#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 1.22 3.31 2.92 0.00 -1.26 -5.07 105.19 106.30 1yho n GLY 2 Ca 0.00 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.35 5.41 -0.20 1.61 0.01 -1.26 -4.88 113.70 112.04 1yho s SER 3 Ca 0.00 -1.07 -0.03 0.00 1.31 0.00 0.00 55.95 56.16 1yho s SER 3 Cb 0.00 -1.91 -0.01 0.00 0.21 0.00 0.00 66.02 64.31 1yho s SER 3 CO 0.00 -0.33 -0.06 -0.76 0.41 0.00 0.00 173.24 172.50 1yho s LEU 4 N 1.45 2.86 -0.14 2.44 1.02 -1.26 -2.17 118.68 122.88 1yho s LEU 4 Ca -0.00 -0.38 0.01 0.00 0.02 0.00 0.00 54.13 53.77 1yho s LEU 4 Cb -0.19 -1.71 0.02 0.00 0.02 0.00 0.00 46.19 44.32 1yho s LEU 4 CO 0.04 0.01 -0.15 0.20 0.02 0.00 0.00 176.35 176.47 1yho s ASN 5 N 1.27 2.66 -0.07 2.29 0.01 -0.77 -1.85 114.94 118.48 1yho s ASN 5 Ca 0.03 -0.48 0.02 0.00 -0.71 0.00 0.00 52.86 51.72 1yho s ASN 5 Cb -0.14 -1.18 -0.03 0.00 0.41 0.00 0.00 41.25 40.31 1yho s ASN 5 CO -0.02 -0.03 -0.12 0.00 -1.51 0.00 0.00 177.10 175.42 1yho s ILE 7 N -0.57 -0.40 0.03 0.00 2.07 -0.91 0.92 121.20 122.34 1yho s ILE 7 Ca 0.08 0.22 -0.08 0.00 -1.41 0.00 0.00 60.65 59.46 1yho s ILE 7 Cb -0.12 -0.48 0.00 0.00 0.13 0.00 0.00 42.46 42.00 1yho s ILE 7 CO 0.02 0.07 0.16 0.68 -1.91 0.00 0.00 174.94 173.96 1yho s VAL 8 N 2.41 0.11 0.22 4.00 -7.23 0.24 -4.54 120.40 115.61 1yho s VAL 8 Ca 0.03 -0.88 -0.01 0.00 -1.81 0.00 0.00 61.98 59.31 1yho s VAL 8 Cb -0.13 -0.79 -0.04 0.00 0.56 0.00 0.00 36.38 35.98 1yho s VAL 8 CO -0.09 -0.49 0.42 0.00 -0.31 0.00 0.00 175.10 174.63 1yho s ALA 9 N -2.28 3.80 0.03 1.32 0.00 -1.26 -2.04 121.76 121.34 1yho s ALA 9 Ca -0.07 -0.82 -0.08 0.00 0.00 0.00 0.00 51.96 50.99 1yho s ALA 9 Cb -0.03 -2.03 -0.00 0.00 0.00 0.00 0.00 23.12 21.06 1yho s ALA 9 CO -0.03 0.37 0.15 0.14 0.00 0.00 0.00 175.76 176.40 1yho s VAL 10 N -1.93 0.11 0.58 0.00 -7.23 0.21 -4.71 120.40 107.44 1yho s VAL 10 Ca 0.39 -0.94 -0.01 0.00 -1.81 0.00 0.00 61.98 59.61 1yho s VAL 10 Cb -0.11 -0.84 0.04 0.00 0.56 0.00 0.00 36.38 36.03 1yho s VAL 10 CO 0.30 -0.52 0.83 -0.55 -0.31 0.00 0.00 175.10 174.85 1yho s SER 11 N -2.00 5.20 0.61 4.85 0.15 0.75 -0.83 113.70 122.42 1yho s SER 11 Ca -0.06 0.13 0.35 0.00 0.70 0.00 0.00 55.95 57.07 1yho s SER 11 Cb -0.02 -0.98 2.02 0.00 -1.71 0.00 0.00 66.02 65.33 1yho s SER 11 CO -0.03 -1.23 2.29 -0.61 1.20 0.00 0.00 173.24 174.86 1yho h GLN 12 N -0.08 0.00 -0.78 5.44 4.15 -0.06 -0.30 115.11 123.48 1yho h GLN 12 Ca -0.43 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 58.86 1yho h GLN 12 Cb 1.30 0.00 -0.08 0.00 0.21 0.00 0.00 27.48 28.91 1yho h GLN 12 CO 0.55 0.00 0.16 0.09 -1.93 0.00 0.00 178.83 177.70 1yho n ASN 13 N -3.58 4.33 -2.43 -0.69 4.13 -1.26 -4.87 115.26 110.89 1yho n ASN 13 Ca -0.03 -2.89 -0.20 0.00 1.68 0.00 0.00 54.58 53.14 1yho n ASN 13 Cb 0.08 -0.68 0.00 0.00 -1.54 0.00 0.00 39.78 37.64 1yho n ASN 13 CO 0.00 0.00 0.00 0.80 0.28 0.00 0.00 177.26 178.34 1yho n MET 14 N 0.09 -2.29 -3.72 3.52 1.56 -0.12 -4.89 117.12 111.26 1yho n MET 14 Ca 0.29 0.96 -0.32 0.00 -0.27 0.00 0.00 57.70 58.36 1yho n MET 14 Cb 1.12 -5.61 -0.05 0.00 2.15 0.00 0.00 33.22 30.83 1yho n MET 14 CO 0.00 0.00 0.00 0.20 -0.73 0.00 0.00 175.97 175.44 1yho s GLY 15 N -2.23 2.23 -0.08 -5.12 0.00 -1.24 -1.03 107.32 99.86 1yho s GLY 15 Ca 0.06 -0.61 -0.00 0.00 0.00 0.00 0.00 44.72 44.17 1yho s GLY 15 CO 0.08 -0.54 -0.07 0.29 0.00 0.00 0.00 173.10 172.86 1yho n ILE 16 N 0.21 0.43 0.00 0.90 -5.35 -1.08 -0.18 119.36 114.29 1yho n ILE 16 Ca -0.04 -0.16 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 1yho n ILE 16 Cb 0.52 -0.87 0.00 0.00 -1.74 0.00 0.00 39.64 37.55 1yho n ILE 16 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1yho n GLY 17 N 3.06 1.99 3.00 3.28 0.00 -1.26 -4.24 105.19 111.01 1yho n GLY 17 Ca -0.13 -0.78 -0.23 0.00 0.00 0.00 0.00 46.02 44.88 1yho n GLY 17 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1yho s LYS 18 N -2.00 1.44 -1.56 1.61 -2.85 0.11 -3.54 119.74 112.96 1yho s LYS 18 Ca 0.00 -0.34 -0.01 0.00 -1.00 0.00 0.00 55.97 54.62 1yho s LYS 18 Cb 0.00 -1.23 0.00 0.00 -2.06 0.00 0.00 37.83 34.54 1yho s LYS 18 CO 0.00 0.02 0.09 -1.71 0.10 0.00 0.00 175.35 173.85 1yho n ASN 19 N 3.79 -5.43 -0.34 0.03 2.85 -1.26 -1.63 115.26 113.27 1yho n ASN 19 Ca -0.23 -0.06 -0.04 0.00 -0.11 0.00 0.00 54.58 54.14 1yho n ASN 19 Cb 0.52 -4.45 -0.02 0.00 1.24 0.00 0.00 39.78 37.07 1yho n ASN 19 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1yho n GLY 20 N -1.09 0.65 3.10 8.20 0.00 -1.26 -5.03 105.19 109.76 1yho n GLY 20 Ca -0.20 -0.86 -0.22 0.00 0.00 0.00 0.00 46.02 44.74 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 1.59 0.46 1.61 1.01 -0.65 -4.94 116.67 112.81 1yho s ASP 21 Ca 0.00 -0.27 -0.24 0.00 0.71 0.00 0.00 52.55 52.75 1yho s ASP 21 Cb 0.00 -0.17 -0.07 0.00 1.01 0.00 0.00 42.92 43.69 1yho s ASP 21 CO 0.00 0.15 1.26 -0.76 0.21 0.00 0.00 175.17 176.02 1yho s LEU 22 N -0.42 4.06 0.41 1.23 1.43 -1.26 0.07 118.68 124.20 1yho s LEU 22 Ca 0.05 2.53 0.13 0.00 -1.03 0.00 0.00 54.13 55.81 1yho s LEU 22 Cb -0.05 -4.12 0.97 0.00 0.03 0.00 0.00 46.19 43.01 1yho s LEU 22 CO -0.00 -1.02 1.93 -0.65 0.23 0.00 0.00 176.35 176.84 1yho h PRO 23 N 2.17 0.49 -6.14 1.29 0.11 -1.85 -3.42 132.00 124.65 1yho h PRO 23 Ca -0.50 -0.03 -0.57 0.00 0.11 0.00 0.00 66.00 65.01 1yho h PRO 23 Cb 1.26 -0.11 -0.06 0.00 0.11 0.00 0.00 31.00 32.20 1yho h PRO 23 CO 0.60 0.32 -0.54 1.67 -0.21 0.00 0.00 178.00 179.85 1yho s TRP 24 N -5.48 3.26 1.22 0.65 -2.14 -1.26 -4.82 118.94 110.37 1yho s TRP 24 Ca -0.08 0.04 -0.16 0.00 2.66 0.00 0.00 56.10 58.56 1yho s TRP 24 Cb 0.21 -1.58 0.30 0.00 -3.10 0.00 0.00 33.47 29.30 1yho s TRP 24 CO 0.77 0.52 1.02 -1.25 -2.66 0.00 0.00 176.95 175.34 1yho s PRO 25 N -3.04 -1.33 0.01 3.25 0.04 -1.26 -4.89 135.00 127.78 1yho s PRO 25 Ca 0.32 0.51 -0.30 0.00 0.04 0.00 0.00 61.00 61.57 1yho s PRO 25 Cb -0.11 -1.53 -0.08 0.00 0.04 0.00 0.00 34.50 32.82 1yho s PRO 25 CO 0.25 -3.91 1.93 -1.25 0.04 0.00 0.00 177.00 174.06 1yho s PRO 26 N -4.77 4.09 -0.15 0.56 0.04 -1.26 -4.98 135.00 128.54 1yho s PRO 26 Ca 0.68 2.51 -0.06 0.00 0.04 0.00 0.00 61.00 64.17 1yho s PRO 26 Cb -0.20 -4.15 -0.04 0.00 0.04 0.00 0.00 34.50 30.16 1yho s PRO 26 CO 0.61 -1.00 0.06 -1.17 0.04 0.00 0.00 177.00 175.54 1yho s LEU 27 N 4.61 3.85 0.11 -3.56 2.96 -1.26 -5.00 118.68 120.38 1yho s LEU 27 Ca 0.87 0.16 -0.09 0.00 -0.22 0.00 0.00 54.13 54.84 1yho s LEU 27 Cb -0.41 -1.94 -0.13 0.00 0.50 0.00 0.00 46.19 44.21 1yho s LEU 27 CO 0.39 0.27 1.29 -0.09 -1.32 0.00 0.00 176.35 176.89 1yho h ARG 28 N 6.01 0.62 -0.07 1.98 9.65 -1.97 -1.35 114.38 129.26 1yho h ARG 28 Ca -0.43 -0.59 -0.16 0.00 -1.10 0.00 0.00 59.98 57.70 1yho h ARG 28 Cb 1.18 0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 29.90 1yho h ARG 28 CO 0.64 1.20 -0.67 -0.97 2.80 0.00 0.00 179.97 182.97 1yho h ASN 29 N 0.39 0.33 -0.01 -3.80 -1.24 -1.98 -1.19 115.58 108.08 1yho h ASN 29 Ca -0.08 -0.21 -0.17 0.00 0.71 0.00 0.00 56.30 56.55 1yho h ASN 29 Cb 1.52 -0.10 0.01 0.00 0.73 0.00 0.00 38.32 40.48 1yho h ASN 29 CO 0.17 0.91 -0.66 -0.08 -1.29 0.00 0.00 177.43 176.47 1yho h GLU 30 N 0.20 0.46 -0.26 6.67 4.22 -1.98 -1.26 114.58 122.64 1yho h GLU 30 Ca -0.02 -0.49 -0.06 0.00 0.08 0.00 0.00 59.36 58.88 1yho h GLU 30 Cb 1.21 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.59 1yho h GLU 30 CO 0.11 1.14 -0.07 0.74 -2.18 0.00 0.00 179.01 178.74 1yho h PHE 31 N -0.01 0.56 -0.37 0.92 -1.00 -1.28 0.60 116.94 116.36 1yho h PHE 31 Ca -0.08 -0.12 -0.08 0.00 2.81 0.00 0.00 57.97 60.50 1yho h PHE 31 Cb 1.36 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 40.77 1yho h PHE 31 CO 0.14 0.72 -0.07 -0.09 -1.61 0.00 0.00 178.31 177.40 1yho h ARG 32 N 0.24 0.70 -0.45 1.51 2.43 -1.31 -1.65 114.38 115.84 1yho h ARG 32 Ca 0.06 -0.26 -0.06 0.00 -0.81 0.00 0.00 59.98 58.91 1yho h ARG 32 Cb 0.55 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 1yho h ARG 32 CO 0.03 0.84 0.03 -0.92 -1.51 0.00 0.00 179.97 178.44 1yho h TYR 33 N 0.50 0.83 -0.30 2.20 3.20 -1.21 0.82 116.97 123.01 1yho h TYR 33 Ca 0.10 -0.13 -0.00 0.00 3.14 0.00 0.00 58.73 61.83 1yho h TYR 33 Cb 0.57 -0.22 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 1yho h TYR 33 CO 0.05 0.80 0.17 0.35 -1.64 0.00 0.00 178.16 177.88 1yho h PHE 34 N 0.62 0.41 -0.07 -3.82 3.57 -0.82 -0.04 116.94 116.78 1yho h PHE 34 Ca 0.13 -0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.51 1yho h PHE 34 Cb 0.44 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1yho h PHE 34 CO 0.03 0.33 -0.47 0.37 -2.23 0.00 0.00 178.31 176.34 1yho h GLN 35 N 0.37 0.18 -0.09 1.11 4.15 -1.22 -2.41 115.11 117.20 1yho h GLN 35 Ca 0.11 -0.09 -0.03 0.00 0.77 0.00 0.00 58.65 59.41 1yho h GLN 35 Cb 0.05 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 27.74 1yho h GLN 35 CO -0.02 0.61 -0.05 -0.09 -1.93 0.00 0.00 178.83 177.35 1yho h ARG 36 N 0.14 0.19 0.28 1.69 1.12 -0.46 -1.43 114.38 115.92 1yho h ARG 36 Ca 0.01 -0.09 -0.01 0.00 -1.11 0.00 0.00 59.98 58.78 1yho h ARG 36 Cb 0.89 -0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.85 1yho h ARG 36 CO 0.07 0.57 -0.13 1.98 -3.11 0.00 0.00 179.97 179.35 1yho h MET 37 N -0.19 -0.36 -0.58 0.20 4.05 -0.99 -1.37 114.93 115.69 1yho h MET 37 Ca 0.02 0.02 0.05 0.00 -0.28 0.00 0.00 59.70 59.51 1yho h MET 37 Cb 0.52 0.08 -0.05 0.00 -0.80 0.00 0.00 31.60 31.35 1yho h MET 37 CO 0.01 -0.18 0.31 1.15 0.23 0.00 0.00 176.91 178.44 1yho h THR 38 N -0.46 0.97 -0.09 -0.77 2.02 -1.50 -1.29 112.91 111.79 1yho h THR 38 Ca -0.04 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 66.91 1yho h THR 38 Cb 0.35 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1yho h THR 38 CO 0.06 0.11 -0.05 0.71 0.37 0.00 0.00 175.52 176.72 1yho h THR 39 N 0.60 1.10 -1.14 3.16 1.35 -1.14 -3.39 112.91 113.45 1yho h THR 39 Ca 0.25 -0.40 -0.34 0.00 -0.55 0.00 0.00 66.41 65.37 1yho h THR 39 Cb 0.14 1.08 -0.04 0.00 -1.73 0.00 0.00 68.15 67.61 1yho h THR 39 CO -0.16 0.13 0.92 -0.89 -0.25 0.00 0.00 175.52 175.27 1yho s THR 40 N -4.92 3.34 0.47 6.82 2.01 -0.49 -4.95 115.64 117.93 1yho s THR 40 Ca -0.05 -0.12 -0.18 0.00 0.31 0.00 0.00 61.69 61.64 1yho s THR 40 Cb 0.16 -3.82 -0.09 0.00 0.01 0.00 0.00 72.50 68.77 1yho s THR 40 CO 0.70 -0.78 0.96 -0.44 -0.69 0.00 0.00 174.62 174.37 1yho s SER 41 N 8.63 6.75 -0.01 3.53 0.01 -1.26 -4.98 113.70 126.38 1yho s SER 41 Ca 0.73 1.60 0.02 0.00 1.31 0.00 0.00 55.95 59.61 1yho s SER 41 Cb -0.10 -2.51 -0.25 0.00 0.21 0.00 0.00 66.02 63.36 1yho s SER 41 CO 0.09 -0.48 0.81 0.28 0.41 0.00 0.00 173.24 174.35 1yho h SER 42 N 1.37 0.23 -3.35 2.44 0.02 -1.96 -3.45 113.55 108.85 1yho h SER 42 Ca -0.48 -0.36 -0.65 0.00 -0.84 0.00 0.00 61.79 59.46 1yho h SER 42 Cb 1.18 -0.08 -0.19 0.00 0.14 0.00 0.00 62.40 63.45 1yho h SER 42 CO 0.61 1.31 -0.65 0.68 -1.14 0.00 0.00 176.83 177.64 1yho s VAL 43 N -2.62 4.05 0.15 2.27 -7.23 -1.26 -5.10 120.40 110.66 1yho s VAL 43 Ca -0.08 -0.32 -0.24 0.00 -1.81 0.00 0.00 61.98 59.53 1yho s VAL 43 Cb 0.08 -2.75 -0.08 0.00 0.56 0.00 0.00 36.38 34.19 1yho s VAL 43 CO 0.83 0.53 0.74 -0.70 -0.31 0.00 0.00 175.10 176.19 1yho s GLU 44 N -0.08 4.49 0.00 4.82 2.12 -1.26 -3.72 118.70 125.06 1yho s GLU 44 Ca 0.03 1.07 0.00 0.00 0.36 0.00 0.00 54.97 56.42 1yho s GLU 44 Cb -0.13 -3.24 0.00 0.00 0.26 0.00 0.00 34.13 31.03 1yho s GLU 44 CO 0.02 0.57 0.00 0.41 -0.54 0.00 0.00 175.26 175.73 1yho n GLY 45 N 1.56 1.39 3.79 -1.50 0.00 -1.26 -5.04 105.19 104.13 1yho n GLY 45 Ca -0.06 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.53 2.78 -0.03 1.61 3.01 -1.24 -5.06 119.74 120.27 1yho s LYS 46 Ca 0.00 -1.15 0.05 0.00 -1.01 0.00 0.00 55.97 53.85 1yho s LYS 46 Cb 0.00 -2.47 -0.03 0.00 -1.01 0.00 0.00 37.83 34.32 1yho s LYS 46 CO 0.00 0.36 -0.16 -0.65 0.51 0.00 0.00 175.35 175.41 1yho s GLN 47 N -3.82 2.39 -0.12 1.68 -0.21 -0.77 -4.97 119.66 113.84 1yho s GLN 47 Ca 0.33 -0.77 -0.06 0.00 0.02 0.00 0.00 55.36 54.88 1yho s GLN 47 Cb -0.07 -2.31 -0.04 0.00 1.00 0.00 0.00 33.01 31.59 1yho s GLN 47 CO 0.24 0.60 0.12 -0.80 -2.12 0.00 0.00 175.29 173.34 1yho s ASN 48 N -0.85 6.26 -0.07 5.90 0.01 -1.26 -3.02 114.94 121.90 1yho s ASN 48 Ca 0.12 0.43 -0.01 0.00 -0.71 0.00 0.00 52.86 52.69 1yho s ASN 48 Cb -0.11 -2.00 -0.03 0.00 0.41 0.00 0.00 41.25 39.52 1yho s ASN 48 CO 0.01 0.41 -0.01 -0.22 -1.51 0.00 0.00 177.10 175.77 1yho s LEU 49 N -1.01 3.48 0.04 0.60 0.20 -0.93 -1.99 118.68 119.07 1yho s LEU 49 Ca 0.15 0.09 0.06 0.00 0.69 0.00 0.00 54.13 55.12 1yho s LEU 49 Cb -0.12 -1.81 -0.03 0.00 -0.43 0.00 0.00 46.19 43.80 1yho s LEU 49 CO 0.04 0.36 -0.15 0.54 -0.29 0.00 0.00 176.35 176.85 1yho s VAL 50 N -0.89 2.99 -0.21 1.68 0.11 -0.05 0.53 120.40 124.56 1yho s VAL 50 Ca 0.14 -1.13 -0.04 0.00 -2.93 0.00 0.00 61.98 58.01 1yho s VAL 50 Cb -0.11 -2.28 -0.02 0.00 -1.53 0.00 0.00 36.38 32.44 1yho s VAL 50 CO 0.03 0.32 -0.03 -0.63 -3.33 0.00 0.00 175.10 171.46 1yho s ILE 51 N -0.97 3.60 0.09 7.04 -1.09 0.23 -1.60 121.20 128.51 1yho s ILE 51 Ca 0.16 -0.42 0.07 0.00 -2.23 0.00 0.00 60.65 58.22 1yho s ILE 51 Cb -0.11 -2.63 -0.03 0.00 -1.58 0.00 0.00 42.46 38.11 1yho s ILE 51 CO 0.06 0.43 -0.18 -0.04 -1.23 0.00 0.00 174.94 173.99 1yho s MET 52 N 1.25 0.99 0.73 2.79 -1.94 0.31 -2.09 119.30 121.32 1yho s MET 52 Ca 0.03 -1.08 -0.07 0.00 -1.71 0.00 0.00 55.69 52.85 1yho s MET 52 Cb -0.14 -1.12 0.07 0.00 2.01 0.00 0.00 34.83 35.65 1yho s MET 52 CO -0.00 0.25 1.04 0.20 -0.01 0.00 0.00 175.02 176.50 1yho s GLY 53 N -1.89 1.68 0.25 -0.03 0.00 -1.07 -1.59 107.32 104.67 1yho s GLY 53 Ca 0.03 -0.90 -0.06 0.00 0.00 0.00 0.00 44.72 43.79 1yho s GLY 53 CO 0.03 -0.48 1.89 1.70 0.00 0.00 0.00 173.10 176.24 1yho h LYS 54 N -0.69 1.23 -0.16 2.90 3.11 -1.95 -0.99 116.57 120.02 1yho h LYS 54 Ca -0.44 -0.12 -0.03 0.00 -2.81 0.00 0.00 60.65 57.24 1yho h LYS 54 Cb 1.32 -0.25 -0.01 0.00 -1.00 0.00 0.00 32.23 32.29 1yho h LYS 54 CO 0.60 0.88 -0.03 -0.22 -2.81 0.00 0.00 179.45 177.87 1yho h LYS 55 N 1.24 0.30 -0.35 1.90 3.64 -1.93 -2.01 116.57 119.36 1yho h LYS 55 Ca 0.32 -0.11 0.01 0.00 -1.27 0.00 0.00 60.65 59.60 1yho h LYS 55 Cb -0.02 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 1yho h LYS 55 CO -0.06 0.56 0.21 1.15 -2.27 0.00 0.00 179.45 179.05 1yho h THR 56 N 0.02 1.06 -0.90 1.00 2.02 -1.88 -0.29 112.91 113.93 1yho h THR 56 Ca 0.04 -0.15 0.01 0.00 0.77 0.00 0.00 66.41 67.08 1yho h THR 56 Cb 0.44 0.58 -0.04 0.00 -1.74 0.00 0.00 68.15 67.39 1yho h THR 56 CO 0.01 0.08 0.59 -0.25 0.37 0.00 0.00 175.52 176.33 1yho h TRP 57 N 0.43 1.13 0.00 3.16 2.91 -1.17 -0.62 115.95 121.80 1yho h TRP 57 Ca 0.13 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.16 1yho h TRP 57 Cb -0.02 -0.38 -0.00 0.00 -0.51 0.00 0.00 29.16 28.25 1yho h TRP 57 CO -0.07 0.71 -0.08 0.74 -1.03 0.00 0.00 178.44 178.71 1yho h PHE 58 N 1.22 0.00 0.01 2.65 -1.00 -0.84 -3.06 116.94 115.91 1yho h PHE 58 Ca 0.33 0.00 -0.25 0.00 2.81 0.00 0.00 57.97 60.86 1yho h PHE 58 Cb -0.14 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 39.38 1yho h PHE 58 CO 0.00 0.08 -1.31 1.03 -1.61 0.00 0.00 178.31 176.51 1yho h SER 59 N 0.00 0.02 -2.93 2.17 0.87 0.23 -3.45 113.55 110.46 1yho h SER 59 Ca -0.00 -0.03 -0.55 0.00 -1.23 0.00 0.00 61.79 59.98 1yho h SER 59 Cb 0.75 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.68 1yho h SER 59 CO 0.01 1.02 0.84 -0.63 -0.53 0.00 0.00 176.83 177.54 1yho s ILE 60 N -2.66 3.97 0.48 2.23 1.01 -0.37 -4.98 121.20 120.88 1yho s ILE 60 Ca -0.02 1.29 -0.23 0.00 0.00 0.00 0.00 60.65 61.69 1yho s ILE 60 Cb 0.09 -3.83 -0.09 0.00 0.01 0.00 0.00 42.46 38.65 1yho s ILE 60 CO 0.82 -0.04 1.07 -2.65 0.00 0.00 0.00 174.94 174.15 1yho n PRO 61 N 5.76 1.38 0.20 2.79 -0.02 -1.26 -4.89 135.00 138.96 1yho n PRO 61 Ca 0.13 0.50 0.04 0.00 -2.02 0.00 0.00 63.50 62.15 1yho n PRO 61 Cb 0.44 -2.18 0.41 0.00 -0.02 0.00 0.00 33.50 32.16 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 1.38 0.00 -0.16 -0.52 4.81 -1.93 -2.62 114.58 115.55 1yho h GLU 62 Ca -0.47 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 58.80 1yho h GLU 62 Cb 1.33 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.71 1yho h GLU 62 CO 0.56 0.33 0.11 -0.22 -0.73 0.00 0.00 179.01 179.06 1yho h LYS 63 N 0.00 0.06 -0.76 1.92 3.64 -2.02 -0.66 116.57 118.75 1yho h LYS 63 Ca -0.00 -0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.03 1yho h LYS 63 Cb 0.61 -0.01 -0.20 0.00 -0.41 0.00 0.00 32.23 32.21 1yho h LYS 63 CO 0.04 0.04 0.37 0.09 -2.27 0.00 0.00 179.45 177.72 1yho n ASN 64 N -4.50 3.75 -3.85 4.20 3.02 -0.99 -4.93 115.26 111.97 1yho n ASN 64 Ca 0.00 -3.52 -0.13 0.00 -0.03 0.00 0.00 54.58 50.90 1yho n ASN 64 Cb 0.20 -0.76 -0.14 0.00 -0.61 0.00 0.00 39.78 38.47 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 -3.19 0.00 0.27 3.52 0.52 -0.26 -3.49 118.95 116.33 1yho s ARG 65 Ca 0.53 0.05 -0.30 0.00 -0.52 0.00 0.00 55.73 55.50 1yho s ARG 65 Cb 0.45 -0.04 -0.09 0.00 0.52 0.00 0.00 34.95 35.78 1yho s ARG 65 CO 0.09 -0.03 1.05 -2.14 0.02 0.00 0.00 175.30 174.28 1yho s PRO 66 N 0.21 4.71 -0.70 3.54 0.02 -1.26 -4.91 135.00 136.62 1yho s PRO 66 Ca -0.02 1.70 -0.26 0.00 0.02 0.00 0.00 61.00 62.45 1yho s PRO 66 Cb -0.03 -3.22 -0.05 0.00 0.02 0.00 0.00 34.50 31.23 1yho s PRO 66 CO -0.01 0.31 2.02 -1.17 -0.33 0.00 0.00 177.00 177.82 1yho s LEU 67 N -1.37 3.23 1.04 -5.54 1.98 -1.23 -4.95 118.68 111.84 1yho s LEU 67 Ca 0.43 0.12 -0.11 0.00 -2.89 0.00 0.00 54.13 51.68 1yho s LEU 67 Cb -0.30 -2.54 0.21 0.00 0.66 0.00 0.00 46.19 44.23 1yho s LEU 67 CO 0.38 -2.70 1.09 -0.54 -1.89 0.00 0.00 176.35 172.70 1yho s LYS 68 N 7.38 0.05 0.00 1.98 -0.14 -1.26 -3.56 119.74 124.19 1yho s LYS 68 Ca 0.75 1.27 0.00 0.00 -1.36 0.00 0.00 55.97 56.63 1yho s LYS 68 Cb -0.12 -1.63 0.00 0.00 -1.68 0.00 0.00 37.83 34.40 1yho s LYS 68 CO 0.14 -3.20 0.00 0.41 -0.76 0.00 0.00 175.35 171.94 1yho n GLY 69 N 0.60 2.80 3.10 -3.33 0.00 -1.26 -4.98 105.19 102.12 1yho n GLY 69 Ca 0.08 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 45.67 1yho n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yho s ARG 70 N 0.00 0.53 -0.06 1.61 3.00 -1.23 -4.70 118.95 118.08 1yho s ARG 70 Ca 0.00 -0.65 -0.30 0.00 0.00 0.00 0.00 55.73 54.78 1yho s ARG 70 Cb 0.00 0.21 -0.03 0.00 0.00 0.00 0.00 34.95 35.13 1yho s ARG 70 CO 0.00 -0.13 1.20 0.42 0.00 0.00 0.00 175.30 176.80 1yho s ILE 71 N -2.16 4.26 -0.29 1.52 -1.09 -0.84 -4.79 121.20 117.80 1yho s ILE 71 Ca -0.09 1.58 -0.18 0.00 -2.23 0.00 0.00 60.65 59.73 1yho s ILE 71 Cb -0.04 -4.02 -0.02 0.00 -1.58 0.00 0.00 42.46 36.80 1yho s ILE 71 CO -0.03 -0.01 0.53 0.20 -1.23 0.00 0.00 174.94 174.40 1yho s ASN 72 N 1.50 6.40 -0.11 3.58 -0.87 -1.26 -0.88 114.94 123.32 1yho s ASN 72 Ca 0.56 0.35 0.04 0.00 -1.57 0.00 0.00 52.86 52.24 1yho s ASN 72 Cb -0.24 -2.28 0.00 0.00 -0.02 0.00 0.00 41.25 38.71 1yho s ASN 72 CO 0.21 -0.37 -0.23 -0.22 -2.57 0.00 0.00 177.10 173.93 1yho s LEU 73 N 2.38 2.07 -0.06 0.60 0.20 -0.63 -0.60 118.68 122.65 1yho s LEU 73 Ca 0.21 -0.56 -0.01 0.00 0.69 0.00 0.00 54.13 54.46 1yho s LEU 73 Cb -0.15 -1.39 -0.03 0.00 -0.43 0.00 0.00 46.19 44.18 1yho s LEU 73 CO 0.11 0.14 0.01 -0.69 -0.29 0.00 0.00 176.35 175.63 1yho s VAL 74 N 0.44 4.36 -0.36 1.68 1.01 -0.26 -0.53 120.40 126.74 1yho s VAL 74 Ca -0.17 -0.33 -0.06 0.00 0.00 0.00 0.00 61.98 61.42 1yho s VAL 74 Cb -0.17 -2.88 0.05 0.00 0.00 0.00 0.00 36.38 33.38 1yho s VAL 74 CO 0.07 0.53 0.14 -0.76 0.00 0.00 0.00 175.10 175.07 1yho s LEU 75 N -1.13 4.53 -0.07 3.92 1.43 -0.62 -1.78 118.68 124.95 1yho s LEU 75 Ca 0.16 -1.29 -0.03 0.00 -1.03 0.00 0.00 54.13 51.94 1yho s LEU 75 Cb -0.11 -1.88 0.04 0.00 0.03 0.00 0.00 46.19 44.27 1yho s LEU 75 CO 0.05 -0.38 0.16 -0.55 0.23 0.00 0.00 176.35 175.86 1yho s SER 76 N 1.56 0.06 0.01 2.29 0.15 -0.70 -3.84 113.70 113.23 1yho s SER 76 Ca -0.00 0.33 0.18 0.00 0.70 0.00 0.00 55.95 57.15 1yho s SER 76 Cb -0.20 0.23 -0.18 0.00 -1.71 0.00 0.00 66.02 64.15 1yho s SER 76 CO 0.02 -0.17 0.65 -1.14 1.20 0.00 0.00 173.24 173.80 1yho n ARG 77 N 4.45 0.64 0.08 5.44 0.63 -1.24 -4.08 116.66 122.57 1yho n ARG 77 Ca -0.22 0.13 -0.17 0.00 -0.92 0.00 0.00 57.85 56.68 1yho n ARG 77 Cb 0.51 -1.72 -0.09 0.00 0.45 0.00 0.00 32.46 31.62 1yho n ARG 77 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1yho h GLU 78 N 0.00 0.47 -6.17 -0.14 4.81 -1.95 -3.45 114.58 108.15 1yho h GLU 78 Ca -0.21 -0.57 -0.58 0.00 -0.13 0.00 0.00 59.36 57.87 1yho h GLU 78 Cb 1.62 0.18 -0.04 0.00 0.63 0.00 0.00 28.75 31.13 1yho h GLU 78 CO 0.04 1.21 -0.14 -0.51 -0.73 0.00 0.00 179.01 178.87 1yho s LEU 79 N -7.72 4.41 -0.25 1.64 1.43 -1.26 -5.00 118.68 111.94 1yho s LEU 79 Ca -0.07 1.01 0.04 0.00 -1.03 0.00 0.00 54.13 54.09 1yho s LEU 79 Cb 0.08 -2.95 -0.18 0.00 0.03 0.00 0.00 46.19 43.16 1yho s LEU 79 CO 0.89 0.21 -0.19 1.17 0.23 0.00 0.00 176.35 178.66 1yho n LYS 80 N 1.26 0.66 -3.59 1.70 3.00 -1.26 -4.82 118.16 115.10 1yho n LYS 80 Ca -0.09 0.13 -0.38 0.00 -0.00 0.00 0.00 58.31 57.97 1yho n LYS 80 Cb 0.52 -1.52 -0.06 0.00 0.00 0.00 0.00 35.03 33.97 1yho n LYS 80 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 1yho s GLU 81 N -2.52 3.84 0.21 1.64 2.56 -1.26 -5.02 118.70 118.16 1yho s GLU 81 Ca -0.32 0.25 -0.31 0.00 0.00 0.00 0.00 54.97 54.60 1yho s GLU 81 Cb 0.09 -3.24 -0.10 0.00 2.00 0.00 0.00 34.13 32.88 1yho s GLU 81 CO 0.63 0.66 1.46 -1.25 -0.56 0.00 0.00 175.26 176.19 1yho s PRO 82 N -0.87 4.27 0.77 4.30 0.04 -1.26 -4.97 135.00 137.28 1yho s PRO 82 Ca 0.21 2.28 -0.15 0.00 0.04 0.00 0.00 61.00 63.37 1yho s PRO 82 Cb -0.15 -3.14 0.01 0.00 0.04 0.00 0.00 34.50 31.25 1yho s PRO 82 CO 0.10 -0.46 0.76 -2.30 0.04 0.00 0.00 177.00 175.14 1yho n PRO 83 N 2.92 0.26 -1.71 0.56 -0.02 -1.26 -4.85 135.00 130.91 1yho n PRO 83 Ca 0.09 0.14 -0.42 0.00 -2.02 0.00 0.00 63.50 61.28 1yho n PRO 83 Cb 0.40 -2.05 -0.03 0.00 -0.02 0.00 0.00 33.50 31.80 1yho n PRO 83 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1yho n GLN 84 N -1.65 2.74 0.00 -0.52 6.02 -1.26 -1.64 117.38 121.07 1yho n GLN 84 Ca 0.11 0.99 0.00 0.00 -0.01 0.00 0.00 57.00 58.09 1yho n GLN 84 Cb 0.50 -2.85 0.00 0.00 1.02 0.00 0.00 30.24 28.91 1yho n GLN 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1yho n GLY 85 N 4.03 3.27 3.79 1.08 0.00 -1.26 -4.99 105.19 111.11 1yho n GLY 85 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.96 2.94 -0.04 4.61 0.00 -0.65 -4.32 121.76 121.34 1yho s ALA 86 Ca 0.00 0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.64 1yho s ALA 86 Cb 0.00 -3.28 -0.26 0.00 0.00 0.00 0.00 23.12 19.59 1yho s ALA 86 CO 0.00 -0.33 0.67 0.45 0.00 0.00 0.00 175.76 176.55 1yho h HIS 87 N 1.90 0.32 -3.17 0.00 3.86 -1.17 -3.47 115.15 113.42 1yho h HIS 87 Ca -0.49 -0.24 -0.05 0.00 -1.16 0.00 0.00 60.37 58.43 1yho h HIS 87 Cb 1.22 -0.01 -0.14 0.00 1.06 0.00 0.00 27.41 29.54 1yho h HIS 87 CO 0.57 1.38 -0.02 -0.06 0.86 0.00 0.00 177.93 180.66 1yho s PHE 88 N -2.60 -0.30 -0.03 2.45 0.08 -0.96 -5.01 117.98 111.62 1yho s PHE 88 Ca -0.11 0.11 -0.01 0.00 0.12 0.00 0.00 56.93 57.03 1yho s PHE 88 Cb 0.07 0.31 0.02 0.00 -0.57 0.00 0.00 43.02 42.85 1yho s PHE 88 CO 0.82 -0.69 0.06 -1.17 -0.10 0.00 0.00 175.22 174.14 1yho s LEU 89 N -2.52 1.32 0.12 -0.37 2.96 -1.26 -1.10 118.68 117.82 1yho s LEU 89 Ca -0.00 0.11 0.09 0.00 -0.22 0.00 0.00 54.13 54.11 1yho s LEU 89 Cb 0.01 0.10 -0.04 0.00 0.50 0.00 0.00 46.19 46.76 1yho s LEU 89 CO -0.09 -0.09 -0.22 -0.44 -1.32 0.00 0.00 176.35 174.20 1yho s SER 90 N 0.66 2.70 0.07 3.68 0.01 -0.73 -4.94 113.70 115.14 1yho s SER 90 Ca -0.05 -0.72 -0.15 0.00 1.31 0.00 0.00 55.95 56.33 1yho s SER 90 Cb -0.07 -0.16 -0.17 0.00 0.21 0.00 0.00 66.02 65.83 1yho s SER 90 CO -0.02 0.07 1.27 0.03 0.41 0.00 0.00 173.24 174.99 1yho h ARG 91 N 3.93 0.66 -4.75 12.44 3.08 -1.89 -1.86 114.38 125.98 1yho h ARG 91 Ca -0.46 -0.53 -0.30 0.00 0.07 0.00 0.00 59.98 58.76 1yho h ARG 91 Cb 1.18 0.11 -0.15 0.00 0.08 0.00 0.00 29.97 31.20 1yho h ARG 91 CO 0.41 1.15 -0.62 -1.54 -1.07 0.00 0.00 179.97 178.30 1yho s SER 92 N -6.88 0.75 0.22 7.04 1.04 -1.26 -3.73 113.70 110.88 1yho s SER 92 Ca -0.12 -1.37 -0.08 0.00 0.48 0.00 0.00 55.95 54.87 1yho s SER 92 Cb 0.07 0.25 0.17 0.00 0.10 0.00 0.00 66.02 66.61 1yho s SER 92 CO 0.86 -0.76 1.81 0.25 0.98 0.00 0.00 173.24 176.38 1yho h LEU 93 N 2.51 1.08 -0.72 2.42 5.85 -1.99 -2.34 115.31 122.12 1yho h LEU 93 Ca -0.37 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.21 1yho h LEU 93 Cb 1.24 -0.28 -0.04 0.00 0.37 0.00 0.00 40.66 41.96 1yho h LEU 93 CO 0.58 0.92 0.47 -0.78 -0.34 0.00 0.00 178.44 179.29 1yho h ASP 94 N 1.17 0.84 -0.13 1.25 1.82 -1.98 0.12 116.42 119.51 1yho h ASP 94 Ca 0.28 -0.03 -0.00 0.00 -0.39 0.00 0.00 57.03 56.89 1yho h ASP 94 Cb 0.14 -0.21 -0.01 0.00 0.68 0.00 0.00 39.33 39.93 1yho h ASP 94 CO -0.03 0.62 0.07 -0.78 -1.61 0.00 0.00 179.24 177.50 1yho h ASP 95 N 0.98 0.17 -0.42 2.28 1.82 -1.89 0.12 116.42 119.48 1yho h ASP 95 Ca 0.26 -0.11 -0.07 0.00 -0.39 0.00 0.00 57.03 56.72 1yho h ASP 95 Cb -0.10 -0.04 -0.02 0.00 0.68 0.00 0.00 39.33 39.84 1yho h ASP 95 CO -0.06 0.24 0.04 0.00 -1.61 0.00 0.00 179.24 177.85 1yho h ALA 96 N 0.94 1.14 -0.35 -0.78 0.00 -1.17 -2.31 119.26 116.73 1yho h ALA 96 Ca 0.05 -0.25 -0.12 0.00 0.00 0.00 0.00 54.91 54.59 1yho h ALA 96 Cb 0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1yho h ALA 96 CO -0.01 0.56 -0.27 -0.07 0.00 0.00 0.00 179.25 179.47 1yho h LEU 97 N 0.75 0.74 -0.37 0.00 3.38 -0.52 -2.39 115.31 116.90 1yho h LEU 97 Ca 0.15 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1yho h LEU 97 Cb 0.40 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1yho h LEU 97 CO 0.01 0.97 0.07 0.11 0.09 0.00 0.00 178.44 179.69 1yho h LYS 98 N 0.62 0.61 -0.26 1.13 1.79 -0.66 -0.56 116.57 119.24 1yho h LYS 98 Ca 0.08 -0.16 -0.00 0.00 -2.18 0.00 0.00 60.65 58.38 1yho h LYS 98 Cb 0.77 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 31.34 1yho h LYS 98 CO 0.06 0.67 0.15 1.25 -1.08 0.00 0.00 179.45 180.50 1yho h LEU 99 N 0.46 0.32 -1.58 2.94 5.85 -1.35 0.28 115.31 122.24 1yho h LEU 99 Ca 0.11 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 1yho h LEU 99 Cb 0.35 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1yho h LEU 99 CO 0.01 0.31 -0.21 0.74 -0.34 0.00 0.00 178.44 178.95 1yho h THR 100 N 0.31 0.75 0.00 1.05 2.02 -1.35 -2.40 112.91 113.29 1yho h THR 100 Ca 0.09 -0.84 -0.04 0.00 0.77 0.00 0.00 66.41 66.39 1yho h THR 100 Cb 0.05 1.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 1yho h THR 100 CO -0.02 0.20 -0.77 -0.08 0.37 0.00 0.00 175.52 175.22 1yho h GLU 101 N 0.00 0.00 -7.13 6.66 4.81 -0.47 -3.37 114.58 115.07 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 0.50 0.00 0.13 0.00 0.63 0.00 0.00 28.75 30.01 1yho h GLU 101 CO 0.03 0.10 0.45 -0.65 -0.73 0.00 0.00 179.01 178.20 1yho s GLN 102 N -3.21 2.66 0.34 1.92 -0.21 0.94 -4.42 119.66 117.68 1yho s GLN 102 Ca 0.01 1.80 0.08 0.00 0.02 0.00 0.00 55.36 57.28 1yho s GLN 102 Cb 0.08 -1.89 0.62 0.00 1.00 0.00 0.00 33.01 32.82 1yho s GLN 102 CO 0.76 -1.44 1.80 -1.00 -2.12 0.00 0.00 175.29 173.29 1yho h PRO 103 N 0.42 0.22 -0.48 2.91 0.13 -1.90 0.62 132.00 133.91 1yho h PRO 103 Ca -0.49 -0.08 0.01 0.00 -0.87 0.00 0.00 66.00 64.57 1yho h PRO 103 Cb 1.30 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 1yho h PRO 103 CO 0.53 0.49 0.32 0.93 -0.23 0.00 0.00 178.00 180.04 1yho h GLU 104 N 0.19 0.61 0.00 0.86 3.07 -1.91 -2.92 114.58 114.48 1yho h GLU 104 Ca 0.03 -0.04 -0.21 0.00 -0.50 0.00 0.00 59.36 58.64 1yho h GLU 104 Cb 0.61 -0.14 -0.04 0.00 -0.84 0.00 0.00 28.75 28.34 1yho h GLU 104 CO 0.04 0.40 -2.09 1.28 -1.40 0.00 0.00 179.01 177.24 1yho n LEU 105 N -4.47 0.00 0.21 1.33 4.32 -1.07 -4.36 117.00 112.96 1yho n LEU 105 Ca 0.04 0.00 0.18 0.00 -0.02 0.00 0.00 56.01 56.22 1yho n LEU 105 Cb 0.08 0.29 0.83 0.00 -1.62 0.00 0.00 43.42 42.99 1yho n LEU 105 CO 0.35 0.29 1.16 0.00 -1.22 0.00 0.00 177.39 177.97 1yho h ALA 106 N 1.16 1.75 -0.01 -1.18 0.00 0.43 0.64 119.26 122.05 1yho h ALA 106 Ca -0.32 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.46 1yho h ALA 106 Cb 1.68 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.47 1yho h ALA 106 CO 0.02 -0.39 -0.56 -0.91 0.00 0.00 0.00 179.25 177.40 1yho h ASN 107 N 0.00 0.04 0.00 0.00 2.35 -1.73 -3.32 115.58 112.92 1yho h ASN 107 Ca 0.10 -0.02 -0.41 0.00 -0.55 0.00 0.00 56.30 55.42 1yho h ASN 107 Cb 0.67 -0.01 -0.07 0.00 0.05 0.00 0.00 38.32 38.96 1yho h ASN 107 CO -0.00 0.60 -2.49 1.17 -1.65 0.00 0.00 177.43 175.06 1yho n LYS 108 N -3.87 0.64 -4.21 0.81 0.00 0.56 -4.92 118.16 107.18 1yho n LYS 108 Ca -0.01 0.18 -0.31 0.00 0.00 0.00 0.00 58.31 58.16 1yho n LYS 108 Cb 0.57 -1.52 -0.08 0.00 0.00 0.00 0.00 35.03 34.00 1yho n LYS 108 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1yho s VAL 109 N -2.52 4.02 0.06 3.15 1.01 0.19 -1.85 120.40 124.48 1yho s VAL 109 Ca -0.36 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 60.77 1yho s VAL 109 Cb 0.10 -2.87 0.00 0.00 0.00 0.00 0.00 36.38 33.62 1yho s VAL 109 CO 0.58 0.22 0.00 0.47 0.00 0.00 0.00 175.10 176.37 1yho n ASP 110 N 0.91 0.26 -4.50 3.32 9.92 -1.17 -3.96 116.55 121.33 1yho n ASP 110 Ca -0.12 0.10 -0.26 0.00 -0.53 0.00 0.00 54.79 53.97 1yho n ASP 110 Cb 0.52 -0.03 -0.10 0.00 -0.64 0.00 0.00 41.12 40.87 1yho n ASP 110 CO 0.00 0.00 0.00 -0.04 0.13 0.00 0.00 177.20 177.29 1yho s MET 111 N -2.00 1.80 0.09 -1.24 -1.94 -1.26 -3.98 119.30 110.77 1yho s MET 111 Ca 0.00 -1.43 0.09 0.00 -1.71 0.00 0.00 55.69 52.64 1yho s MET 111 Cb 0.00 -1.99 -0.04 0.00 2.01 0.00 0.00 34.83 34.81 1yho s MET 111 CO 0.00 0.41 -0.19 0.14 -0.01 0.00 0.00 175.02 175.37 1yho s VAL 112 N -1.77 2.77 -0.06 -6.03 -7.23 -0.92 -2.20 120.40 104.95 1yho s VAL 112 Ca 0.24 -1.43 0.05 0.00 -1.81 0.00 0.00 61.98 59.03 1yho s VAL 112 Cb -0.08 -2.23 -0.00 0.00 0.56 0.00 0.00 36.38 34.63 1yho s VAL 112 CO 0.13 0.18 -0.20 0.26 -0.31 0.00 0.00 175.10 175.15 1yho s TRP 113 N -1.06 2.08 -0.20 2.82 0.52 0.19 -1.85 118.94 121.44 1yho s TRP 113 Ca 0.16 -0.68 -0.10 0.00 0.02 0.00 0.00 56.10 55.51 1yho s TRP 113 Cb -0.10 -1.40 -0.05 0.00 -1.15 0.00 0.00 33.47 30.77 1yho s TRP 113 CO 0.08 -0.24 0.12 0.42 0.02 0.00 0.00 176.95 177.35 1yho s ILE 114 N 0.10 5.29 -0.26 2.03 -1.09 0.15 0.77 121.20 128.19 1yho s ILE 114 Ca -0.08 0.15 0.18 0.00 -2.23 0.00 0.00 60.65 58.67 1yho s ILE 114 Cb -0.14 -3.41 0.49 0.00 -1.58 0.00 0.00 42.46 37.82 1yho s ILE 114 CO 0.04 0.44 1.14 1.33 -1.23 0.00 0.00 174.94 176.66 1yho n VAL 115 N 3.55 1.66 0.00 2.92 0.24 -0.89 -2.14 118.33 123.67 1yho n VAL 115 Ca -0.16 -3.31 0.00 0.00 -2.04 0.00 0.00 64.34 58.83 1yho n VAL 115 Cb 0.52 0.50 0.00 0.00 -1.47 0.00 0.00 33.84 33.39 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 -0.62 0.48 0.00 7.63 0.00 -1.26 -4.79 105.19 106.63 1yho n GLY 116 Ca 0.19 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.31 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 0.77 1.17 0.26 -0.02 0.00 -1.26 -2.60 105.19 103.50 1yho n GLY 117 Ca 0.00 -1.59 -0.08 0.00 0.00 0.00 0.00 46.02 44.35 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 0.75 -0.94 1.61 0.87 -1.99 -2.29 113.55 111.57 1yho h SER 118 Ca 0.00 -0.28 0.05 0.00 -1.23 0.00 0.00 61.79 60.33 1yho h SER 118 Cb 0.00 -0.21 -0.06 0.00 -0.44 0.00 0.00 62.40 61.69 1yho h SER 118 CO 0.00 0.98 0.61 0.28 -0.53 0.00 0.00 176.83 178.17 1yho h SER 119 N 0.64 0.98 -0.01 6.23 0.02 -1.99 0.20 113.55 119.62 1yho h SER 119 Ca 0.08 -0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.80 1yho h SER 119 Cb 0.76 -0.21 0.01 0.00 0.14 0.00 0.00 62.40 63.10 1yho h SER 119 CO 0.06 0.65 -0.85 0.58 -1.14 0.00 0.00 176.83 176.13 1yho h VAL 120 N 1.13 1.30 -0.51 2.27 2.07 -1.82 -2.25 116.25 118.44 1yho h VAL 120 Ca 0.39 -2.11 -0.08 0.00 0.82 0.00 0.00 66.70 65.72 1yho h VAL 120 Cb 0.11 2.13 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 1yho h VAL 120 CO -0.14 0.66 -0.01 0.22 0.02 0.00 0.00 177.57 178.32 1yho h TYR 121 N 0.44 1.00 -0.29 1.57 3.20 -0.81 -1.89 116.97 120.19 1yho h TYR 121 Ca -0.07 -0.18 -0.06 0.00 3.14 0.00 0.00 58.73 61.56 1yho h TYR 121 Cb 1.48 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 39.48 1yho h TYR 121 CO 0.08 0.93 -0.05 0.87 -1.64 0.00 0.00 178.16 178.34 1yho h LYS 122 N 0.78 0.55 -0.72 1.82 1.79 -0.66 -0.48 116.57 119.65 1yho h LYS 122 Ca 0.14 -0.20 0.02 0.00 -2.18 0.00 0.00 60.65 58.43 1yho h LYS 122 Cb 0.53 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 31.11 1yho h LYS 122 CO 0.03 0.74 0.46 1.49 -1.08 0.00 0.00 179.45 181.09 1yho h GLU 123 N 0.32 0.90 0.00 3.15 4.57 -1.34 -2.00 114.58 120.18 1yho h GLU 123 Ca 0.08 -0.05 -0.12 0.00 -1.18 0.00 0.00 59.36 58.08 1yho h GLU 123 Cb 0.53 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.90 1yho h GLU 123 CO 0.03 0.60 -0.58 0.00 -1.18 0.00 0.00 179.01 177.88 1yho h ALA 124 N 1.29 0.98 0.00 2.92 0.00 -1.26 -2.93 119.26 120.25 1yho h ALA 124 Ca 0.28 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1yho h ALA 124 Cb -0.04 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1yho h ALA 124 CO -0.08 0.72 -0.00 0.52 0.00 0.00 0.00 179.25 180.40 1yho h MET 125 N 0.00 0.00 -0.72 0.00 2.86 -0.30 -0.08 114.93 116.69 1yho h MET 125 Ca -0.01 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.62 1yho h MET 125 Cb 1.06 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.71 1yho h MET 125 CO 0.07 0.00 0.02 -1.71 1.06 0.00 0.00 176.91 176.36 1yho n ASN 126 N -3.12 4.32 -4.58 1.22 2.85 -1.11 -4.89 115.26 109.97 1yho n ASN 126 Ca -0.03 -2.68 -0.43 0.00 -0.11 0.00 0.00 54.58 51.33 1yho n ASN 126 Cb 0.07 -0.64 -0.04 0.00 1.24 0.00 0.00 39.78 40.41 1yho n ASN 126 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 1yho s HIS 127 N -2.25 3.04 0.41 1.20 3.76 -0.05 -4.92 115.29 116.49 1yho s HIS 127 Ca 0.39 0.55 0.22 0.00 -0.15 0.00 0.00 55.06 56.07 1yho s HIS 127 Cb 0.30 -3.65 1.22 0.00 1.11 0.00 0.00 32.58 31.56 1yho s HIS 127 CO 0.11 -0.88 2.01 -1.35 -0.85 0.00 0.00 174.74 173.79 1yho h PRO 128 N 8.67 0.00 -7.44 8.40 0.11 -1.90 -3.44 132.00 136.40 1yho h PRO 128 Ca -0.24 0.00 -0.46 0.00 0.11 0.00 0.00 66.00 65.41 1yho h PRO 128 Cb 1.08 0.00 0.13 0.00 0.11 0.00 0.00 31.00 32.33 1yho h PRO 128 CO 0.97 0.17 0.28 0.20 -0.21 0.00 0.00 178.00 179.41 1yho s GLY 129 N -4.21 1.58 0.19 -0.55 0.00 -1.26 -4.57 107.32 98.50 1yho s GLY 129 Ca -0.03 -0.42 -0.32 0.00 0.00 0.00 0.00 44.72 43.96 1yho s GLY 129 CO 0.63 0.13 1.71 -1.58 0.00 0.00 0.00 173.10 173.99 1yho s HIS 130 N -3.17 2.82 -0.01 1.90 2.46 -1.26 -4.84 115.29 113.19 1yho s HIS 130 Ca 0.64 0.35 -0.06 0.00 0.47 0.00 0.00 55.06 56.45 1yho s HIS 130 Cb -0.16 -4.10 0.00 0.00 -0.13 0.00 0.00 32.58 28.20 1yho s HIS 130 CO 0.55 -4.21 0.13 -1.17 -2.47 0.00 0.00 174.74 167.57 1yho s LEU 131 N 1.42 1.56 0.01 8.88 0.20 -1.25 -4.46 118.68 125.04 1yho s LEU 131 Ca 0.75 -0.09 0.01 0.00 0.69 0.00 0.00 54.13 55.48 1yho s LEU 131 Cb -0.48 0.60 -0.04 0.00 -0.43 0.00 0.00 46.19 45.84 1yho s LEU 131 CO 0.32 -0.29 0.05 -0.54 -0.29 0.00 0.00 176.35 175.61 1yho s LYS 132 N -1.02 2.92 -0.06 1.98 3.01 -0.77 -1.98 119.74 123.83 1yho s LYS 132 Ca -0.11 -0.57 -0.01 0.00 -1.01 0.00 0.00 55.97 54.27 1yho s LYS 132 Cb -0.06 -2.76 0.03 0.00 -1.01 0.00 0.00 37.83 34.02 1yho s LYS 132 CO 0.01 0.63 0.02 -1.17 0.51 0.00 0.00 175.35 175.34 1yho s LEU 133 N -1.77 0.48 -0.31 3.17 0.20 0.55 -0.94 118.68 120.06 1yho s LEU 133 Ca 0.22 -0.04 -0.07 0.00 0.69 0.00 0.00 54.13 54.94 1yho s LEU 133 Cb -0.12 -0.35 0.02 0.00 -0.43 0.00 0.00 46.19 45.31 1yho s LEU 133 CO 0.14 -0.21 0.09 -0.36 -0.29 0.00 0.00 176.35 175.72 1yho s PHE 134 N 2.00 3.18 -0.15 5.38 0.40 0.26 0.10 117.98 129.15 1yho s PHE 134 Ca 0.05 -1.11 -0.01 0.00 -0.60 0.00 0.00 56.93 55.26 1yho s PHE 134 Cb -0.12 -2.27 -0.01 0.00 0.51 0.00 0.00 43.02 41.13 1yho s PHE 134 CO -0.04 -0.62 -0.13 0.08 0.70 0.00 0.00 175.22 175.20 1yho s VAL 135 N 1.47 2.92 -0.30 -0.44 1.01 -0.39 -0.59 120.40 124.08 1yho s VAL 135 Ca 0.01 -0.69 -0.11 0.00 0.00 0.00 0.00 61.98 61.20 1yho s VAL 135 Cb -0.18 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 1yho s VAL 135 CO 0.03 0.51 0.18 -0.89 0.00 0.00 0.00 175.10 174.93 1yho s THR 136 N 0.73 5.01 -0.32 3.92 2.01 -0.86 -0.19 115.64 125.94 1yho s THR 136 Ca -0.06 -0.14 -0.18 0.00 0.31 0.00 0.00 61.69 61.62 1yho s THR 136 Cb -0.15 -3.49 -0.01 0.00 0.01 0.00 0.00 72.50 68.86 1yho s THR 136 CO 0.02 0.13 0.52 -0.60 -0.69 0.00 0.00 174.62 173.99 1yho s ARG 137 N 1.70 3.80 -0.25 4.92 3.52 0.00 0.67 118.95 133.30 1yho s ARG 137 Ca 0.06 0.03 -0.09 0.00 -0.13 0.00 0.00 55.73 55.59 1yho s ARG 137 Cb -0.17 -3.75 -0.04 0.00 -1.56 0.00 0.00 34.95 29.43 1yho s ARG 137 CO 0.09 -0.54 0.14 0.42 -0.81 0.00 0.00 175.30 174.60 1yho s ILE 138 N 2.38 4.99 -1.29 4.11 1.01 -0.01 0.37 121.20 132.76 1yho s ILE 138 Ca 0.20 0.06 -0.16 0.00 0.00 0.00 0.00 60.65 60.74 1yho s ILE 138 Cb -0.15 -3.34 0.10 0.00 0.01 0.00 0.00 42.46 39.08 1yho s ILE 138 CO 0.12 0.32 1.70 0.23 0.00 0.00 0.00 174.94 177.31 1yho n MET 139 N 4.66 3.24 -3.63 2.79 2.81 -0.29 0.52 117.12 127.22 1yho n MET 139 Ca -0.15 -3.40 -0.13 0.00 -1.81 0.00 0.00 57.70 52.22 1yho n MET 139 Cb 0.52 -3.32 -0.07 0.00 -0.71 0.00 0.00 33.22 29.64 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 3.18 0.80 -0.18 0.03 -1.52 -1.26 -4.45 119.66 116.27 1yho s GLN 140 Ca 0.49 1.01 -0.29 0.00 -1.95 0.00 0.00 55.36 54.62 1yho s GLN 140 Cb 0.03 0.37 -0.01 0.00 -0.22 0.00 0.00 33.01 33.18 1yho s GLN 140 CO 0.04 -0.10 1.25 0.34 -0.25 0.00 0.00 175.29 176.57 1yho s ASP 141 N 0.54 6.94 -0.16 5.90 -1.08 -1.26 -3.97 116.67 123.58 1yho s ASP 141 Ca -0.01 1.64 -0.11 0.00 -0.52 0.00 0.00 52.55 53.55 1yho s ASP 141 Cb -0.05 -2.54 0.05 0.00 -1.46 0.00 0.00 42.92 38.92 1yho s ASP 141 CO -0.02 -0.78 0.39 -0.36 0.52 0.00 0.00 175.17 174.92 1yho s PHE 142 N 3.54 -0.51 0.25 -5.34 0.08 -1.26 -5.08 117.98 109.66 1yho s PHE 142 Ca 0.54 1.15 -0.30 0.00 0.12 0.00 0.00 56.93 58.45 1yho s PHE 142 Cb -0.21 0.20 -0.09 0.00 -0.57 0.00 0.00 43.02 42.35 1yho s PHE 142 CO 0.15 -0.28 1.19 -2.00 -0.10 0.00 0.00 175.22 174.18 1yho s GLU 143 N 0.90 4.52 0.03 0.44 2.56 -1.26 -4.86 118.70 121.03 1yho s GLU 143 Ca -0.06 1.92 0.00 0.00 0.00 0.00 0.00 54.97 56.84 1yho s GLU 143 Cb -0.06 -3.19 -0.03 0.00 2.00 0.00 0.00 34.13 32.85 1yho s GLU 143 CO -0.07 -0.01 -0.04 -1.12 -0.56 0.00 0.00 175.26 173.47 1yho s SER 144 N -0.34 0.37 -0.15 -1.70 0.01 -1.26 -4.74 113.70 105.90 1yho s SER 144 Ca 0.49 -0.63 0.13 0.00 1.31 0.00 0.00 55.95 57.26 1yho s SER 144 Cb -0.34 0.12 -0.24 0.00 0.21 0.00 0.00 66.02 65.77 1yho s SER 144 CO 0.41 -0.36 0.26 -0.67 0.41 0.00 0.00 173.24 173.29 1yho n ASP 145 N 1.22 0.59 -4.37 2.44 -0.08 -1.24 -4.90 116.55 110.21 1yho n ASP 145 Ca -0.21 0.14 -0.33 0.00 -1.51 0.00 0.00 54.79 52.87 1yho n ASP 145 Cb 0.56 0.41 -0.14 0.00 2.34 0.00 0.00 41.12 44.29 1yho n ASP 145 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1yho s THR 146 N -2.53 3.14 0.03 5.18 2.01 -1.23 -5.08 115.64 117.16 1yho s THR 146 Ca -0.11 -0.62 0.05 0.00 0.31 0.00 0.00 61.69 61.31 1yho s THR 146 Cb 0.07 -2.33 -0.04 0.00 0.01 0.00 0.00 72.50 70.21 1yho s THR 146 CO 0.80 0.51 -0.08 -0.36 -0.69 0.00 0.00 174.62 174.81 1yho s PHE 147 N 0.45 2.83 -0.07 4.92 0.08 -1.26 -2.62 117.98 122.31 1yho s PHE 147 Ca -0.09 -0.09 -0.20 0.00 0.12 0.00 0.00 56.93 56.67 1yho s PHE 147 Cb -0.16 -1.55 -0.04 0.00 -0.57 0.00 0.00 43.02 40.70 1yho s PHE 147 CO 0.04 0.38 0.58 0.12 -0.10 0.00 0.00 175.22 176.24 1yho s PHE 148 N -1.05 3.57 0.54 0.36 2.19 -0.20 -5.00 117.98 118.39 1yho s PHE 148 Ca 0.18 1.08 -0.20 0.00 0.33 0.00 0.00 56.93 58.33 1yho s PHE 148 Cb -0.11 -2.64 -0.06 0.00 -1.31 0.00 0.00 43.02 38.89 1yho s PHE 148 CO 0.09 0.19 1.12 -1.25 1.83 0.00 0.00 175.22 177.20 1yho s PRO 149 N 0.48 3.40 -0.42 10.12 0.04 -1.26 -4.94 135.00 142.42 1yho s PRO 149 Ca 0.31 1.59 -0.28 0.00 0.04 0.00 0.00 61.00 62.66 1yho s PRO 149 Cb -0.17 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.34 1yho s PRO 149 CO 0.14 -0.81 1.78 -2.00 0.04 0.00 0.00 177.00 176.16 1yho s GLU 150 N -3.28 3.15 0.29 4.56 2.12 -1.26 -4.95 118.70 119.32 1yho s GLU 150 Ca 0.72 1.15 -0.29 0.00 0.36 0.00 0.00 54.97 56.90 1yho s GLU 150 Cb -0.23 -4.24 -0.10 0.00 0.26 0.00 0.00 34.13 29.82 1yho s GLU 150 CO 0.26 -2.09 1.40 0.42 -0.54 0.00 0.00 175.26 174.72 1yho s ILE 151 N 7.41 2.62 0.29 -3.70 1.01 -1.26 -4.96 121.20 122.60 1yho s ILE 151 Ca 0.74 0.56 -0.29 0.00 0.00 0.00 0.00 60.65 61.66 1yho s ILE 151 Cb -0.19 -3.36 -0.10 0.00 0.01 0.00 0.00 42.46 38.83 1yho s ILE 151 CO 0.30 0.11 1.23 -1.81 0.00 0.00 0.00 174.94 174.76 1yho s ASP 152 N 0.05 6.98 0.31 3.58 1.01 -1.26 -4.93 116.67 122.40 1yho s ASP 152 Ca 0.55 2.48 0.17 0.00 0.71 0.00 0.00 52.55 56.46 1yho s ASP 152 Cb -0.42 -2.63 0.14 0.00 1.01 0.00 0.00 42.92 41.02 1yho s ASP 152 CO 0.48 -0.38 1.48 0.25 0.21 0.00 0.00 175.17 177.21 1yho h LEU 153 N 3.89 0.00 -1.51 1.23 7.12 -1.94 -1.20 115.31 122.90 1yho h LEU 153 Ca -0.47 0.00 -0.04 0.00 0.13 0.00 0.00 57.88 57.49 1yho h LEU 153 Cb 1.22 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.34 1yho h LEU 153 CO 0.68 0.41 -0.15 -0.08 -0.13 0.00 0.00 178.44 179.17 1yho h GLU 154 N 0.00 0.13 0.00 1.25 4.81 -2.01 -3.21 114.58 115.55 1yho h GLU 154 Ca -0.00 -0.03 -0.37 0.00 -0.13 0.00 0.00 59.36 58.83 1yho h GLU 154 Cb 1.30 -0.02 -0.07 0.00 0.63 0.00 0.00 28.75 30.60 1yho h GLU 154 CO 0.05 0.29 -2.39 1.17 -0.73 0.00 0.00 179.01 177.40 1yho n LYS 155 N -4.30 0.65 -4.26 1.92 3.00 -1.22 -4.97 118.16 108.98 1yho n LYS 155 Ca -0.01 0.12 -0.32 0.00 -0.00 0.00 0.00 58.31 58.10 1yho n LYS 155 Cb 0.25 -1.49 -0.09 0.00 0.00 0.00 0.00 35.03 33.70 1yho n LYS 155 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1yho s TYR 156 N -2.49 3.00 -0.13 5.64 1.51 -0.46 -2.17 117.35 122.27 1yho s TYR 156 Ca -0.30 0.02 -0.03 0.00 -1.01 0.00 0.00 57.07 55.75 1yho s TYR 156 Cb 0.08 -1.61 -0.03 0.00 -0.11 0.00 0.00 41.96 40.29 1yho s TYR 156 CO 0.60 0.45 -0.01 0.15 -1.11 0.00 0.00 175.55 175.63 1yho s LYS 157 N -1.81 3.38 -0.44 -0.62 1.02 0.21 -4.06 119.74 117.42 1yho s LYS 157 Ca 0.21 -0.45 -0.25 0.00 0.02 0.00 0.00 55.97 55.50 1yho s LYS 157 Cb -0.11 -2.88 0.02 0.00 -0.52 0.00 0.00 37.83 34.33 1yho s LYS 157 CO 0.13 0.46 0.89 -0.51 -0.92 0.00 0.00 175.35 175.40 1yho s LEU 158 N -0.22 4.05 -0.68 3.17 1.43 -1.26 -1.75 118.68 123.42 1yho s LEU 158 Ca 0.05 0.18 -0.07 0.00 -1.03 0.00 0.00 54.13 53.26 1yho s LEU 158 Cb -0.13 -3.15 0.18 0.00 0.03 0.00 0.00 46.19 43.12 1yho s LEU 158 CO 0.02 -0.97 0.54 -0.76 0.23 0.00 0.00 176.35 175.41 1yho s LEU 159 N 3.58 5.73 0.15 1.79 2.01 0.25 -4.92 118.68 127.27 1yho s LEU 159 Ca 0.36 -2.77 -0.09 0.00 0.01 0.00 0.00 54.13 51.64 1yho s LEU 159 Cb -0.11 -1.97 -0.02 0.00 0.01 0.00 0.00 46.19 44.10 1yho s LEU 159 CO 0.24 -0.45 1.46 1.55 1.01 0.00 0.00 176.35 180.16 1yho h PRO 160 N 7.32 0.83 -4.60 1.29 0.13 -1.92 -1.65 132.00 133.40 1yho h PRO 160 Ca 0.01 -0.48 -0.69 0.00 -0.87 0.00 0.00 66.00 63.97 1yho h PRO 160 Cb 0.98 0.04 -0.32 0.00 0.13 0.00 0.00 31.00 31.84 1yho h PRO 160 CO 0.73 1.12 -0.59 -2.00 -0.23 0.00 0.00 178.00 177.03 1yho s GLU 161 N -4.21 2.33 -0.02 0.86 -6.30 -1.26 -4.79 118.70 105.31 1yho s GLU 161 Ca -0.10 -1.49 0.06 0.00 -2.50 0.00 0.00 54.97 50.95 1yho s GLU 161 Cb 0.11 -3.47 -0.01 0.00 0.00 0.00 0.00 34.13 30.75 1yho s GLU 161 CO 0.88 -0.85 -0.22 -0.47 0.02 0.00 0.00 175.26 174.62 1yho s TYR 162 N 1.26 2.01 0.33 5.30 5.04 -1.26 -5.10 117.35 124.93 1yho s TYR 162 Ca 0.02 -0.43 -0.29 0.00 -2.44 0.00 0.00 57.07 53.93 1yho s TYR 162 Cb -0.21 -1.30 -0.11 0.00 0.35 0.00 0.00 41.96 40.69 1yho s TYR 162 CO -0.01 -0.07 1.43 -1.25 -1.34 0.00 0.00 175.55 174.31 1yho s PRO 163 N -0.42 4.22 0.00 4.97 0.04 -1.26 -2.65 135.00 139.91 1yho s PRO 163 Ca 0.06 2.40 0.00 0.00 0.04 0.00 0.00 61.00 63.50 1yho s PRO 163 Cb -0.09 -3.03 0.00 0.00 0.04 0.00 0.00 34.50 31.41 1yho s PRO 163 CO -0.00 -0.40 0.00 0.41 0.04 0.00 0.00 177.00 177.05 1yho n GLY 164 N 1.03 3.00 3.44 0.56 0.00 -1.26 -5.01 105.19 106.94 1yho n GLY 164 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 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 -2.42 3.31 0.20 1.61 0.11 -1.08 -5.09 120.40 117.04 1yho s VAL 165 Ca 0.00 -0.58 -0.30 0.00 -2.93 0.00 0.00 61.98 58.17 1yho s VAL 165 Cb 0.00 -2.39 -0.09 0.00 -1.53 0.00 0.00 36.38 32.37 1yho s VAL 165 CO 0.00 0.53 1.33 -0.76 -3.33 0.00 0.00 175.10 172.87 1yho s LEU 166 N 0.10 4.41 0.03 2.54 1.43 -1.26 -4.51 118.68 121.42 1yho s LEU 166 Ca -0.04 2.42 0.10 0.00 -1.03 0.00 0.00 54.13 55.58 1yho s LEU 166 Cb -0.14 -3.61 -0.22 0.00 0.03 0.00 0.00 46.19 42.25 1yho s LEU 166 CO 0.04 -0.55 0.93 0.28 0.23 0.00 0.00 176.35 177.28 1yho h SER 167 N 5.43 0.00 -3.76 2.29 0.02 -1.90 -3.41 113.55 112.23 1yho h SER 167 Ca -0.45 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 59.98 1yho h SER 167 Cb 1.21 0.00 0.08 0.00 0.14 0.00 0.00 62.40 63.83 1yho h SER 167 CO 0.78 0.99 0.72 -0.62 -1.14 0.00 0.00 176.83 177.55 1yho s ASP 168 N -6.34 6.61 0.01 3.07 2.15 -1.26 -4.72 116.67 116.19 1yho s ASP 168 Ca -0.02 2.79 -0.30 0.00 0.43 0.00 0.00 52.55 55.45 1yho s ASP 168 Cb 0.09 -2.65 -0.07 0.00 -0.30 0.00 0.00 42.92 39.99 1yho s ASP 168 CO 0.82 -0.68 1.60 -0.69 -0.17 0.00 0.00 175.17 176.06 1yho s VAL 169 N -0.82 3.36 0.54 1.11 1.01 -1.26 -4.84 120.40 119.49 1yho s VAL 169 Ca 0.53 0.68 -0.07 0.00 0.00 0.00 0.00 61.98 63.12 1yho s VAL 169 Cb -0.42 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 1yho s VAL 169 CO 0.53 -0.02 0.88 -1.10 0.00 0.00 0.00 175.10 175.39 1yho s GLN 170 N 3.09 3.54 -0.07 2.72 1.11 -0.50 -4.85 119.66 124.70 1yho s GLN 170 Ca 0.72 0.40 -0.00 0.00 0.01 0.00 0.00 55.36 56.48 1yho s GLN 170 Cb -0.36 -2.26 0.03 0.00 -1.01 0.00 0.00 33.01 29.41 1yho s GLN 170 CO 0.30 -0.36 -0.03 -2.00 0.01 0.00 0.00 175.29 173.21 1yho s GLU 171 N -4.92 0.81 -0.06 2.91 2.12 -1.26 -2.03 118.70 116.28 1yho s GLU 171 Ca 0.50 -0.02 -0.02 0.00 0.36 0.00 0.00 54.97 55.79 1yho s GLU 171 Cb -0.11 -1.00 0.04 0.00 0.26 0.00 0.00 34.13 33.32 1yho s GLU 171 CO 0.48 -0.21 0.12 -2.00 -0.54 0.00 0.00 175.26 173.11 1yho s GLU 172 N 1.54 0.03 -1.69 4.30 2.56 -0.21 -4.84 118.70 120.38 1yho s GLU 172 Ca -0.01 0.39 -0.00 0.00 0.00 0.00 0.00 54.97 55.34 1yho s GLU 172 Cb -0.13 -0.25 0.00 0.00 2.00 0.00 0.00 34.13 35.75 1yho s GLU 172 CO -0.04 -0.22 0.04 1.17 -0.56 0.00 0.00 175.26 175.65 1yho n LYS 173 N 4.61 -1.95 -1.03 4.30 4.81 -1.26 -0.92 118.16 126.71 1yho n LYS 173 Ca -0.19 0.96 -0.01 0.00 -0.87 0.00 0.00 58.31 58.20 1yho n LYS 173 Cb 0.51 -5.63 -0.00 0.00 0.02 0.00 0.00 35.03 29.92 1yho n LYS 173 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1yho n GLY 174 N -1.03 0.48 3.26 3.14 0.00 -1.26 -5.03 105.19 104.76 1yho n GLY 174 Ca -0.23 -0.79 -0.33 0.00 0.00 0.00 0.00 46.02 44.67 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 -2.03 2.63 -0.12 -0.61 1.01 -0.10 -5.11 121.20 116.87 1yho s ILE 175 Ca 0.00 -0.78 -0.05 0.00 0.00 0.00 0.00 60.65 59.82 1yho s ILE 175 Cb 0.00 -2.11 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 1yho s ILE 175 CO 0.00 0.52 0.06 -0.54 0.00 0.00 0.00 174.94 174.98 1yho s LYS 176 N 0.78 3.40 0.07 2.79 1.02 -1.26 -1.05 119.74 125.50 1yho s LYS 176 Ca -0.06 -0.31 -0.18 0.00 0.02 0.00 0.00 55.97 55.44 1yho s LYS 176 Cb -0.15 -3.03 0.04 0.00 -0.52 0.00 0.00 37.83 34.17 1yho s LYS 176 CO 0.00 0.61 0.43 1.52 -0.92 0.00 0.00 175.35 176.99 1yho s TYR 177 N -0.58 -0.28 0.17 3.18 1.13 -0.86 -1.13 117.35 118.98 1yho s TYR 177 Ca 0.11 0.16 0.08 0.00 -1.41 0.00 0.00 57.07 56.01 1yho s TYR 177 Cb -0.12 0.26 -0.04 0.00 -1.10 0.00 0.00 41.96 40.96 1yho s TYR 177 CO 0.02 -0.63 -0.17 0.21 -2.51 0.00 0.00 175.55 172.47 1yho s LYS 178 N -2.93 1.27 -0.23 -3.49 2.20 0.16 -1.40 119.74 115.32 1yho s LYS 178 Ca -0.02 -1.43 -0.09 0.00 -0.36 0.00 0.00 55.97 54.06 1yho s LYS 178 Cb 0.00 -1.27 -0.04 0.00 -1.51 0.00 0.00 37.83 35.01 1yho s LYS 178 CO -0.06 0.25 0.12 -0.06 -0.36 0.00 0.00 175.35 175.24 1yho s PHE 179 N -2.23 3.24 -0.02 4.03 0.08 -1.26 -0.82 117.98 121.00 1yho s PHE 179 Ca 0.17 0.05 0.04 0.00 0.12 0.00 0.00 56.93 57.31 1yho s PHE 179 Cb -0.05 -2.23 -0.03 0.00 -0.57 0.00 0.00 43.02 40.15 1yho s PHE 179 CO 0.07 -0.02 -0.13 -2.00 -0.10 0.00 0.00 175.22 173.04 1yho s GLU 180 N 1.07 2.45 -0.12 0.44 2.56 0.73 -4.90 118.70 120.93 1yho s GLU 180 Ca 0.06 -0.75 0.01 0.00 0.00 0.00 0.00 54.97 54.29 1yho s GLU 180 Cb -0.14 -2.39 -0.01 0.00 2.00 0.00 0.00 34.13 33.59 1yho s GLU 180 CO 0.04 0.61 -0.15 0.08 -0.56 0.00 0.00 175.26 175.28 1yho s VAL 181 N -0.84 2.93 -0.07 3.70 1.01 -0.62 -1.27 120.40 125.25 1yho s VAL 181 Ca 0.13 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.45 1yho s VAL 181 Cb -0.11 -2.21 -0.00 0.00 0.00 0.00 0.00 36.38 34.06 1yho s VAL 181 CO 0.03 0.54 -0.21 -0.31 0.00 0.00 0.00 175.10 175.15 1yho s TYR 182 N 0.20 2.19 -0.09 5.22 2.02 0.29 0.84 117.35 128.03 1yho s TYR 182 Ca -0.09 -0.77 0.04 0.00 -0.37 0.00 0.00 57.07 55.89 1yho s TYR 182 Cb -0.15 -1.47 -0.00 0.00 -0.40 0.00 0.00 41.96 39.93 1yho s TYR 182 CO 0.05 -0.29 -0.23 -1.21 -1.57 0.00 0.00 175.55 172.31 1yho s GLU 183 N 0.18 2.78 -0.26 -0.62 2.02 -0.72 -0.33 118.70 121.75 1yho s GLU 183 Ca -0.11 -0.83 -0.10 0.00 0.02 0.00 0.00 54.97 53.95 1yho s GLU 183 Cb -0.15 -2.16 -0.05 0.00 0.10 0.00 0.00 34.13 31.87 1yho s GLU 183 CO 0.05 0.21 0.16 0.21 0.02 0.00 0.00 175.26 175.91 1yho s LYS 184 N 0.25 3.96 0.06 1.61 2.20 -0.84 0.66 119.74 127.65 1yho s LYS 184 Ca -0.15 -0.32 -0.11 0.00 -0.36 0.00 0.00 55.97 55.02 1yho s LYS 184 Cb -0.17 -3.56 -0.06 0.00 -1.51 0.00 0.00 37.83 32.54 1yho s LYS 184 CO 0.07 -0.08 0.41 1.21 -0.36 0.00 0.00 175.35 176.60 1yho s ASN 185 N 1.44 6.70 0.00 1.43 2.47 -0.92 -3.78 114.94 122.27 1yho s ASN 185 Ca 0.07 0.86 0.20 0.00 0.42 0.00 0.00 52.86 54.40 1yho s ASN 185 Cb -0.15 -2.20 1.18 0.00 -1.45 0.00 0.00 41.25 38.62 1yho s ASN 185 CO 0.07 0.21 1.56 -0.67 -3.72 0.00 0.00 177.10 174.56