -1.83 -2.40 116.25 117.37 1yho h VAL 120 Ca 0.20 -0.59 -0.08 0.00 0.82 0.00 0.00 66.70 67.04 1yho h VAL 120 Cb 0.11 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.37 1yho h VAL 120 CO -0.14 0.24 0.05 0.22 0.02 0.00 0.00 177.57 177.95 1yho h TYR 121 N 0.79 1.10 0.03 1.57 3.20 -0.58 -1.78 116.97 121.31 1yho h TYR 121 Ca 0.19 -0.17 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 1yho h TYR 121 Cb 0.13 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.11 1yho h TYR 121 CO 0.01 0.97 -0.01 0.87 -1.64 0.00 0.00 178.16 178.35 1yho h LYS 122 N 0.92 -0.04 -0.83 1.82 1.57 -0.71 0.28 116.57 119.57 1yho h LYS 122 Ca 0.17 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1yho h LYS 122 Cb 0.50 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.77 1yho h LYS 122 CO 0.02 -0.02 0.49 0.93 -0.57 0.00 0.00 179.45 180.30 1yho h GLU 123 N -0.04 1.14 0.00 3.15 4.39 -1.39 -1.87 114.58 119.95 1yho h GLU 123 Ca -0.00 -0.11 -0.09 0.00 0.34 0.00 0.00 59.36 59.49 1yho h GLU 123 Cb 0.03 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.44 1yho h GLU 123 CO 0.01 0.81 -0.44 0.00 -1.16 0.00 0.00 179.01 178.23 1yho h ALA 124 N 1.38 0.95 0.00 3.43 0.00 -0.96 -2.91 119.26 121.15 1yho h ALA 124 Ca 0.30 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1yho h ALA 124 Cb -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1yho h ALA 124 CO -0.05 0.55 0.00 -1.33 0.00 0.00 0.00 179.25 178.42 1yho n MET 125 N -3.55 0.18 -0.55 0.00 2.81 0.95 -1.81 117.12 115.15 1yho n MET 125 Ca -0.00 0.53 0.04 0.00 -1.81 0.00 0.00 57.70 56.46 1yho n MET 125 Cb 0.55 -1.93 0.25 0.00 -0.71 0.00 0.00 33.22 31.39 1yho n MET 125 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1yho n ASN 126 N -2.28 3.91 -4.55 7.83 4.13 -1.10 -4.86 115.26 118.34 1yho n ASN 126 Ca 0.00 -2.56 -0.42 0.00 1.68 0.00 0.00 54.58 53.28 1yho n ASN 126 Cb 0.14 -0.61 -0.06 0.00 -1.54 0.00 0.00 39.78 37.72 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 -2.07 3.09 0.13 3.10 3.76 -0.75 -4.94 115.29 117.61 1yho s HIS 127 Ca 0.34 0.20 -0.07 0.00 -0.15 0.00 0.00 55.06 55.38 1yho s HIS 127 Cb 0.26 -3.33 -0.07 0.00 1.11 0.00 0.00 32.58 30.55 1yho s HIS 127 CO 0.10 -0.78 1.35 -1.00 -0.85 0.00 0.00 174.74 173.56 1yho h PRO 128 N 8.69 0.59 -6.98 8.40 0.13 -1.90 -3.46 132.00 137.47 1yho h PRO 128 Ca -0.26 -0.51 -0.39 0.00 -0.87 0.00 0.00 66.00 63.98 1yho h PRO 128 Cb 1.10 0.11 0.22 0.00 0.13 0.00 0.00 31.00 32.56 1yho h PRO 128 CO 0.88 1.13 -0.14 0.41 -0.23 0.00 0.00 178.00 180.06 1yho n GLY 129 N 0.70 -3.35 3.71 1.56 0.00 -1.26 -4.21 105.19 102.34 1yho n GLY 129 Ca -0.06 -1.54 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 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 -2.20 2.57 -0.04 1.61 3.76 -1.26 -4.80 115.29 114.93 1yho s HIS 130 Ca 0.68 0.19 -0.07 0.00 -0.15 0.00 0.00 55.06 55.71 1yho s HIS 130 Cb -0.17 -4.15 0.01 0.00 1.11 0.00 0.00 32.58 29.39 1yho s HIS 130 CO 0.60 -4.52 0.16 -1.17 -0.85 0.00 0.00 174.74 168.96 1yho s LEU 131 N 1.88 1.41 -0.10 0.89 0.20 -1.26 -4.17 118.68 117.54 1yho s LEU 131 Ca 0.77 0.15 -0.05 0.00 0.69 0.00 0.00 54.13 55.69 1yho s LEU 131 Cb -0.48 0.63 -0.04 0.00 -0.43 0.00 0.00 46.19 45.87 1yho s LEU 131 CO 0.34 -0.17 0.12 -0.75 -0.29 0.00 0.00 176.35 175.60 1yho s LYS 132 N -0.43 3.36 -0.19 1.98 2.20 -0.10 -1.91 119.74 124.66 1yho s LYS 132 Ca -0.05 -0.21 -0.04 0.00 -0.36 0.00 0.00 55.97 55.31 1yho s LYS 132 Cb -0.03 -3.11 0.06 0.00 -1.51 0.00 0.00 37.83 33.24 1yho s LYS 132 CO 0.01 0.75 0.08 -1.17 -0.36 0.00 0.00 175.35 174.66 1yho s LEU 133 N -1.15 0.60 -0.27 5.43 0.20 0.55 0.10 118.68 124.14 1yho s LEU 133 Ca 0.17 -0.72 -0.07 0.00 0.69 0.00 0.00 54.13 54.19 1yho s LEU 133 Cb -0.12 -0.35 -0.01 0.00 -0.43 0.00 0.00 46.19 45.28 1yho s LEU 133 CO 0.06 -0.35 0.08 -0.36 -0.29 0.00 0.00 176.35 175.49 1yho s PHE 134 N 2.06 3.11 -0.10 5.38 0.40 0.14 0.11 117.98 129.07 1yho s PHE 134 Ca 0.02 -0.71 0.01 0.00 -0.60 0.00 0.00 56.93 55.65 1yho s PHE 134 Cb -0.16 -2.25 -0.02 0.00 0.51 0.00 0.00 43.02 41.10 1yho s PHE 134 CO -0.11 -0.48 -0.14 0.14 0.70 0.00 0.00 175.22 175.33 1yho s VAL 135 N 1.56 2.97 -0.24 -0.44 -7.23 -0.43 -0.51 120.40 116.09 1yho s VAL 135 Ca 0.05 -0.71 -0.06 0.00 -1.81 0.00 0.00 61.98 59.45 1yho s VAL 135 Cb -0.16 -2.21 -0.02 0.00 0.56 0.00 0.00 36.38 34.55 1yho s VAL 135 CO 0.03 0.55 0.02 -0.89 -0.31 0.00 0.00 175.10 174.50 1yho s THR 136 N 0.00 3.88 -0.14 5.32 2.01 -0.84 -0.25 115.64 125.63 1yho s THR 136 Ca -0.04 -0.33 -0.16 0.00 0.31 0.00 0.00 61.69 61.46 1yho s THR 136 Cb -0.14 -2.80 -0.04 0.00 0.01 0.00 0.00 72.50 69.52 1yho s THR 136 CO 0.04 0.37 0.39 -0.13 -0.69 0.00 0.00 174.62 174.60 1yho s ARG 137 N 1.55 4.30 -0.31 4.92 3.00 -0.25 0.92 118.95 133.08 1yho s ARG 137 Ca 0.06 0.29 -0.09 0.00 0.00 0.00 0.00 55.73 55.99 1yho s ARG 137 Cb -0.15 -3.43 -0.00 0.00 0.00 0.00 0.00 34.95 31.37 1yho s ARG 137 CO 0.00 0.20 0.13 0.42 0.00 0.00 0.00 175.30 176.06 1yho s ILE 138 N 0.54 4.41 -1.31 1.52 -1.09 0.27 0.37 121.20 125.91 1yho s ILE 138 Ca 0.22 -0.52 -0.17 0.00 -2.23 0.00 0.00 60.65 57.95 1yho s ILE 138 Cb -0.14 -3.27 0.04 0.00 -1.58 0.00 0.00 42.46 37.51 1yho s ILE 138 CO 0.07 0.06 1.90 0.23 -1.23 0.00 0.00 174.94 175.98 1yho n MET 139 N 4.95 2.89 -3.40 2.79 2.81 -0.19 -1.28 117.12 125.69 1yho n MET 139 Ca -0.14 -2.95 0.02 0.00 -1.81 0.00 0.00 57.70 52.82 1yho n MET 139 Cb 0.49 -3.43 -0.05 0.00 -0.71 0.00 0.00 33.22 29.51 1yho n MET 139 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 1yho s GLN 140 N 4.16 0.11 0.29 0.03 0.74 -1.26 -4.40 119.66 119.33 1yho s GLN 140 Ca 0.53 0.24 -0.29 0.00 0.05 0.00 0.00 55.36 55.89 1yho s GLN 140 Cb 0.07 0.10 -0.10 0.00 1.10 0.00 0.00 33.01 34.18 1yho s GLN 140 CO 0.04 -0.03 1.41 -0.51 -0.55 0.00 0.00 175.29 175.65 1yho s ASP 141 N 1.75 6.65 0.12 6.67 1.11 -1.26 -4.41 116.67 127.30 1yho s ASP 141 Ca -0.03 2.72 -0.14 0.00 0.18 0.00 0.00 52.55 55.27 1yho s ASP 141 Cb -0.02 -2.64 0.03 0.00 1.07 0.00 0.00 42.92 41.36 1yho s ASP 141 CO -0.14 -0.68 0.36 -0.36 1.18 0.00 0.00 175.17 175.53 1yho s PHE 142 N -0.44 -0.11 0.04 4.23 0.08 -1.26 -5.09 117.98 115.43 1yho s PHE 142 Ca 0.56 -0.23 -0.30 0.00 0.12 0.00 0.00 56.93 57.07 1yho s PHE 142 Cb -0.42 0.19 -0.04 0.00 -0.57 0.00 0.00 43.02 42.18 1yho s PHE 142 CO 0.48 -0.68 1.03 -1.21 -0.10 0.00 0.00 175.22 174.74 1yho s GLU 143 N -3.82 4.55 0.04 0.44 2.02 -1.26 -4.94 118.70 115.72 1yho s GLU 143 Ca 0.04 1.52 -0.05 0.00 0.02 0.00 0.00 54.97 56.50 1yho s GLU 143 Cb 0.02 -3.41 -0.01 0.00 0.10 0.00 0.00 34.13 30.82 1yho s GLU 143 CO -0.11 -0.06 0.08 -1.54 0.02 0.00 0.00 175.26 173.65 1yho s SER 144 N 0.85 0.21 -0.07 -0.19 1.04 -1.26 -4.65 113.70 109.62 1yho s SER 144 Ca 0.53 -0.57 0.02 0.00 0.48 0.00 0.00 55.95 56.41 1yho s SER 144 Cb -0.24 0.22 -0.06 0.00 0.10 0.00 0.00 66.02 66.04 1yho s SER 144 CO 0.29 -0.51 -0.04 -0.67 0.98 0.00 0.00 173.24 173.29 1yho n ASP 145 N 0.76 3.45 -4.74 7.02 2.03 -1.24 -4.99 116.55 118.85 1yho n ASP 145 Ca -0.19 -0.03 -0.35 0.00 0.52 0.00 0.00 54.79 54.74 1yho n ASP 145 Cb 0.58 0.11 -0.08 0.00 -0.72 0.00 0.00 41.12 41.02 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 -2.15 5.16 0.08 5.18 2.01 -1.23 -5.09 115.64 119.61 1yho s THR 146 Ca -0.08 0.09 0.01 0.00 0.31 0.00 0.00 61.69 62.02 1yho s THR 146 Cb 0.02 -3.31 -0.04 0.00 0.01 0.00 0.00 72.50 69.19 1yho s THR 146 CO 0.19 0.51 0.20 -0.36 -0.69 0.00 0.00 174.62 174.47 1yho s PHE 147 N -0.10 3.46 -0.15 4.92 0.08 -1.26 -2.78 117.98 122.16 1yho s PHE 147 Ca 0.09 0.20 -0.22 0.00 0.12 0.00 0.00 56.93 57.11 1yho s PHE 147 Cb -0.12 -1.72 -0.03 0.00 -0.57 0.00 0.00 43.02 40.58 1yho s PHE 147 CO 0.00 0.57 0.69 0.12 -0.10 0.00 0.00 175.22 176.50 1yho s PHE 148 N -1.53 3.46 0.63 0.36 5.36 0.46 -4.92 117.98 121.79 1yho s PHE 148 Ca 0.34 1.10 -0.18 0.00 -0.96 0.00 0.00 56.93 57.23 1yho s PHE 148 Cb -0.13 -2.84 -0.04 0.00 -0.34 0.00 0.00 43.02 39.67 1yho s PHE 148 CO 0.27 -0.09 0.85 -2.30 -1.46 0.00 0.00 175.22 172.50 1yho n PRO 149 N 4.62 0.70 -2.46 10.12 -0.02 -1.26 -4.93 135.00 141.77 1yho n PRO 149 Ca -0.00 0.28 -0.41 0.00 -2.02 0.00 0.00 63.50 61.35 1yho n PRO 149 Cb 0.50 -2.07 -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 -2.00 1.98 0.00 0.00 175.50 175.48 1yho s GLU 150 N -2.75 4.59 0.01 -0.52 2.12 -1.26 -5.03 118.70 115.86 1yho s GLU 150 Ca 0.74 1.80 -0.16 0.00 0.36 0.00 0.00 54.97 57.71 1yho s GLU 150 Cb -0.40 -3.22 -0.06 0.00 0.26 0.00 0.00 34.13 30.71 1yho s GLU 150 CO 0.49 0.10 0.45 0.42 -0.54 0.00 0.00 175.26 176.18 1yho s ILE 151 N -0.67 4.97 -0.36 -3.70 1.01 -1.26 -5.05 121.20 116.14 1yho s ILE 151 Ca 0.48 0.93 -0.25 0.00 0.00 0.00 0.00 60.65 61.81 1yho s ILE 151 Cb -0.31 -3.76 0.01 0.00 0.01 0.00 0.00 42.46 38.41 1yho s ILE 151 CO 0.39 0.56 0.88 -1.81 0.00 0.00 0.00 174.94 174.96 1yho s ASP 152 N -1.00 6.66 0.46 3.58 1.01 -1.26 -4.91 116.67 121.20 1yho s ASP 152 Ca 0.25 0.55 0.19 0.00 0.71 0.00 0.00 52.55 54.25 1yho s ASP 152 Cb -0.17 -2.44 1.10 0.00 1.01 0.00 0.00 42.92 42.41 1yho s ASP 152 CO 0.15 -0.80 1.98 -0.07 0.21 0.00 0.00 175.17 176.63 1yho h LEU 153 N 9.93 0.00 -1.42 1.23 3.38 -1.97 0.83 115.31 127.28 1yho h LEU 153 Ca -0.24 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.67 1yho h LEU 153 Cb 1.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 1yho h LEU 153 CO 0.96 0.20 -0.29 -0.08 0.09 0.00 0.00 178.44 179.32 1yho h GLU 154 N 0.00 0.00 0.00 1.13 4.81 -2.02 -3.21 114.58 115.30 1yho h GLU 154 Ca -0.00 -0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 58.94 1yho h GLU 154 Cb 0.42 -0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.74 1yho h GLU 154 CO 0.03 0.29 -2.07 1.63 -0.73 0.00 0.00 179.01 178.16 1yho n LYS 155 N -4.20 1.34 -4.02 1.92 5.02 -0.85 -4.97 118.16 112.40 1yho n LYS 155 Ca -0.02 0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 55.96 1yho n LYS 155 Cb 0.33 -1.40 -0.06 0.00 -0.02 0.00 0.00 35.03 33.89 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 -2.38 3.33 -0.16 2.13 2.02 0.28 -2.22 117.35 120.36 1yho s TYR 156 Ca -0.10 0.19 -0.02 0.00 -0.37 0.00 0.00 57.07 56.77 1yho s TYR 156 Cb 0.05 -1.71 -0.02 0.00 -0.40 0.00 0.00 41.96 39.88 1yho s TYR 156 CO 0.61 0.56 -0.07 0.21 -1.57 0.00 0.00 175.55 175.29 1yho s LYS 157 N -2.12 3.50 -0.36 -0.62 2.20 0.12 -4.32 119.74 118.14 1yho s LYS 157 Ca 0.28 -0.61 -0.29 0.00 -0.36 0.00 0.00 55.97 54.99 1yho s LYS 157 Cb -0.12 -2.82 0.02 0.00 -1.51 0.00 0.00 37.83 33.39 1yho s LYS 157 CO 0.20 0.14 1.17 -1.17 -0.36 0.00 0.00 175.35 175.33 1yho s LEU 158 N 0.58 3.82 -0.55 5.43 0.20 -1.26 -2.04 118.68 124.86 1yho s LEU 158 Ca -0.05 0.93 0.01 0.00 0.69 0.00 0.00 54.13 55.71 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 -1.06 0.32 -0.76 -0.29 0.00 0.00 176.35 174.58 1yho s LEU 159 N 4.16 4.69 0.08 -0.68 1.43 0.25 -4.99 118.68 123.62 1yho s LEU 159 Ca 0.50 -2.91 -0.29 0.00 -1.03 0.00 0.00 54.13 50.39 1yho s LEU 159 Cb -0.12 -1.72 -0.13 0.00 0.03 0.00 0.00 46.19 44.25 1yho s LEU 159 CO 0.23 -0.29 1.46 -0.65 0.23 0.00 0.00 176.35 177.33 1yho h PRO 160 N 6.76 -0.68 -4.98 1.29 0.11 -1.92 -1.46 132.00 131.10 1yho h PRO 160 Ca -0.05 0.05 -0.66 0.00 0.11 0.00 0.00 66.00 65.45 1yho h PRO 160 Cb 0.92 0.16 -0.27 0.00 0.11 0.00 0.00 31.00 31.92 1yho h PRO 160 CO 0.69 -0.46 -0.71 -2.00 -0.21 0.00 0.00 178.00 175.32 1yho s GLU 161 N -5.32 3.41 0.02 1.05 2.12 -1.26 -4.37 118.70 114.34 1yho s GLU 161 Ca -0.14 -0.61 0.07 0.00 0.36 0.00 0.00 54.97 54.65 1yho s GLU 161 Cb 0.04 -3.06 -0.02 0.00 0.26 0.00 0.00 34.13 31.35 1yho s GLU 161 CO 0.50 -0.20 -0.21 -0.47 -0.54 0.00 0.00 175.26 174.34 1yho s TYR 162 N 1.50 1.88 0.24 5.30 6.14 -1.26 -5.07 117.35 126.08 1yho s TYR 162 Ca 0.06 -0.37 -0.31 0.00 0.64 0.00 0.00 57.07 57.09 1yho s TYR 162 Cb -0.14 -1.16 -0.13 0.00 0.42 0.00 0.00 41.96 40.94 1yho s TYR 162 CO -0.02 0.04 1.39 -2.30 0.64 0.00 0.00 175.55 175.30 1yho n PRO 163 N 2.18 2.01 0.00 4.97 -0.02 -1.26 -1.98 135.00 140.89 1yho n PRO 163 Ca -0.16 0.71 0.00 0.00 -2.02 0.00 0.00 63.50 62.03 1yho n PRO 163 Cb 0.53 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 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 2.08 2.73 3.88 -1.23 0.00 -1.26 -5.01 105.19 106.38 1yho n GLY 164 Ca 0.11 -0.42 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.36 5.46 0.25 1.61 0.11 -0.84 -5.08 120.40 120.55 1yho s VAL 165 Ca 0.00 0.11 -0.30 0.00 -2.93 0.00 0.00 61.98 58.86 1yho s VAL 165 Cb 0.00 -3.42 -0.09 0.00 -1.53 0.00 0.00 36.38 31.34 1yho s VAL 165 CO 0.00 0.55 1.14 -0.76 -3.33 0.00 0.00 175.10 172.70 1yho s LEU 166 N -1.24 4.51 -0.19 2.54 1.43 -1.26 -4.42 118.68 120.05 1yho s LEU 166 Ca 0.18 2.28 0.16 0.00 -1.03 0.00 0.00 54.13 55.72 1yho s LEU 166 Cb -0.12 -3.62 -0.23 0.00 0.03 0.00 0.00 46.19 42.24 1yho s LEU 166 CO 0.07 -0.24 0.05 -1.54 0.23 0.00 0.00 176.35 174.93 1yho n SER 167 N 1.59 0.36 -4.77 2.29 3.41 -1.26 -4.44 113.62 110.80 1yho n SER 167 Ca 0.01 -0.01 -0.40 0.00 -0.26 0.00 0.00 58.87 58.21 1yho n SER 167 Cb 0.45 0.90 -0.01 0.00 -0.26 0.00 0.00 64.21 65.29 1yho n SER 167 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1yho s ASP 168 N -5.41 6.44 -0.00 4.04 -1.08 -1.26 -4.64 116.67 114.76 1yho s ASP 168 Ca -0.11 2.74 -0.30 0.00 -0.52 0.00 0.00 52.55 54.36 1yho s ASP 168 Cb 0.06 -2.65 -0.07 0.00 -1.46 0.00 0.00 42.92 38.80 1yho s ASP 168 CO 0.77 -0.77 1.72 -0.69 0.52 0.00 0.00 175.17 176.73 1yho s VAL 169 N -1.20 3.33 0.58 1.11 1.01 -1.26 -4.80 120.40 119.18 1yho s VAL 169 Ca 0.54 0.51 -0.05 0.00 0.00 0.00 0.00 61.98 62.97 1yho s VAL 169 Cb -0.40 -3.33 0.01 0.00 0.00 0.00 0.00 36.38 32.67 1yho s VAL 169 CO 0.53 -0.03 0.88 -1.10 0.00 0.00 0.00 175.10 175.37 1yho s GLN 170 N 3.80 2.85 -0.13 2.72 -1.52 -0.64 -4.90 119.66 121.84 1yho s GLN 170 Ca 0.77 -0.11 -0.06 0.00 -1.95 0.00 0.00 55.36 54.01 1yho s GLN 170 Cb -0.37 -2.30 0.06 0.00 -0.22 0.00 0.00 33.01 30.18 1yho s GLN 170 CO 0.33 -0.70 0.29 -2.00 -0.25 0.00 0.00 175.29 172.95 1yho s GLU 171 N -4.96 0.21 -0.06 2.91 2.12 -1.26 -2.01 118.70 115.66 1yho s GLU 171 Ca 0.54 0.72 -0.02 0.00 0.36 0.00 0.00 54.97 56.56 1yho s GLU 171 Cb -0.10 -0.02 0.04 0.00 0.26 0.00 0.00 34.13 34.30 1yho s GLU 171 CO 0.44 -0.23 0.11 -2.00 -0.54 0.00 0.00 175.26 173.04 1yho s GLU 172 N 1.99 0.03 -1.77 4.30 2.12 -0.43 -4.84 118.70 120.09 1yho s GLU 172 Ca -0.03 0.37 0.00 0.00 0.36 0.00 0.00 54.97 55.67 1yho s GLU 172 Cb -0.11 -0.26 0.00 0.00 0.26 0.00 0.00 34.13 34.02 1yho s GLU 172 CO -0.09 -0.22 0.00 1.63 -0.54 0.00 0.00 175.26 176.04 1yho n LYS 173 N 4.57 -1.70 -1.00 4.30 4.76 -1.26 -1.05 118.16 126.78 1yho n LYS 173 Ca -0.20 1.01 -0.00 0.00 -2.87 0.00 0.00 58.31 56.25 1yho n LYS 173 Cb 0.51 -5.67 -0.00 0.00 -1.84 0.00 0.00 35.03 28.03 1yho n LYS 173 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1yho n GLY 174 N -1.00 0.42 3.19 0.72 0.00 -1.26 -5.03 105.19 102.23 1yho n GLY 174 Ca -0.24 -0.84 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 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 2.73 -0.15 -0.61 1.01 -0.21 -5.10 121.20 116.86 1yho s ILE 175 Ca 0.00 -1.00 -0.11 0.00 0.00 0.00 0.00 60.65 59.54 1yho s ILE 175 Cb 0.00 -2.35 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 1yho s ILE 175 CO 0.00 0.27 0.21 -1.59 0.00 0.00 0.00 174.94 173.82 1yho s LYS 176 N 1.32 4.00 0.05 2.79 -2.85 -1.26 -1.31 119.74 122.48 1yho s LYS 176 Ca 0.01 -0.05 -0.08 0.00 -1.00 0.00 0.00 55.97 54.85 1yho s LYS 176 Cb -0.16 -3.35 -0.00 0.00 -2.06 0.00 0.00 37.83 32.26 1yho s LYS 176 CO -0.06 0.43 0.17 1.52 0.10 0.00 0.00 175.35 177.51 1yho s TYR 177 N -0.07 0.12 0.29 1.78 1.13 -0.85 -1.02 117.35 118.73 1yho s TYR 177 Ca 0.14 -0.43 0.10 0.00 -1.41 0.00 0.00 57.07 55.47 1yho s TYR 177 Cb -0.12 -0.07 -0.05 0.00 -1.10 0.00 0.00 41.96 40.62 1yho s TYR 177 CO 0.03 -0.45 -0.08 0.15 -2.51 0.00 0.00 175.55 172.68 1yho s LYS 178 N -2.99 1.97 -0.22 -3.49 1.02 0.16 -1.62 119.74 114.57 1yho s LYS 178 Ca -0.02 -1.67 -0.01 0.00 0.02 0.00 0.00 55.97 54.29 1yho s LYS 178 Cb 0.01 -1.92 0.01 0.00 -0.52 0.00 0.00 37.83 35.41 1yho s LYS 178 CO -0.06 0.28 -0.10 -0.06 -0.92 0.00 0.00 175.35 174.49 1yho s PHE 179 N -2.46 2.94 0.05 3.18 0.40 -1.26 -1.09 117.98 119.73 1yho s PHE 179 Ca 0.32 -1.38 0.04 0.00 -0.60 0.00 0.00 56.93 55.31 1yho s PHE 179 Cb -0.04 -2.03 -0.04 0.00 0.51 0.00 0.00 43.02 41.43 1yho s PHE 179 CO 0.18 -0.69 -0.04 -1.21 0.70 0.00 0.00 175.22 174.15 1yho s GLU 180 N 1.36 2.50 -0.06 0.44 2.02 0.66 -4.81 118.70 120.82 1yho s GLU 180 Ca 0.04 -0.80 0.05 0.00 0.02 0.00 0.00 54.97 54.28 1yho s GLU 180 Cb -0.15 -2.50 -0.01 0.00 0.10 0.00 0.00 34.13 31.58 1yho s GLU 180 CO -0.07 0.57 -0.23 0.08 0.02 0.00 0.00 175.26 175.63 1yho s VAL 181 N -1.14 1.89 -0.05 2.63 1.01 -0.55 -1.31 120.40 122.88 1yho s VAL 181 Ca 0.21 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.25 1yho s VAL 181 Cb -0.11 -1.61 0.01 0.00 0.00 0.00 0.00 36.38 34.66 1yho s VAL 181 CO 0.12 0.53 -0.13 -0.31 0.00 0.00 0.00 175.10 175.31 1yho s TYR 182 N -0.06 1.40 0.08 5.22 1.51 0.29 0.84 117.35 126.63 1yho s TYR 182 Ca -0.05 -0.44 0.09 0.00 -1.01 0.00 0.00 57.07 55.66 1yho s TYR 182 Cb -0.14 -0.99 -0.03 0.00 -0.11 0.00 0.00 41.96 40.69 1yho s TYR 182 CO 0.04 -0.19 -0.24 -2.00 -1.11 0.00 0.00 175.55 172.05 1yho s GLU 183 N 0.34 1.74 -0.18 -0.62 2.12 -0.86 -0.33 118.70 120.90 1yho s GLU 183 Ca -0.08 -1.16 -0.09 0.00 0.36 0.00 0.00 54.97 54.00 1yho s GLU 183 Cb -0.12 -2.02 -0.05 0.00 0.26 0.00 0.00 34.13 32.20 1yho s GLU 183 CO 0.02 0.50 0.12 0.15 -0.54 0.00 0.00 175.26 175.51 1yho s LYS 184 N -1.64 4.02 -0.17 4.30 1.02 -0.80 0.13 119.74 126.59 1yho s LYS 184 Ca 0.14 -0.22 -0.02 0.00 0.02 0.00 0.00 55.97 55.88 1yho s LYS 184 Cb -0.10 -3.35 -0.01 0.00 -0.52 0.00 0.00 37.83 33.85 1yho s LYS 184 CO 0.05 0.38 -0.08 -0.80 -0.92 0.00 0.00 175.35 173.98 1yho s ASN 185 N 0.11 4.26 0.00 2.83 0.01 -0.94 -4.22 114.94 116.99 1yho s ASN 185 Ca 0.09 -0.32 0.01 0.00 -0.71 0.00 0.00 52.86 51.92 1yho s ASN 185 Cb -0.11 -1.69 0.04 0.00 0.41 0.00 0.00 41.25 39.89 1yho s ASN 185 CO -0.01 0.09 0.53 0.47 -1.51 0.00 0.00 177.10 176.68