#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 3.31 7.55 0.00 -1.26 -4.99 105.19 110.16 1yho n GLY 2 Ca 0.00 -0.40 -0.39 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.59 5.47 -0.23 1.61 0.01 -1.26 -4.87 113.70 111.84 1yho s SER 3 Ca 0.00 -1.11 -0.05 0.00 1.31 0.00 0.00 55.95 56.10 1yho s SER 3 Cb 0.00 -1.93 -0.01 0.00 0.21 0.00 0.00 66.02 64.29 1yho s SER 3 CO 0.00 -0.36 -0.00 -0.76 0.41 0.00 0.00 173.24 172.53 1yho s LEU 4 N 1.45 3.12 -0.17 2.44 1.02 -1.26 -1.91 118.68 123.37 1yho s LEU 4 Ca -0.00 -0.36 0.01 0.00 0.02 0.00 0.00 54.13 53.80 1yho s LEU 4 Cb -0.19 -1.80 0.02 0.00 0.02 0.00 0.00 46.19 44.23 1yho s LEU 4 CO 0.04 -0.04 -0.20 0.20 0.02 0.00 0.00 176.35 176.38 1yho s ASN 5 N 1.52 3.07 0.01 2.29 0.01 -0.58 -1.07 114.94 120.18 1yho s ASN 5 Ca 0.06 -0.62 -0.01 0.00 -0.71 0.00 0.00 52.86 51.58 1yho s ASN 5 Cb -0.15 -1.43 -0.04 0.00 0.41 0.00 0.00 41.25 40.04 1yho s ASN 5 CO -0.01 0.01 0.12 0.00 -1.51 0.00 0.00 177.10 175.71 1yho s ILE 7 N -1.28 -0.67 0.03 0.00 2.07 -0.84 0.10 121.20 120.60 1yho s ILE 7 Ca 0.26 0.11 -0.11 0.00 -1.41 0.00 0.00 60.65 59.51 1yho s ILE 7 Cb -0.12 -0.72 0.01 0.00 0.13 0.00 0.00 42.46 41.76 1yho s ILE 7 CO 0.17 0.03 0.22 0.68 -1.91 0.00 0.00 174.94 174.14 1yho s VAL 8 N 2.62 0.09 0.10 4.00 -7.23 0.13 -4.56 120.40 115.56 1yho s VAL 8 Ca 0.01 -0.76 0.03 0.00 -1.81 0.00 0.00 61.98 59.45 1yho s VAL 8 Cb -0.13 -0.79 -0.04 0.00 0.56 0.00 0.00 36.38 35.99 1yho s VAL 8 CO -0.14 -0.42 0.15 0.00 -0.31 0.00 0.00 175.10 174.39 1yho s ALA 9 N -2.16 3.73 -0.04 1.32 0.00 -1.26 -1.73 121.76 121.62 1yho s ALA 9 Ca -0.08 -1.02 -0.08 0.00 0.00 0.00 0.00 51.96 50.77 1yho s ALA 9 Cb -0.03 -1.56 0.01 0.00 0.00 0.00 0.00 23.12 21.55 1yho s ALA 9 CO -0.02 0.68 0.20 0.14 0.00 0.00 0.00 175.76 176.77 1yho s VAL 10 N -1.55 0.04 0.74 0.00 -7.23 0.23 -4.76 120.40 107.87 1yho s VAL 10 Ca 0.32 -0.31 -0.12 0.00 -1.81 0.00 0.00 61.98 60.06 1yho s VAL 10 Cb -0.12 -0.39 0.04 0.00 0.56 0.00 0.00 36.38 36.47 1yho s VAL 10 CO 0.25 -0.17 1.11 -0.44 -0.31 0.00 0.00 175.10 175.54 1yho s SER 11 N -0.62 5.08 0.63 4.85 0.01 0.19 -1.05 113.70 122.80 1yho s SER 11 Ca -0.07 1.09 0.37 0.00 1.31 0.00 0.00 55.95 58.64 1yho s SER 11 Cb -0.04 -1.82 2.09 0.00 0.21 0.00 0.00 66.02 66.46 1yho s SER 11 CO 0.01 -1.57 2.28 -0.61 0.41 0.00 0.00 173.24 173.77 1yho h GLN 12 N -0.82 0.00 -0.76 12.44 4.15 -1.36 0.21 115.11 128.96 1yho h GLN 12 Ca -0.46 0.00 -0.11 0.00 0.77 0.00 0.00 58.65 58.85 1yho h GLN 12 Cb 1.27 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 28.89 1yho h GLN 12 CO 0.63 0.00 0.15 -1.71 -1.93 0.00 0.00 178.83 175.97 1yho n ASN 13 N -3.45 4.44 -3.38 -0.69 5.15 -1.26 -4.89 115.26 111.18 1yho n ASN 13 Ca -0.03 -2.89 -0.23 0.00 -0.60 0.00 0.00 54.58 50.83 1yho n ASN 13 Cb 0.11 -0.68 0.06 0.00 -0.53 0.00 0.00 39.78 38.74 1yho n ASN 13 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 1yho n MET 14 N 0.13 -6.92 -4.03 1.20 2.81 0.06 -4.94 117.12 105.44 1yho n MET 14 Ca 0.29 0.85 -0.29 0.00 -1.81 0.00 0.00 57.70 56.75 1yho n MET 14 Cb 1.12 -5.83 -0.05 0.00 -0.71 0.00 0.00 33.22 27.75 1yho n MET 14 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1yho s GLY 15 N -3.11 1.91 -0.05 3.03 0.00 -1.24 -1.08 107.32 106.77 1yho s GLY 15 Ca 0.49 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 44.15 1yho s GLY 15 CO 0.61 -1.05 -0.05 0.29 0.00 0.00 0.00 173.10 172.90 1yho n ILE 16 N 0.05 0.29 0.00 0.90 -5.35 -1.13 -0.63 119.36 113.49 1yho n ILE 16 Ca -0.08 -0.11 0.00 0.00 -0.27 0.00 0.00 62.75 62.29 1yho n ILE 16 Cb 0.53 -0.72 0.00 0.00 -1.74 0.00 0.00 39.64 37.71 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 3.23 1.72 3.07 3.28 0.00 -1.26 -4.24 105.19 110.99 1yho n GLY 17 Ca -0.09 -0.81 -0.26 0.00 0.00 0.00 0.00 46.02 44.86 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 1.89 -1.59 1.61 -2.85 0.23 -3.04 119.74 113.98 1yho s LYS 18 Ca 0.00 -0.51 0.00 0.00 -1.00 0.00 0.00 55.97 54.46 1yho s LYS 18 Cb 0.00 -1.54 0.00 0.00 -2.06 0.00 0.00 37.83 34.23 1yho s LYS 18 CO 0.00 0.08 0.00 0.09 0.10 0.00 0.00 175.35 175.62 1yho n ASN 19 N 3.67 -5.22 -0.02 0.03 3.02 -1.26 -1.76 115.26 113.72 1yho n ASN 19 Ca -0.22 0.05 -0.00 0.00 -0.03 0.00 0.00 54.58 54.39 1yho n ASN 19 Cb 0.52 -4.29 -0.00 0.00 -0.61 0.00 0.00 39.78 35.40 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 -0.98 0.39 3.08 7.41 0.00 -1.26 -5.05 105.19 108.78 1yho n GLY 20 Ca -0.21 -1.05 -0.16 0.00 0.00 0.00 0.00 46.02 44.60 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 -3.00 1.12 0.49 1.61 2.15 -0.72 -4.92 116.67 113.39 1yho s ASP 21 Ca 0.00 -0.46 -0.23 0.00 0.43 0.00 0.00 52.55 52.30 1yho s ASP 21 Cb 0.00 -0.03 -0.06 0.00 -0.30 0.00 0.00 42.92 42.53 1yho s ASP 21 CO 0.00 -0.08 1.25 -0.76 -0.17 0.00 0.00 175.17 175.41 1yho s LEU 22 N -1.24 3.97 0.28 -1.34 1.43 -1.26 0.74 118.68 121.26 1yho s LEU 22 Ca -0.04 2.52 0.00 0.00 -1.03 0.00 0.00 54.13 55.58 1yho s LEU 22 Cb -0.08 -4.22 0.51 0.00 0.03 0.00 0.00 46.19 42.43 1yho s LEU 22 CO 0.01 -1.17 1.86 -0.65 0.23 0.00 0.00 176.35 176.63 1yho h PRO 23 N 1.88 1.03 -5.97 1.29 0.11 -1.89 -3.42 132.00 125.03 1yho h PRO 23 Ca -0.50 -0.06 -0.61 0.00 0.11 0.00 0.00 66.00 64.93 1yho h PRO 23 Cb 1.27 -0.23 -0.05 0.00 0.11 0.00 0.00 31.00 32.10 1yho h PRO 23 CO 0.59 0.68 -0.34 1.67 -0.21 0.00 0.00 178.00 180.39 1yho s TRP 24 N -5.98 3.58 1.15 0.65 -2.14 -1.26 -4.88 118.94 110.07 1yho s TRP 24 Ca -0.12 0.64 -0.18 0.00 2.66 0.00 0.00 56.10 59.10 1yho s TRP 24 Cb 0.21 -2.04 0.17 0.00 -3.10 0.00 0.00 33.47 28.71 1yho s TRP 24 CO 0.81 0.58 0.26 -2.30 -2.66 0.00 0.00 176.95 173.64 1yho n PRO 25 N 1.05 -2.15 -1.69 3.25 -0.02 -1.26 -4.79 135.00 129.39 1yho n PRO 25 Ca -0.10 -0.62 -0.51 0.00 -2.02 0.00 0.00 63.50 60.25 1yho n PRO 25 Cb 0.53 -1.75 -0.05 0.00 -0.02 0.00 0.00 33.50 32.20 1yho n PRO 25 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1yho n PRO 26 N -2.78 1.86 -3.77 0.52 -0.02 -1.26 -4.95 135.00 124.61 1yho n PRO 26 Ca 0.02 0.68 -0.36 0.00 -2.02 0.00 0.00 63.50 61.82 1yho n PRO 26 Cb 0.57 -2.48 -0.12 0.00 -0.02 0.00 0.00 33.50 31.45 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 3.92 3.56 0.16 2.45 2.96 -1.26 -4.98 118.68 125.50 1yho s LEU 27 Ca 0.95 -0.15 -0.08 0.00 -0.22 0.00 0.00 54.13 54.63 1yho s LEU 27 Cb -0.81 -1.96 0.03 0.00 0.50 0.00 0.00 46.19 43.95 1yho s LEU 27 CO 0.56 -0.01 1.49 -0.09 -1.32 0.00 0.00 176.35 176.97 1yho h ARG 28 N 8.08 0.78 -0.32 1.98 2.43 -1.97 -2.13 114.38 123.22 1yho h ARG 28 Ca -0.37 -0.44 -0.11 0.00 -0.81 0.00 0.00 59.98 58.24 1yho h ARG 28 Cb 1.18 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 1yho h ARG 28 CO 0.59 1.07 -0.24 -0.97 -1.51 0.00 0.00 179.97 178.91 1yho h ASN 29 N 0.62 0.77 -0.52 -3.80 -1.24 -1.97 -1.18 115.58 108.26 1yho h ASN 29 Ca 0.04 -0.44 -0.03 0.00 0.71 0.00 0.00 56.30 56.57 1yho h ASN 29 Cb 1.03 -0.21 -0.02 0.00 0.73 0.00 0.00 38.32 39.84 1yho h ASN 29 CO 0.10 1.05 0.21 -0.08 -1.29 0.00 0.00 177.43 177.42 1yho h GLU 30 N 0.49 0.78 -0.02 6.67 4.57 -1.97 0.23 114.58 125.33 1yho h GLU 30 Ca 0.06 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.10 1yho h GLU 30 Cb 0.80 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.26 1yho h GLU 30 CO 0.06 0.68 0.00 0.74 -1.18 0.00 0.00 179.01 179.32 1yho h PHE 31 N 0.70 0.03 -0.39 0.92 -1.00 -1.36 -0.62 116.94 115.23 1yho h PHE 31 Ca 0.17 -0.01 -0.05 0.00 2.81 0.00 0.00 57.97 60.90 1yho h PHE 31 Cb 0.19 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 39.73 1yho h PHE 31 CO 0.01 0.33 0.04 -0.09 -1.61 0.00 0.00 178.31 176.99 1yho h ARG 32 N -0.28 0.59 -0.14 1.51 2.43 -1.14 -1.28 114.38 116.07 1yho h ARG 32 Ca 0.00 -0.12 -0.14 0.00 -0.81 0.00 0.00 59.98 58.91 1yho h ARG 32 Cb 0.32 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 1yho h ARG 32 CO 0.00 0.58 -0.52 -0.92 -1.51 0.00 0.00 179.97 177.60 1yho h TYR 33 N 0.57 0.48 -0.19 2.20 3.20 -0.42 -0.94 116.97 121.87 1yho h TYR 33 Ca 0.13 -0.16 -0.20 0.00 3.14 0.00 0.00 58.73 61.63 1yho h TYR 33 Cb 0.30 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1yho h TYR 33 CO 0.01 0.83 -0.66 0.35 -1.64 0.00 0.00 178.16 177.05 1yho h PHE 34 N 0.31 0.96 -0.01 -3.82 3.04 -0.60 -2.02 116.94 114.79 1yho h PHE 34 Ca 0.01 -0.38 -0.01 0.00 3.98 0.00 0.00 57.97 61.56 1yho h PHE 34 Cb 1.02 -0.16 0.00 0.00 2.56 0.00 0.00 35.95 39.37 1yho h PHE 34 CO 0.03 1.19 -0.04 1.96 -2.02 0.00 0.00 178.31 179.44 1yho h GLN 35 N 0.53 0.05 -0.77 1.11 4.20 -1.20 -2.40 115.11 116.64 1yho h GLN 35 Ca -0.02 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.67 1yho h GLN 35 Cb 1.26 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 29.01 1yho h GLN 35 CO 0.13 0.64 0.51 0.07 -0.67 0.00 0.00 178.83 179.51 1yho h ARG 36 N -0.54 1.01 0.09 1.46 -0.00 -1.25 0.17 114.38 115.32 1yho h ARG 36 Ca -0.00 -0.06 -0.00 0.00 -0.00 0.00 0.00 59.98 59.91 1yho h ARG 36 Cb 0.65 -0.23 0.00 0.00 -0.00 0.00 0.00 29.97 30.39 1yho h ARG 36 CO 0.01 0.67 -0.04 0.52 -0.00 0.00 0.00 179.97 181.12 1yho h MET 37 N 1.04 -0.12 -0.33 0.08 2.86 -1.39 -1.32 114.93 115.75 1yho h MET 37 Ca 0.28 0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.89 1yho h MET 37 Cb -0.12 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.56 1yho h MET 37 CO -0.06 0.18 0.07 1.79 1.06 0.00 0.00 176.91 179.95 1yho h THR 38 N -0.42 1.22 -0.94 2.22 1.35 -1.19 -2.99 112.91 112.16 1yho h THR 38 Ca -0.01 -0.76 0.03 0.00 -0.55 0.00 0.00 66.41 65.11 1yho h THR 38 Cb 0.35 1.10 -0.05 0.00 -1.73 0.00 0.00 68.15 67.82 1yho h THR 38 CO 0.02 0.25 0.62 0.71 -0.25 0.00 0.00 175.52 176.87 1yho h THR 39 N 0.37 1.18 -1.21 6.82 1.35 -0.69 -3.38 112.91 117.35 1yho h THR 39 Ca 0.10 -0.42 -0.34 0.00 -0.55 0.00 0.00 66.41 65.21 1yho h THR 39 Cb 0.31 -0.14 -0.03 0.00 -1.73 0.00 0.00 68.15 66.57 1yho h THR 39 CO 0.00 0.22 0.96 0.42 -0.25 0.00 0.00 175.52 176.87 1yho s THR 40 N -6.10 3.28 0.14 6.82 -4.23 -0.50 -4.94 115.64 110.10 1yho s THR 40 Ca -0.13 -0.07 0.04 0.00 -1.18 0.00 0.00 61.69 60.36 1yho s THR 40 Cb 0.18 -3.67 -0.04 0.00 1.34 0.00 0.00 72.50 70.31 1yho s THR 40 CO 0.81 -0.64 0.14 -0.94 -0.54 0.00 0.00 174.62 173.44 1yho s SER 41 N 9.16 5.62 0.28 3.99 1.04 -1.26 -4.95 113.70 127.58 1yho s SER 41 Ca 0.77 -0.06 0.08 0.00 0.48 0.00 0.00 55.95 57.22 1yho s SER 41 Cb -0.11 -1.51 0.39 0.00 0.10 0.00 0.00 66.02 64.89 1yho s SER 41 CO 0.12 0.10 1.64 0.28 0.98 0.00 0.00 173.24 176.36 1yho h SER 42 N 2.66 0.14 -3.27 7.02 0.02 -1.96 -3.43 113.55 114.72 1yho h SER 42 Ca -0.47 -0.07 -0.58 0.00 -0.84 0.00 0.00 61.79 59.82 1yho h SER 42 Cb 1.19 -0.04 -0.08 0.00 0.14 0.00 0.00 62.40 63.61 1yho h SER 42 CO 0.65 0.65 -0.16 0.68 -1.14 0.00 0.00 176.83 177.51 1yho s VAL 43 N -3.84 5.15 -0.04 2.27 -7.23 -1.26 -5.06 120.40 110.38 1yho s VAL 43 Ca -0.03 0.92 -0.20 0.00 -1.81 0.00 0.00 61.98 60.86 1yho s VAL 43 Cb 0.13 -3.79 -0.05 0.00 0.56 0.00 0.00 36.38 33.23 1yho s VAL 43 CO 0.77 0.38 0.55 -1.61 -0.31 0.00 0.00 175.10 174.89 1yho s GLU 44 N 0.27 4.30 0.00 4.82 2.02 -1.26 -3.85 118.70 125.01 1yho s GLU 44 Ca 0.25 0.64 0.00 0.00 0.02 0.00 0.00 54.97 55.88 1yho s GLU 44 Cb -0.15 -3.37 0.00 0.00 0.10 0.00 0.00 34.13 30.71 1yho s GLU 44 CO 0.11 0.31 0.00 0.41 0.02 0.00 0.00 175.26 176.10 1yho n GLY 45 N 2.69 1.73 3.95 -1.39 0.00 -1.26 -5.03 105.19 105.87 1yho n GLY 45 Ca -0.07 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.41 3.38 0.16 1.61 3.01 -1.25 -5.10 119.74 121.14 1yho s LYS 46 Ca 0.00 -0.39 0.09 0.00 -1.01 0.00 0.00 55.97 54.65 1yho s LYS 46 Cb 0.00 -2.64 -0.04 0.00 -1.01 0.00 0.00 37.83 34.14 1yho s LYS 46 CO 0.00 0.05 -0.11 -0.65 0.51 0.00 0.00 175.35 175.15 1yho s GLN 47 N -4.37 2.02 -0.06 1.68 -0.21 -0.89 -5.01 119.66 112.83 1yho s GLN 47 Ca 0.42 -1.23 0.01 0.00 0.02 0.00 0.00 55.36 54.58 1yho s GLN 47 Cb -0.10 -2.16 -0.03 0.00 1.00 0.00 0.00 33.01 31.72 1yho s GLN 47 CO 0.36 0.45 -0.05 -0.80 -2.12 0.00 0.00 175.29 173.13 1yho s ASN 48 N -2.65 4.81 -0.22 5.90 0.01 -1.26 -3.06 114.94 118.47 1yho s ASN 48 Ca 0.23 0.00 -0.06 0.00 -0.71 0.00 0.00 52.86 52.33 1yho s ASN 48 Cb -0.09 -1.24 -0.03 0.00 0.41 0.00 0.00 41.25 40.30 1yho s ASN 48 CO 0.14 0.35 0.03 -0.22 -1.51 0.00 0.00 177.10 175.89 1yho s LEU 49 N -0.95 3.38 0.01 0.60 0.20 -0.96 -0.88 118.68 120.07 1yho s LEU 49 Ca 0.14 -0.18 0.01 0.00 0.69 0.00 0.00 54.13 54.79 1yho s LEU 49 Cb -0.11 -1.87 -0.04 0.00 -0.43 0.00 0.00 46.19 43.74 1yho s LEU 49 CO 0.03 0.04 0.02 0.68 -0.29 0.00 0.00 176.35 176.83 1yho s VAL 50 N 1.16 4.30 -0.15 1.68 -7.23 0.63 -0.89 120.40 119.90 1yho s VAL 50 Ca 0.03 -0.58 -0.03 0.00 -1.81 0.00 0.00 61.98 59.59 1yho s VAL 50 Cb -0.14 -2.94 -0.03 0.00 0.56 0.00 0.00 36.38 33.83 1yho s VAL 50 CO 0.02 0.35 -0.05 -0.63 -0.31 0.00 0.00 175.10 174.48 1yho s ILE 51 N -1.13 3.79 0.18 -0.62 1.01 -0.45 -0.49 121.20 123.49 1yho s ILE 51 Ca 0.21 -0.39 0.04 0.00 0.00 0.00 0.00 60.65 60.51 1yho s ILE 51 Cb -0.12 -2.65 -0.05 0.00 0.01 0.00 0.00 42.46 39.65 1yho s ILE 51 CO 0.12 0.50 -0.07 -0.04 0.00 0.00 0.00 174.94 175.45 1yho s MET 52 N 0.34 1.19 0.45 2.79 -1.94 0.13 -2.08 119.30 120.18 1yho s MET 52 Ca -0.05 -1.55 0.08 0.00 -1.71 0.00 0.00 55.69 52.47 1yho s MET 52 Cb -0.14 -0.67 0.03 0.00 2.01 0.00 0.00 34.83 36.06 1yho s MET 52 CO 0.03 0.02 0.62 0.20 -0.01 0.00 0.00 175.02 175.88 1yho s GLY 53 N -3.23 1.90 0.27 -0.03 0.00 -0.49 -2.00 107.32 103.74 1yho s GLY 53 Ca 0.22 -1.77 -0.03 0.00 0.00 0.00 0.00 44.72 43.13 1yho s GLY 53 CO 0.04 -1.53 1.90 1.70 0.00 0.00 0.00 173.10 175.21 1yho h LYS 54 N 0.54 1.19 -0.15 2.90 3.64 -1.92 0.40 116.57 123.17 1yho h LYS 54 Ca -0.38 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 58.89 1yho h LYS 54 Cb 1.28 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 32.83 1yho h LYS 54 CO 0.44 0.79 -0.08 0.87 -2.27 0.00 0.00 179.45 179.19 1yho h LYS 55 N 1.22 0.31 -0.34 1.90 1.79 -1.96 -2.08 116.57 117.42 1yho h LYS 55 Ca 0.41 -0.14 -0.04 0.00 -2.18 0.00 0.00 60.65 58.69 1yho h LYS 55 Cb 0.06 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.69 1yho h LYS 55 CO -0.14 0.65 0.05 1.15 -1.08 0.00 0.00 179.45 180.08 1yho h THR 56 N -0.03 1.24 -0.95 -0.16 2.02 -1.83 0.34 112.91 113.55 1yho h THR 56 Ca 0.03 -0.84 0.04 0.00 0.77 0.00 0.00 66.41 66.42 1yho h THR 56 Cb 0.56 1.13 -0.06 0.00 -1.74 0.00 0.00 68.15 68.05 1yho h THR 56 CO 0.02 0.28 0.61 -0.25 0.37 0.00 0.00 175.52 176.56 1yho h TRP 57 N 0.39 1.15 0.00 3.16 2.91 -0.23 -0.25 115.95 123.08 1yho h TRP 57 Ca 0.10 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.15 1yho h TRP 57 Cb 0.36 -0.38 0.00 0.00 -0.51 0.00 0.00 29.16 28.63 1yho h TRP 57 CO 0.02 0.65 0.00 0.74 -1.03 0.00 0.00 178.44 178.82 1yho h PHE 58 N 1.18 0.00 0.00 2.65 -1.00 -1.20 -3.21 116.94 115.35 1yho h PHE 58 Ca 0.38 0.00 -0.19 0.00 2.81 0.00 0.00 57.97 60.97 1yho h PHE 58 Cb 0.03 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.56 1yho h PHE 58 CO -0.01 0.00 -1.00 0.77 -1.61 0.00 0.00 178.31 176.46 1yho h SER 59 N 0.00 0.00 -2.85 2.17 0.02 0.33 -3.44 113.55 109.78 1yho h SER 59 Ca 0.00 0.00 -0.56 0.00 -0.84 0.00 0.00 61.79 60.39 1yho h SER 59 Cb 0.94 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.45 1yho h SER 59 CO 0.00 0.83 1.04 -0.63 -1.14 0.00 0.00 176.83 176.93 1yho s ILE 60 N -2.78 3.89 0.86 3.27 1.01 -0.23 -4.98 121.20 122.25 1yho s ILE 60 Ca 0.01 1.04 -0.14 0.00 0.00 0.00 0.00 60.65 61.55 1yho s ILE 60 Cb 0.09 -3.82 0.01 0.00 0.01 0.00 0.00 42.46 38.74 1yho s ILE 60 CO 0.80 -0.26 0.46 -2.65 0.00 0.00 0.00 174.94 173.29 1yho n PRO 61 N 7.29 -0.05 0.17 2.79 -0.02 -1.26 -4.76 135.00 139.16 1yho n PRO 61 Ca 0.17 0.03 0.05 0.00 -2.02 0.00 0.00 63.50 61.73 1yho n PRO 61 Cb 0.45 -1.85 0.21 0.00 -0.02 0.00 0.00 33.50 32.29 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 -1.09 0.00 -0.80 -0.52 4.22 -1.94 -1.83 114.58 112.63 1yho h GLU 62 Ca -0.44 0.00 0.16 0.00 0.08 0.00 0.00 59.36 59.16 1yho h GLU 62 Cb 1.31 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.50 1yho h GLU 62 CO 0.37 0.41 0.53 0.87 -2.18 0.00 0.00 179.01 179.01 1yho h LYS 63 N 0.00 0.42 0.00 1.92 1.57 -2.01 -2.66 116.57 115.81 1yho h LYS 63 Ca -0.00 -0.03 -0.28 0.00 -1.87 0.00 0.00 60.65 58.47 1yho h LYS 63 Cb 1.10 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 33.26 1yho h LYS 63 CO 0.05 0.28 -2.06 0.09 -0.57 0.00 0.00 179.45 177.24 1yho n ASN 64 N -4.49 1.24 -4.76 0.86 3.02 -1.21 -4.97 115.26 104.96 1yho n ASN 64 Ca 0.16 -0.00 -0.40 0.00 -0.03 0.00 0.00 54.58 54.30 1yho n ASN 64 Cb 0.56 0.85 -0.06 0.00 -0.61 0.00 0.00 39.78 40.52 1yho n ASN 64 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1yho s ARG 65 N -2.37 4.80 0.28 3.52 3.52 -0.69 -2.86 118.95 125.14 1yho s ARG 65 Ca -0.08 1.42 -0.29 0.00 -0.13 0.00 0.00 55.73 56.64 1yho s ARG 65 Cb 0.05 -3.28 -0.10 0.00 -1.56 0.00 0.00 34.95 30.06 1yho s ARG 65 CO 0.62 0.53 1.17 -2.14 -0.81 0.00 0.00 175.30 174.67 1yho s PRO 66 N -1.16 4.54 -0.75 5.12 0.02 -1.26 -4.66 135.00 136.85 1yho s PRO 66 Ca 0.40 1.92 -0.26 0.00 0.02 0.00 0.00 61.00 63.09 1yho s PRO 66 Cb -0.25 -3.17 -0.07 0.00 0.02 0.00 0.00 34.50 31.03 1yho s PRO 66 CO 0.31 0.06 2.12 -0.51 -0.33 0.00 0.00 177.00 178.64 1yho s LEU 67 N -1.33 3.15 0.89 -5.54 2.01 -1.13 -4.94 118.68 111.79 1yho s LEU 67 Ca 0.47 -0.02 -0.11 0.00 0.01 0.00 0.00 54.13 54.48 1yho s LEU 67 Cb -0.34 -2.54 0.13 0.00 0.01 0.00 0.00 46.19 43.45 1yho s LEU 67 CO 0.43 -2.99 1.10 -0.54 1.01 0.00 0.00 176.35 175.36 1yho s LYS 68 N 7.69 1.24 0.00 1.70 1.02 -1.26 -3.70 119.74 126.44 1yho s LYS 68 Ca 0.79 1.10 0.00 0.00 0.02 0.00 0.00 55.97 57.88 1yho s LYS 68 Cb -0.11 -1.79 0.00 0.00 -0.52 0.00 0.00 37.83 35.41 1yho s LYS 68 CO 0.10 -2.33 0.00 0.41 -0.92 0.00 0.00 175.35 172.61 1yho n GLY 69 N -0.62 3.04 3.01 -3.33 0.00 -1.26 -5.00 105.19 101.03 1yho n GLY 69 Ca 0.08 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.23 0.40 -0.13 1.61 0.52 -1.24 -4.57 118.95 115.31 1yho s ARG 70 Ca 0.00 -0.77 -0.29 0.00 -0.52 0.00 0.00 55.73 54.14 1yho s ARG 70 Cb 0.00 0.12 -0.02 0.00 0.52 0.00 0.00 34.95 35.58 1yho s ARG 70 CO 0.00 -0.06 1.18 0.42 0.02 0.00 0.00 175.30 176.86 1yho s ILE 71 N -2.10 4.38 -0.15 1.52 -1.09 -0.06 -4.88 121.20 118.82 1yho s ILE 71 Ca -0.10 1.68 -0.18 0.00 -2.23 0.00 0.00 60.65 59.83 1yho s ILE 71 Cb -0.05 -4.08 -0.04 0.00 -1.58 0.00 0.00 42.46 36.70 1yho s ILE 71 CO -0.03 -0.08 0.46 0.20 -1.23 0.00 0.00 174.94 174.26 1yho s ASN 72 N 1.58 6.60 -0.11 3.58 0.01 -1.26 -0.27 114.94 125.07 1yho s ASN 72 Ca 0.53 0.71 0.01 0.00 -0.71 0.00 0.00 52.86 53.40 1yho s ASN 72 Cb -0.21 -2.27 0.02 0.00 0.41 0.00 0.00 41.25 39.19 1yho s ASN 72 CO 0.17 -0.05 -0.12 -0.22 -1.51 0.00 0.00 177.10 175.37 1yho s LEU 73 N 0.96 1.54 -0.11 0.60 0.20 0.36 -1.52 118.68 120.70 1yho s LEU 73 Ca 0.24 -0.38 -0.03 0.00 0.69 0.00 0.00 54.13 54.65 1yho s LEU 73 Cb -0.15 -0.98 -0.03 0.00 -0.43 0.00 0.00 46.19 44.60 1yho s LEU 73 CO 0.09 -0.04 0.01 -0.69 -0.29 0.00 0.00 176.35 175.44 1yho s VAL 74 N 1.24 4.37 -0.28 1.68 1.01 -0.86 0.17 120.40 127.73 1yho s VAL 74 Ca -0.02 -0.21 -0.10 0.00 0.00 0.00 0.00 61.98 61.64 1yho s VAL 74 Cb -0.14 -2.87 -0.05 0.00 0.00 0.00 0.00 36.38 33.33 1yho s VAL 74 CO -0.04 0.57 0.17 -0.76 0.00 0.00 0.00 175.10 175.04 1yho s LEU 75 N -0.53 3.95 -0.30 3.92 1.43 -0.85 -1.60 118.68 124.70 1yho s LEU 75 Ca 0.09 -0.06 -0.03 0.00 -1.03 0.00 0.00 54.13 53.11 1yho s LEU 75 Cb -0.12 -2.09 0.19 0.00 0.03 0.00 0.00 46.19 44.20 1yho s LEU 75 CO 0.02 -0.05 0.64 -0.55 0.23 0.00 0.00 176.35 176.64 1yho s SER 76 N 1.74 -1.29 0.16 2.29 0.15 -0.54 -4.31 113.70 111.90 1yho s SER 76 Ca 0.07 0.87 0.09 0.00 0.70 0.00 0.00 55.95 57.67 1yho s SER 76 Cb -0.16 2.11 -0.13 0.00 -1.71 0.00 0.00 66.02 66.13 1yho s SER 76 CO 0.10 -0.24 1.33 0.03 1.20 0.00 0.00 173.24 175.66 1yho h ARG 77 N 8.00 0.00 -0.12 5.44 3.08 -1.80 -3.28 114.38 125.70 1yho h ARG 77 Ca -0.22 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.64 1yho h ARG 77 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.21 1yho h ARG 77 CO 0.22 0.88 -0.73 0.93 -1.07 0.00 0.00 179.97 180.20 1yho h GLU 78 N 0.00 0.57 -6.94 0.04 4.39 -1.95 -3.44 114.58 107.24 1yho h GLU 78 Ca -0.01 -0.45 -0.49 0.00 0.34 0.00 0.00 59.36 58.75 1yho h GLU 78 Cb 1.66 0.09 0.02 0.00 -0.10 0.00 0.00 28.75 30.42 1yho h GLU 78 CO 0.11 1.08 0.43 -0.51 -1.16 0.00 0.00 179.01 178.96 1yho s LEU 79 N -8.18 4.19 -0.22 1.33 1.43 -1.24 -4.98 118.68 111.01 1yho s LEU 79 Ca -0.08 2.10 0.02 0.00 -1.03 0.00 0.00 54.13 55.14 1yho s LEU 79 Cb 0.10 -4.11 -0.20 0.00 0.03 0.00 0.00 46.19 42.01 1yho s LEU 79 CO 0.86 -0.48 -0.07 0.29 0.23 0.00 0.00 176.35 177.18 1yho n LYS 80 N 0.07 0.67 -4.25 1.70 4.76 -1.26 -4.94 118.16 114.92 1yho n LYS 80 Ca 0.04 0.16 -0.28 0.00 -2.87 0.00 0.00 58.31 55.36 1yho n LYS 80 Cb 0.49 -1.56 -0.10 0.00 -1.84 0.00 0.00 35.03 32.02 1yho n LYS 80 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1yho s GLU 81 N -2.53 2.10 0.24 1.97 8.01 -1.26 -5.10 118.70 122.14 1yho s GLU 81 Ca -0.30 -1.12 -0.30 0.00 0.01 0.00 0.00 54.97 53.26 1yho s GLU 81 Cb 0.08 -2.25 -0.09 0.00 -4.31 0.00 0.00 34.13 27.56 1yho s GLU 81 CO 0.66 0.48 1.30 -1.25 0.01 0.00 0.00 175.26 176.45 1yho s PRO 82 N -2.46 4.40 0.77 0.39 0.04 -1.26 -4.99 135.00 131.88 1yho s PRO 82 Ca 0.23 2.08 -0.15 0.00 0.04 0.00 0.00 61.00 63.20 1yho s PRO 82 Cb -0.10 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.28 1yho s PRO 82 CO 0.14 -0.20 0.75 -2.30 0.04 0.00 0.00 177.00 175.43 1yho n PRO 83 N 2.03 0.26 -1.72 0.56 -0.02 -1.26 -4.85 135.00 129.99 1yho n PRO 83 Ca 0.04 0.14 -0.42 0.00 -2.02 0.00 0.00 63.50 61.24 1yho n PRO 83 Cb 0.43 -2.04 -0.03 0.00 -0.02 0.00 0.00 33.50 31.83 1yho n PRO 83 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1yho s GLN 84 N -3.26 4.14 0.00 -0.52 2.00 -1.26 -1.66 119.66 119.10 1yho s GLN 84 Ca 0.68 2.59 0.00 0.00 -2.00 0.00 0.00 55.36 56.63 1yho s GLN 84 Cb -0.32 -3.47 0.00 0.00 0.80 0.00 0.00 33.01 30.02 1yho s GLN 84 CO 0.56 -0.82 0.00 0.41 -0.50 0.00 0.00 175.29 174.94 1yho n GLY 85 N 4.17 3.23 3.79 2.59 0.00 -1.26 -4.98 105.19 112.73 1yho n GLY 85 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1yho n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yho s ALA 86 N -2.93 2.85 -0.02 4.61 0.00 -0.66 -4.72 121.76 120.88 1yho s ALA 86 Ca 0.00 0.64 -0.04 0.00 0.00 0.00 0.00 51.96 52.56 1yho s ALA 86 Cb 0.00 -3.27 -0.28 0.00 0.00 0.00 0.00 23.12 19.57 1yho s ALA 86 CO 0.00 -0.37 0.75 0.45 0.00 0.00 0.00 175.76 176.59 1yho h HIS 87 N 1.52 0.49 -3.13 0.00 3.86 -1.59 -3.47 115.15 112.84 1yho h HIS 87 Ca -0.50 -0.36 -0.03 0.00 -1.16 0.00 0.00 60.37 58.32 1yho h HIS 87 Cb 1.23 -0.02 -0.13 0.00 1.06 0.00 0.00 27.41 29.55 1yho h HIS 87 CO 0.56 1.47 0.10 -0.06 0.86 0.00 0.00 177.93 180.86 1yho s PHE 88 N -2.60 -0.41 -0.07 2.45 0.08 -1.06 -5.02 117.98 111.35 1yho s PHE 88 Ca -0.12 0.18 0.02 0.00 0.12 0.00 0.00 56.93 57.13 1yho s PHE 88 Cb 0.06 0.44 0.02 0.00 -0.57 0.00 0.00 43.02 42.97 1yho s PHE 88 CO 0.84 -0.78 -0.10 -1.17 -0.10 0.00 0.00 175.22 173.92 1yho s LEU 89 N -2.72 1.50 0.16 -0.37 2.96 -1.26 -2.02 118.68 116.92 1yho s LEU 89 Ca 0.01 -0.25 0.11 0.00 -0.22 0.00 0.00 54.13 53.78 1yho s LEU 89 Cb 0.00 -0.73 -0.04 0.00 0.50 0.00 0.00 46.19 45.92 1yho s LEU 89 CO -0.12 -0.01 -0.23 -0.44 -1.32 0.00 0.00 176.35 174.23 1yho s SER 90 N 0.87 3.53 -0.00 3.68 0.01 -0.63 -4.97 113.70 116.19 1yho s SER 90 Ca -0.11 -0.76 -0.13 0.00 1.31 0.00 0.00 55.95 56.26 1yho s SER 90 Cb -0.15 -0.32 -0.33 0.00 0.21 0.00 0.00 66.02 65.43 1yho s SER 90 CO 0.01 0.15 0.85 0.03 0.41 0.00 0.00 173.24 174.69 1yho h ARG 91 N 3.48 0.46 -4.43 12.44 3.08 -1.88 -1.42 114.38 126.11 1yho h ARG 91 Ca -0.48 -0.78 -0.21 0.00 0.07 0.00 0.00 59.98 58.57 1yho h ARG 91 Cb 1.19 0.29 -0.14 0.00 0.08 0.00 0.00 29.97 31.39 1yho h ARG 91 CO 0.45 1.37 -0.53 0.45 -1.07 0.00 0.00 179.97 180.64 1yho s SER 92 N -7.42 0.13 0.32 7.04 0.15 -1.26 -4.26 113.70 108.40 1yho s SER 92 Ca -0.12 -1.32 0.01 0.00 0.70 0.00 0.00 55.95 55.22 1yho s SER 92 Cb 0.05 0.42 0.54 0.00 -1.71 0.00 0.00 66.02 65.31 1yho s SER 92 CO 0.90 -0.90 1.95 -0.07 1.20 0.00 0.00 173.24 176.33 1yho h LEU 93 N 2.55 0.77 -0.96 3.45 3.38 -1.99 -2.16 115.31 120.35 1yho h LEU 93 Ca -0.34 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.56 1yho h LEU 93 Cb 1.25 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.76 1yho h LEU 93 CO 0.50 0.62 0.50 0.44 0.09 0.00 0.00 178.44 180.59 1yho h ASP 94 N 0.87 1.09 -0.11 -0.43 5.19 -1.98 0.69 116.42 121.75 1yho h ASP 94 Ca 0.22 -0.09 -0.02 0.00 -0.62 0.00 0.00 57.03 56.53 1yho h ASP 94 Cb 0.02 -0.28 -0.00 0.00 0.18 0.00 0.00 39.33 39.25 1yho h ASP 94 CO -0.04 0.86 -0.02 0.44 -3.12 0.00 0.00 179.24 177.37 1yho h ASP 95 N 1.24 0.20 0.04 6.45 3.32 -1.82 -1.48 116.42 124.38 1yho h ASP 95 Ca 0.31 -0.35 -0.05 0.00 0.02 0.00 0.00 57.03 56.96 1yho h ASP 95 Cb 0.00 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1yho h ASP 95 CO -0.05 0.50 -0.15 0.00 -1.72 0.00 0.00 179.24 177.82 1yho h ALA 96 N 0.70 1.48 -0.25 3.45 0.00 -1.21 -2.14 119.26 121.28 1yho h ALA 96 Ca 0.03 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.57 1yho h ALA 96 Cb 0.41 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1yho h ALA 96 CO 0.01 0.37 -0.40 -0.07 0.00 0.00 0.00 179.25 179.15 1yho h LEU 97 N 0.22 0.79 -0.89 0.00 3.38 -0.74 -1.37 115.31 116.71 1yho h LEU 97 Ca 0.04 -0.52 -0.07 0.00 0.09 0.00 0.00 57.88 57.43 1yho h LEU 97 Cb 0.41 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1yho h LEU 97 CO 0.02 1.16 0.09 0.11 0.09 0.00 0.00 178.44 179.91 1yho h LYS 98 N 0.45 0.91 -0.10 1.13 6.56 -0.99 0.59 116.57 125.11 1yho h LYS 98 Ca 0.02 -0.22 -0.06 0.00 -1.06 0.00 0.00 60.65 59.33 1yho h LYS 98 Cb 1.00 -0.12 -0.00 0.00 -0.57 0.00 0.00 32.23 32.54 1yho h LYS 98 CO 0.09 0.85 -0.17 1.25 -2.06 0.00 0.00 179.45 179.41 1yho h LEU 99 N 0.86 0.33 -1.49 2.94 6.46 -1.36 0.05 115.31 123.10 1yho h LEU 99 Ca 0.18 -0.54 -0.05 0.00 -0.12 0.00 0.00 57.88 57.35 1yho h LEU 99 Cb 0.39 -0.09 -0.01 0.00 -0.73 0.00 0.00 40.66 40.22 1yho h LEU 99 CO 0.01 0.80 -0.24 0.71 -0.62 0.00 0.00 178.44 179.10 1yho h THR 100 N -0.13 0.86 0.00 1.05 1.35 -1.14 -2.57 112.91 112.32 1yho h THR 100 Ca 0.01 -0.95 -0.08 0.00 -0.55 0.00 0.00 66.41 64.83 1yho h THR 100 Cb 0.73 1.57 -0.01 0.00 -1.73 0.00 0.00 68.15 68.71 1yho h THR 100 CO 0.04 0.24 -0.92 -0.08 -0.25 0.00 0.00 175.52 174.55 1yho h GLU 101 N 0.00 0.00 -7.00 4.72 4.81 -0.81 -3.30 114.58 112.99 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 0.55 0.00 0.10 0.00 0.63 0.00 0.00 28.75 30.03 1yho h GLU 101 CO 0.03 0.21 0.58 -0.65 -0.73 0.00 0.00 179.01 178.45 1yho s GLN 102 N -3.10 3.58 0.53 1.92 -0.21 -0.00 -4.63 119.66 117.74 1yho s GLN 102 Ca 0.00 2.09 0.28 0.00 0.02 0.00 0.00 55.36 57.75 1yho s GLN 102 Cb 0.08 -2.46 1.43 0.00 1.00 0.00 0.00 33.01 33.06 1yho s GLN 102 CO 0.77 -0.79 1.95 -1.35 -2.12 0.00 0.00 175.29 173.75 1yho h PRO 103 N 2.01 0.01 -0.91 2.91 0.11 -1.90 0.87 132.00 135.09 1yho h PRO 103 Ca -0.50 -0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.64 1yho h PRO 103 Cb 1.27 -0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.32 1yho h PRO 103 CO 0.60 0.01 0.60 1.49 -0.21 0.00 0.00 178.00 180.48 1yho h GLU 104 N 0.01 1.13 0.00 1.05 4.81 -1.90 -3.00 114.58 116.69 1yho h GLU 104 Ca 0.33 -0.07 -0.15 0.00 -0.13 0.00 0.00 59.36 59.35 1yho h GLU 104 Cb 1.32 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 30.42 1yho h GLU 104 CO -0.01 0.75 -2.09 -0.11 -0.73 0.00 0.00 179.01 176.82 1yho n LEU 105 N -4.50 0.00 0.06 1.64 7.94 -0.28 -4.35 117.00 117.52 1yho n LEU 105 Ca 0.12 0.00 0.19 0.00 -1.11 0.00 0.00 56.01 55.20 1yho n LEU 105 Cb 0.08 0.20 0.71 0.00 0.53 0.00 0.00 43.42 44.94 1yho n LEU 105 CO 0.35 0.20 1.17 0.00 -1.11 0.00 0.00 177.39 178.00 1yho h ALA 106 N 1.46 2.32 -0.00 1.96 0.00 0.78 0.94 119.26 126.71 1yho h ALA 106 Ca -0.22 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.52 1yho h ALA 106 Cb 1.47 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 1yho h ALA 106 CO 0.01 -0.54 -0.71 -0.91 0.00 0.00 0.00 179.25 177.10 1yho h ASN 107 N 0.00 0.04 0.00 0.00 4.21 -1.72 -3.37 115.58 114.74 1yho h ASN 107 Ca 0.20 -0.03 -0.14 0.00 1.21 0.00 0.00 56.30 57.54 1yho h ASN 107 Cb 0.85 -0.01 -0.02 0.00 -1.12 0.00 0.00 38.32 38.01 1yho h ASN 107 CO -0.00 0.74 -1.16 0.29 -1.29 0.00 0.00 177.43 176.00 1yho n LYS 108 N -3.71 0.52 -4.17 0.81 5.02 0.40 -4.91 118.16 112.12 1yho n LYS 108 Ca -0.01 0.42 -0.31 0.00 -2.02 0.00 0.00 58.31 56.39 1yho n LYS 108 Cb 0.69 -1.61 -0.08 0.00 -0.02 0.00 0.00 35.03 34.01 1yho n LYS 108 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1yho s VAL 109 N -2.47 4.18 0.00 -0.18 -7.23 0.30 -2.09 120.40 112.91 1yho s VAL 109 Ca -0.26 -0.78 0.00 0.00 -1.81 0.00 0.00 61.98 59.13 1yho s VAL 109 Cb 0.06 -2.94 0.00 0.00 0.56 0.00 0.00 36.38 34.05 1yho s VAL 109 CO 0.41 0.23 0.00 -0.67 -0.31 0.00 0.00 175.10 174.75 1yho n ASP 110 N 0.89 1.60 -4.54 4.85 -0.08 -1.17 -3.78 116.55 114.32 1yho n ASP 110 Ca -0.12 0.00 -0.27 0.00 -1.51 0.00 0.00 54.79 52.89 1yho n ASP 110 Cb 0.52 0.00 -0.10 0.00 2.34 0.00 0.00 41.12 43.88 1yho n ASP 110 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 1yho s MET 111 N -1.90 1.95 -0.02 -0.67 -1.94 -1.26 -2.94 119.30 112.53 1yho s MET 111 Ca 0.00 -1.31 0.07 0.00 -1.71 0.00 0.00 55.69 52.74 1yho s MET 111 Cb 0.00 -2.10 -0.02 0.00 2.01 0.00 0.00 34.83 34.72 1yho s MET 111 CO 0.00 0.43 -0.23 0.08 -0.01 0.00 0.00 175.02 175.28 1yho s VAL 112 N -1.69 2.28 -0.13 -6.03 1.01 -0.80 -2.26 120.40 112.77 1yho s VAL 112 Ca 0.24 -1.06 0.01 0.00 0.00 0.00 0.00 61.98 61.17 1yho s VAL 112 Cb -0.09 -1.83 0.02 0.00 0.00 0.00 0.00 36.38 34.48 1yho s VAL 112 CO 0.14 0.55 -0.17 0.26 0.00 0.00 0.00 175.10 175.89 1yho s TRP 113 N -0.66 2.26 -0.24 5.22 0.52 -0.07 -1.53 118.94 124.44 1yho s TRP 113 Ca 0.11 -1.18 -0.22 0.00 0.02 0.00 0.00 56.10 54.82 1yho s TRP 113 Cb -0.10 -1.61 -0.01 0.00 -1.15 0.00 0.00 33.47 30.60 1yho s TRP 113 CO -0.00 -0.60 0.72 0.42 0.02 0.00 0.00 176.95 177.51 1yho s ILE 114 N 1.14 4.92 -0.07 2.03 1.09 0.86 -1.34 121.20 129.83 1yho s ILE 114 Ca -0.02 1.33 -0.07 0.00 -1.10 0.00 0.00 60.65 60.79 1yho s ILE 114 Cb -0.14 -4.02 -0.02 0.00 -1.06 0.00 0.00 42.46 37.22 1yho s ILE 114 CO -0.06 -0.01 -0.14 0.52 -0.10 0.00 0.00 174.94 175.16 1yho n VAL 115 N 5.16 0.64 -3.83 2.92 0.31 -0.88 -1.99 118.33 120.65 1yho n VAL 115 Ca 0.02 0.35 -0.07 0.00 -0.01 0.00 0.00 64.34 64.63 1yho n VAL 115 Cb 0.48 -1.87 0.01 0.00 -0.91 0.00 0.00 33.84 31.55 1yho n VAL 115 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1yho s GLY 116 N -3.71 0.17 0.00 2.92 0.00 -1.22 -4.67 107.32 100.81 1yho s GLY 116 Ca -0.11 -0.52 0.00 0.00 0.00 0.00 0.00 44.72 44.09 1yho s GLY 116 CO 0.17 0.05 0.00 0.61 0.00 0.00 0.00 173.10 173.93 1yho n GLY 117 N -0.52 1.83 0.29 0.20 0.00 -1.26 -1.40 105.19 104.33 1yho n GLY 117 Ca -0.06 -1.83 -0.03 0.00 0.00 0.00 0.00 46.02 44.09 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 0.72 -0.51 1.61 0.87 -1.99 -2.30 113.55 111.94 1yho h SER 118 Ca 0.00 -0.14 0.04 0.00 -1.23 0.00 0.00 61.79 60.45 1yho h SER 118 Cb 0.00 -0.19 -0.04 0.00 -0.44 0.00 0.00 62.40 61.73 1yho h SER 118 CO 0.00 0.75 0.28 -1.28 -0.53 0.00 0.00 176.83 176.05 1yho h SER 119 N 0.72 0.43 -0.24 6.23 0.87 -2.00 -0.32 113.55 119.24 1yho h SER 119 Ca 0.15 0.02 -0.10 0.00 -1.23 0.00 0.00 61.79 60.63 1yho h SER 119 Cb 0.35 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 1yho h SER 119 CO 0.01 0.30 -0.19 0.58 -0.53 0.00 0.00 176.83 177.00 1yho h VAL 120 N 0.56 1.26 -0.62 2.23 2.07 -1.80 -2.53 116.25 117.42 1yho h VAL 120 Ca 0.22 -1.24 -0.05 0.00 0.82 0.00 0.00 66.70 66.44 1yho h VAL 120 Cb 0.08 1.18 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1yho h VAL 120 CO -0.13 0.41 0.19 0.22 0.02 0.00 0.00 177.57 178.29 1yho h TYR 121 N 0.61 1.00 0.09 1.57 3.20 -0.81 -0.91 116.97 121.72 1yho h TYR 121 Ca 0.09 -0.10 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1yho h TYR 121 Cb 0.65 -0.29 0.00 0.00 1.54 0.00 0.00 36.73 38.64 1yho h TYR 121 CO 0.03 0.82 -0.04 -0.22 -1.64 0.00 0.00 178.16 177.10 1yho h LYS 122 N 0.89 -0.12 -0.72 1.82 1.63 -0.91 0.12 116.57 119.27 1yho h LYS 122 Ca 0.20 0.01 0.02 0.00 -0.85 0.00 0.00 60.65 60.03 1yho h LYS 122 Cb 0.29 0.03 -0.04 0.00 -0.60 0.00 0.00 32.23 31.91 1yho h LYS 122 CO -0.01 0.05 0.47 1.49 -3.45 0.00 0.00 179.45 178.00 1yho h GLU 123 N -0.27 0.91 0.00 1.90 4.57 -1.38 -1.42 114.58 118.88 1yho h GLU 123 Ca -0.01 -0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.09 1yho h GLU 123 Cb 0.23 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.61 1yho h GLU 123 CO 0.02 0.60 -0.12 0.00 -1.18 0.00 0.00 179.01 178.33 1yho h ALA 124 N 1.28 1.01 0.00 2.92 0.00 -1.03 -2.81 119.26 120.63 1yho h ALA 124 Ca 0.27 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1yho h ALA 124 Cb -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1yho h ALA 124 CO -0.08 0.16 0.00 -0.12 0.00 0.00 0.00 179.25 179.21 1yho n MET 125 N -3.26 0.17 -0.54 0.00 0.00 0.40 -1.81 117.12 112.08 1yho n MET 125 Ca 0.00 0.53 0.04 0.00 0.00 0.00 0.00 57.70 58.27 1yho n MET 125 Cb 0.38 -1.92 0.24 0.00 0.00 0.00 0.00 33.22 31.93 1yho n MET 125 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 175.97 174.26 1yho n ASN 126 N -2.26 3.83 -4.59 6.12 2.85 -1.06 -4.87 115.26 115.28 1yho n ASN 126 Ca 0.00 -2.55 -0.42 0.00 -0.11 0.00 0.00 54.58 51.50 1yho n ASN 126 Cb 0.14 -0.61 -0.05 0.00 1.24 0.00 0.00 39.78 40.50 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 -2.05 3.10 0.13 1.20 3.76 -0.75 -4.93 115.29 115.75 1yho s HIS 127 Ca 0.33 0.58 -0.07 0.00 -0.15 0.00 0.00 55.06 55.75 1yho s HIS 127 Cb 0.25 -3.45 -0.07 0.00 1.11 0.00 0.00 32.58 30.42 1yho s HIS 127 CO 0.10 -0.75 1.34 -1.00 -0.85 0.00 0.00 174.74 173.58 1yho h PRO 128 N 8.49 0.57 -6.99 8.40 0.13 -1.91 -3.46 132.00 137.24 1yho h PRO 128 Ca -0.24 -0.50 -0.38 0.00 -0.87 0.00 0.00 66.00 64.00 1yho h PRO 128 Cb 1.09 0.12 0.22 0.00 0.13 0.00 0.00 31.00 32.56 1yho h PRO 128 CO 0.92 1.13 -0.15 0.20 -0.23 0.00 0.00 178.00 179.87 1yho s GLY 129 N -4.26 1.39 0.12 1.56 0.00 -1.26 -4.37 107.32 100.50 1yho s GLY 129 Ca -0.08 -0.76 -0.31 0.00 0.00 0.00 0.00 44.72 43.58 1yho s GLY 129 CO 0.88 0.26 1.82 0.30 0.00 0.00 0.00 173.10 176.36 1yho s HIS 130 N -2.17 2.12 -0.06 1.90 3.76 -1.26 -4.77 115.29 114.81 1yho s HIS 130 Ca 0.68 -0.02 -0.09 0.00 -0.15 0.00 0.00 55.06 55.49 1yho s HIS 130 Cb -0.14 -4.17 0.02 0.00 1.11 0.00 0.00 32.58 29.40 1yho s HIS 130 CO 0.59 -4.83 0.22 -1.17 -0.85 0.00 0.00 174.74 168.70 1yho s LEU 131 N 2.81 1.17 0.06 0.89 0.20 -1.26 -4.29 118.68 118.26 1yho s LEU 131 Ca 0.81 0.27 0.03 0.00 0.69 0.00 0.00 54.13 55.93 1yho s LEU 131 Cb -0.45 0.83 -0.04 0.00 -0.43 0.00 0.00 46.19 46.10 1yho s LEU 131 CO 0.36 -0.19 0.05 -0.54 -0.29 0.00 0.00 176.35 175.74 1yho s LYS 132 N -0.39 2.81 -0.05 1.98 3.01 -0.23 -1.18 119.74 125.69 1yho s LYS 132 Ca -0.05 -0.68 -0.02 0.00 -1.01 0.00 0.00 55.97 54.21 1yho s LYS 132 Cb -0.03 -2.69 0.03 0.00 -1.01 0.00 0.00 37.83 34.12 1yho s LYS 132 CO 0.01 0.58 0.04 -1.17 0.51 0.00 0.00 175.35 175.32 1yho s LEU 133 N -2.15 0.35 -0.30 3.17 2.96 0.19 0.72 118.68 123.63 1yho s LEU 133 Ca 0.26 0.03 -0.06 0.00 -0.22 0.00 0.00 54.13 54.14 1yho s LEU 133 Cb -0.12 -0.23 0.02 0.00 0.50 0.00 0.00 46.19 46.36 1yho s LEU 133 CO 0.18 -0.22 0.06 -0.36 -1.32 0.00 0.00 176.35 174.69 1yho s PHE 134 N 2.02 3.16 -0.12 5.38 0.40 0.29 0.10 117.98 129.21 1yho s PHE 134 Ca 0.04 -1.16 -0.01 0.00 -0.60 0.00 0.00 56.93 55.20 1yho s PHE 134 Cb -0.12 -2.23 -0.02 0.00 0.51 0.00 0.00 43.02 41.16 1yho s PHE 134 CO -0.04 -0.63 -0.09 0.08 0.70 0.00 0.00 175.22 175.25 1yho s VAL 135 N 1.45 3.48 -0.24 -0.44 1.01 -0.40 0.18 120.40 125.45 1yho s VAL 135 Ca 0.01 -0.52 -0.05 0.00 0.00 0.00 0.00 61.98 61.42 1yho s VAL 135 Cb -0.18 -2.47 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 1yho s VAL 135 CO 0.01 0.54 -0.00 -0.89 0.00 0.00 0.00 175.10 174.76 1yho s THR 136 N 0.01 3.61 -0.28 3.92 2.01 -0.70 -1.27 115.64 122.93 1yho s THR 136 Ca -0.02 -0.50 -0.18 0.00 0.31 0.00 0.00 61.69 61.31 1yho s THR 136 Cb -0.14 -2.70 -0.02 0.00 0.01 0.00 0.00 72.50 69.65 1yho s THR 136 CO 0.03 0.34 0.50 -0.13 -0.69 0.00 0.00 174.62 174.67 1yho s ARG 137 N 1.50 3.98 -0.40 4.92 3.00 -0.20 0.77 118.95 132.51 1yho s ARG 137 Ca 0.05 0.19 -0.16 0.00 0.00 0.00 0.00 55.73 55.81 1yho s ARG 137 Cb -0.15 -3.68 0.01 0.00 0.00 0.00 0.00 34.95 31.13 1yho s ARG 137 CO -0.01 -0.40 0.37 0.42 0.00 0.00 0.00 175.30 175.68 1yho s ILE 138 N 2.30 5.17 -1.12 1.52 -1.09 -0.21 0.00 121.20 127.76 1yho s ILE 138 Ca 0.20 -0.37 -0.12 0.00 -2.23 0.00 0.00 60.65 58.13 1yho s ILE 138 Cb -0.16 -3.95 -0.07 0.00 -1.58 0.00 0.00 42.46 36.70 1yho s ILE 138 CO 0.10 -0.31 2.26 0.80 -1.23 0.00 0.00 174.94 176.57 1yho n MET 139 N 5.40 2.41 -3.21 2.79 1.56 0.10 -1.20 117.12 124.98 1yho n MET 139 Ca -0.09 -1.91 0.02 0.00 -0.27 0.00 0.00 57.70 55.45 1yho n MET 139 Cb 0.48 -2.79 -0.02 0.00 2.15 0.00 0.00 33.22 33.04 1yho n MET 139 CO 0.00 0.00 0.00 -0.65 -0.73 0.00 0.00 175.97 174.59 1yho s GLN 140 N 3.51 0.53 0.04 2.12 -1.52 -1.26 -4.40 119.66 118.68 1yho s GLN 140 Ca 0.52 0.95 -0.30 0.00 -1.95 0.00 0.00 55.36 54.58 1yho s GLN 140 Cb 0.14 0.40 -0.08 0.00 -0.22 0.00 0.00 33.01 33.25 1yho s GLN 140 CO -0.01 -0.60 1.76 0.16 -0.25 0.00 0.00 175.29 176.35 1yho s ASP 141 N 2.81 6.55 0.04 5.90 -4.77 -1.26 -4.42 116.67 121.52 1yho s ASP 141 Ca 0.18 2.51 0.00 0.00 -3.30 0.00 0.00 52.55 51.94 1yho s ASP 141 Cb -0.15 -2.55 -0.03 0.00 -1.09 0.00 0.00 42.92 39.10 1yho s ASP 141 CO -0.20 -0.96 -0.04 -0.36 0.70 0.00 0.00 175.17 174.31 1yho s PHE 142 N 3.51 0.48 -0.16 2.11 0.08 -1.26 -5.11 117.98 117.64 1yho s PHE 142 Ca 0.79 -0.76 -0.25 0.00 0.12 0.00 0.00 56.93 56.82 1yho s PHE 142 Cb -0.40 -0.33 -0.02 0.00 -0.57 0.00 0.00 43.02 41.71 1yho s PHE 142 CO 0.35 -0.24 0.83 -2.00 -0.10 0.00 0.00 175.22 174.06 1yho s GLU 143 N -2.63 4.31 0.08 0.44 2.12 -1.26 -4.92 118.70 116.84 1yho s GLU 143 Ca -0.04 1.02 0.05 0.00 0.36 0.00 0.00 54.97 56.36 1yho s GLU 143 Cb -0.02 -3.57 -0.03 0.00 0.26 0.00 0.00 34.13 30.77 1yho s GLU 143 CO -0.04 -0.31 -0.14 -1.54 -0.54 0.00 0.00 175.26 172.69 1yho s SER 144 N 1.14 1.71 -0.07 -1.70 1.04 -1.26 -4.72 113.70 109.83 1yho s SER 144 Ca 0.38 -0.67 0.11 0.00 0.48 0.00 0.00 55.95 56.26 1yho s SER 144 Cb -0.17 -0.05 -0.24 0.00 0.10 0.00 0.00 66.02 65.67 1yho s SER 144 CO 0.13 -0.10 0.54 0.47 0.98 0.00 0.00 173.24 175.26 1yho n ASP 145 N 1.09 0.93 -4.41 7.02 8.00 -1.22 -4.88 116.55 123.09 1yho n ASP 145 Ca -0.20 0.33 -0.33 0.00 0.71 0.00 0.00 54.79 55.31 1yho n ASP 145 Cb 0.55 -0.04 -0.14 0.00 -0.02 0.00 0.00 41.12 41.47 1yho n ASP 145 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1yho s THR 146 N -2.58 3.09 -0.00 -3.53 2.01 -1.17 -5.06 115.64 108.40 1yho s THR 146 Ca -0.08 -0.66 0.02 0.00 0.31 0.00 0.00 61.69 61.28 1yho s THR 146 Cb 0.08 -2.28 -0.03 0.00 0.01 0.00 0.00 72.50 70.27 1yho s THR 146 CO 0.82 0.54 -0.02 -0.36 -0.69 0.00 0.00 174.62 174.91 1yho s PHE 147 N 0.04 3.01 0.05 4.92 0.08 -1.26 -2.82 117.98 122.01 1yho s PHE 147 Ca -0.04 0.04 -0.20 0.00 0.12 0.00 0.00 56.93 56.85 1yho s PHE 147 Cb -0.14 -1.65 -0.06 0.00 -0.57 0.00 0.00 43.02 40.59 1yho s PHE 147 CO 0.04 0.43 0.59 0.12 -0.10 0.00 0.00 175.22 176.30 1yho s PHE 148 N -1.04 3.78 0.20 0.36 2.19 -0.24 -4.93 117.98 118.29 1yho s PHE 148 Ca 0.18 1.27 -0.30 0.00 0.33 0.00 0.00 56.93 58.41 1yho s PHE 148 Cb -0.11 -2.55 -0.09 0.00 -1.31 0.00 0.00 43.02 38.96 1yho s PHE 148 CO 0.09 0.51 1.34 -1.25 1.83 0.00 0.00 175.22 177.74 1yho s PRO 149 N -0.83 4.36 0.12 10.12 0.04 -1.26 -4.91 135.00 142.65 1yho s PRO 149 Ca 0.30 2.10 -0.31 0.00 0.04 0.00 0.00 61.00 63.13 1yho s PRO 149 Cb -0.19 -3.18 -0.10 0.00 0.04 0.00 0.00 34.50 31.07 1yho s PRO 149 CO 0.19 -0.29 1.75 -2.00 0.04 0.00 0.00 177.00 176.69 1yho s GLU 150 N -0.12 4.16 0.28 4.56 2.12 -1.26 -4.96 118.70 123.48 1yho s GLU 150 Ca 0.57 2.50 -0.29 0.00 0.36 0.00 0.00 54.97 58.12 1yho s GLU 150 Cb -0.37 -3.50 -0.09 0.00 0.26 0.00 0.00 34.13 30.42 1yho s GLU 150 CO 0.39 -0.78 1.03 0.42 -0.54 0.00 0.00 175.26 175.78 1yho s ILE 151 N 2.40 3.74 0.02 -3.70 1.01 -1.26 -5.02 121.20 118.39 1yho s ILE 151 Ca 0.77 1.70 -0.29 0.00 0.00 0.00 0.00 60.65 62.84 1yho s ILE 151 Cb -0.44 -4.06 -0.04 0.00 0.01 0.00 0.00 42.46 37.92 1yho s ILE 151 CO 0.34 0.37 0.93 -1.81 0.00 0.00 0.00 174.94 174.77 1yho s ASP 152 N -1.07 7.34 0.33 3.58 1.01 -1.26 -4.94 116.67 121.66 1yho s ASP 152 Ca 0.45 1.62 0.18 0.00 0.71 0.00 0.00 52.55 55.51 1yho s ASP 152 Cb -0.29 -2.55 0.16 0.00 1.01 0.00 0.00 42.92 41.26 1yho s ASP 152 CO 0.36 -0.18 1.47 -0.07 0.21 0.00 0.00 175.17 176.97 1yho h LEU 153 N 6.43 0.00 -1.64 1.23 3.38 -1.96 -1.79 115.31 120.97 1yho h LEU 153 Ca -0.42 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.51 1yho h LEU 153 Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 1yho h LEU 153 CO 0.74 0.29 -0.20 -0.33 0.09 0.00 0.00 178.44 179.03 1yho h GLU 154 N 0.00 0.00 0.00 1.13 5.08 -2.02 -3.15 114.58 115.63 1yho h GLU 154 Ca -0.01 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.04 1yho h GLU 154 Cb 1.23 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.42 1yho h GLU 154 CO 0.04 0.20 -2.17 1.63 -1.00 0.00 0.00 179.01 177.71 1yho n LYS 155 N -4.09 1.05 -4.02 2.33 4.01 -1.22 -4.97 118.16 111.25 1yho n LYS 155 Ca -0.02 0.03 -0.36 0.00 -0.51 0.00 0.00 58.31 57.45 1yho n LYS 155 Cb 0.27 -1.43 -0.07 0.00 -0.51 0.00 0.00 35.03 33.30 1yho n LYS 155 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 1yho s TYR 156 N -2.41 3.47 -0.20 2.13 1.51 -0.68 -2.17 117.35 119.00 1yho s TYR 156 Ca -0.14 0.41 -0.15 0.00 -1.01 0.00 0.00 57.07 56.18 1yho s TYR 156 Cb 0.06 -1.88 -0.04 0.00 -0.11 0.00 0.00 41.96 39.98 1yho s TYR 156 CO 0.63 0.65 0.36 0.21 -1.11 0.00 0.00 175.55 176.30 1yho s LYS 157 N -1.10 4.18 -0.41 -0.62 2.20 0.78 -4.41 119.74 120.37 1yho s LYS 157 Ca 0.16 0.15 -0.29 0.00 -0.36 0.00 0.00 55.97 55.63 1yho s LYS 157 Cb -0.12 -3.52 0.01 0.00 -1.51 0.00 0.00 37.83 32.70 1yho s LYS 157 CO 0.05 0.02 1.34 -1.17 -0.36 0.00 0.00 175.35 175.23 1yho s LEU 158 N 1.14 3.65 -0.54 5.43 0.20 -1.26 -2.01 118.68 125.28 1yho s LEU 158 Ca 0.18 0.82 0.00 0.00 0.69 0.00 0.00 54.13 55.82 1yho s LEU 158 Cb -0.14 -3.54 0.14 0.00 -0.43 0.00 0.00 46.19 42.21 1yho s LEU 158 CO 0.07 -1.34 0.32 -0.76 -0.29 0.00 0.00 176.35 174.35 1yho s LEU 159 N 5.06 4.90 0.12 -0.68 1.02 0.12 -4.95 118.68 124.25 1yho s LEU 159 Ca 0.58 -2.74 -0.14 0.00 0.02 0.00 0.00 54.13 51.85 1yho s LEU 159 Cb -0.13 -1.76 -0.06 0.00 0.02 0.00 0.00 46.19 44.26 1yho s LEU 159 CO 0.31 -0.35 1.46 1.55 0.02 0.00 0.00 176.35 179.34 1yho h PRO 160 N 7.04 0.78 -4.55 1.29 0.13 -1.93 -1.74 132.00 133.01 1yho h PRO 160 Ca -0.05 -0.39 -0.70 0.00 -0.87 0.00 0.00 66.00 63.99 1yho h PRO 160 Cb 0.95 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.77 1yho h PRO 160 CO 0.69 1.01 -0.56 -2.00 -0.23 0.00 0.00 178.00 176.91 1yho s GLU 161 N -4.46 2.37 -0.02 0.86 -6.30 -1.26 -4.69 118.70 105.21 1yho s GLU 161 Ca -0.12 -1.50 0.06 0.00 -2.50 0.00 0.00 54.97 50.91 1yho s GLU 161 Cb 0.10 -3.55 -0.01 0.00 0.00 0.00 0.00 34.13 30.66 1yho s GLU 161 CO 0.84 -0.89 -0.21 -0.47 0.02 0.00 0.00 175.26 174.55 1yho s TYR 162 N 1.29 1.90 0.32 5.30 6.14 -1.26 -5.10 117.35 125.95 1yho s TYR 162 Ca 0.02 -0.39 -0.29 0.00 0.64 0.00 0.00 57.07 57.06 1yho s TYR 162 Cb -0.22 -1.23 -0.11 0.00 0.42 0.00 0.00 41.96 40.83 1yho s TYR 162 CO -0.01 -0.05 1.41 -1.25 0.64 0.00 0.00 175.55 176.29 1yho s PRO 163 N -0.43 4.25 0.00 4.97 0.04 -1.26 -2.69 135.00 139.88 1yho s PRO 163 Ca 0.06 2.37 0.00 0.00 0.04 0.00 0.00 61.00 63.47 1yho s PRO 163 Cb -0.09 -3.05 0.00 0.00 0.04 0.00 0.00 34.50 31.41 1yho s PRO 163 CO -0.00 -0.38 0.00 0.41 0.04 0.00 0.00 177.00 177.07 1yho n GLY 164 N 1.12 3.04 3.50 0.56 0.00 -1.26 -5.02 105.19 107.13 1yho n GLY 164 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.43 3.21 0.36 1.61 0.11 -1.09 -5.03 120.40 117.13 1yho s VAL 165 Ca 0.00 -0.72 -0.27 0.00 -2.93 0.00 0.00 61.98 58.06 1yho s VAL 165 Cb 0.00 -2.29 -0.09 0.00 -1.53 0.00 0.00 36.38 32.47 1yho s VAL 165 CO 0.00 0.56 1.16 -0.76 -3.33 0.00 0.00 175.10 172.72 1yho s LEU 166 N -0.86 4.32 -0.19 2.54 1.43 -1.26 -4.55 118.68 120.11 1yho s LEU 166 Ca 0.12 2.35 0.16 0.00 -1.03 0.00 0.00 54.13 55.73 1yho s LEU 166 Cb -0.11 -3.87 -0.23 0.00 0.03 0.00 0.00 46.19 42.01 1yho s LEU 166 CO 0.02 -0.49 0.05 -0.24 0.23 0.00 0.00 176.35 175.92 1yho n SER 167 N 0.48 0.36 -4.76 2.29 2.88 -1.26 -4.64 113.62 108.96 1yho n SER 167 Ca 0.02 -0.01 -0.39 0.00 -1.33 0.00 0.00 58.87 57.17 1yho n SER 167 Cb 0.46 0.92 0.01 0.00 -0.75 0.00 0.00 64.21 64.84 1yho n SER 167 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1yho s ASP 168 N -5.39 5.92 0.24 -3.46 -1.08 -1.26 -4.65 116.67 107.00 1yho s ASP 168 Ca -0.10 2.62 -0.30 0.00 -0.52 0.00 0.00 52.55 54.25 1yho s ASP 168 Cb 0.06 -2.63 -0.10 0.00 -1.46 0.00 0.00 42.92 38.79 1yho s ASP 168 CO 0.77 -1.12 1.35 -0.69 0.52 0.00 0.00 175.17 176.01 1yho s VAL 169 N -1.34 2.93 0.28 1.11 1.01 -1.26 -4.74 120.40 118.38 1yho s VAL 169 Ca 0.63 0.80 0.07 0.00 0.00 0.00 0.00 61.98 63.48 1yho s VAL 169 Cb -0.37 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.47 1yho s VAL 169 CO 0.45 0.14 0.30 -1.10 0.00 0.00 0.00 175.10 174.89 1yho s GLN 170 N -0.57 3.03 -0.06 2.72 -0.21 -0.55 -4.95 119.66 119.07 1yho s GLN 170 Ca 0.56 -1.04 -0.02 0.00 0.02 0.00 0.00 55.36 54.88 1yho s GLN 170 Cb -0.39 -2.66 0.04 0.00 1.00 0.00 0.00 33.01 31.00 1yho s GLN 170 CO 0.43 0.28 0.12 -2.00 -2.12 0.00 0.00 175.29 172.00 1yho s GLU 171 N -3.96 0.05 -0.04 2.91 2.12 -1.26 -1.58 118.70 116.93 1yho s GLU 171 Ca 0.37 0.35 -0.02 0.00 0.36 0.00 0.00 54.97 56.03 1yho s GLU 171 Cb -0.08 -0.22 0.03 0.00 0.26 0.00 0.00 34.13 34.13 1yho s GLU 171 CO 0.27 -0.19 0.08 -2.00 -0.54 0.00 0.00 175.26 172.89 1yho s GLU 172 N 1.29 -0.01 -1.54 4.30 -6.30 -0.38 -4.84 118.70 111.22 1yho s GLU 172 Ca -0.08 0.34 -0.05 0.00 -2.50 0.00 0.00 54.97 52.69 1yho s GLU 172 Cb -0.12 -0.31 0.01 0.00 0.00 0.00 0.00 34.13 33.71 1yho s GLU 172 CO -0.05 -0.24 0.51 1.17 0.02 0.00 0.00 175.26 176.68 1yho n LYS 173 N 4.69 -4.32 -1.09 4.30 0.00 -1.26 -0.97 118.16 119.51 1yho n LYS 173 Ca -0.17 0.86 -0.03 0.00 0.00 0.00 0.00 58.31 58.97 1yho n LYS 173 Cb 0.50 -5.68 -0.01 0.00 0.00 0.00 0.00 35.03 29.84 1yho n LYS 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1yho n GLY 174 N -1.41 0.62 3.20 3.14 0.00 -1.26 -5.02 105.19 104.46 1yho n GLY 174 Ca -0.12 -0.74 -0.34 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.08 2.89 0.01 -0.61 1.01 -0.14 -5.10 121.20 117.17 1yho s ILE 175 Ca 0.00 -1.06 -0.15 0.00 0.00 0.00 0.00 60.65 59.44 1yho s ILE 175 Cb 0.00 -2.49 -0.06 0.00 0.01 0.00 0.00 42.46 39.92 1yho s ILE 175 CO 0.00 0.17 0.43 -0.54 0.00 0.00 0.00 174.94 175.00 1yho s LYS 176 N 1.32 3.97 0.03 2.79 1.02 -1.26 -1.25 119.74 126.36 1yho s LYS 176 Ca -0.00 0.46 -0.20 0.00 0.02 0.00 0.00 55.97 56.25 1yho s LYS 176 Cb -0.17 -3.23 0.04 0.00 -0.52 0.00 0.00 37.83 33.95 1yho s LYS 176 CO -0.04 0.67 0.44 1.52 -0.92 0.00 0.00 175.35 177.02 1yho s TYR 177 N -1.03 -0.32 0.15 3.18 1.13 -0.61 0.01 117.35 119.86 1yho s TYR 177 Ca 0.24 0.35 0.10 0.00 -1.41 0.00 0.00 57.07 56.35 1yho s TYR 177 Cb -0.17 0.24 -0.04 0.00 -1.10 0.00 0.00 41.96 40.89 1yho s TYR 177 CO 0.14 -0.57 -0.21 0.21 -2.51 0.00 0.00 175.55 172.61 1yho s LYS 178 N -2.24 1.65 -0.23 -3.49 2.20 0.10 -1.48 119.74 116.25 1yho s LYS 178 Ca -0.07 -1.32 -0.08 0.00 -0.36 0.00 0.00 55.97 54.15 1yho s LYS 178 Cb -0.01 -2.00 -0.04 0.00 -1.51 0.00 0.00 37.83 34.27 1yho s LYS 178 CO -0.01 0.45 0.09 -0.06 -0.36 0.00 0.00 175.35 175.46 1yho s PHE 179 N -1.31 3.17 -0.05 4.03 0.40 -1.26 -1.04 117.98 121.93 1yho s PHE 179 Ca 0.18 -0.12 0.05 0.00 -0.60 0.00 0.00 56.93 56.44 1yho s PHE 179 Cb -0.10 -2.20 -0.01 0.00 0.51 0.00 0.00 43.02 41.23 1yho s PHE 179 CO 0.09 -0.11 -0.21 -1.21 0.70 0.00 0.00 175.22 174.48 1yho s GLU 180 N 1.12 2.21 -0.14 0.44 0.41 -0.40 -4.85 118.70 117.49 1yho s GLU 180 Ca 0.05 -0.77 -0.04 0.00 -0.41 0.00 0.00 54.97 53.80 1yho s GLU 180 Cb -0.14 -1.88 -0.03 0.00 -1.78 0.00 0.00 34.13 30.29 1yho s GLU 180 CO 0.04 0.31 0.00 0.08 -0.49 0.00 0.00 175.26 175.21 1yho s VAL 181 N -0.06 4.30 -0.05 2.63 1.01 -0.66 -1.27 120.40 126.30 1yho s VAL 181 Ca -0.04 -0.23 0.04 0.00 0.00 0.00 0.00 61.98 61.76 1yho s VAL 181 Cb -0.13 -2.87 -0.00 0.00 0.00 0.00 0.00 36.38 33.38 1yho s VAL 181 CO 0.03 0.52 -0.17 -0.31 0.00 0.00 0.00 175.10 175.17 1yho s TYR 182 N -0.08 1.74 0.11 5.22 2.02 0.28 0.12 117.35 126.77 1yho s TYR 182 Ca 0.04 -0.53 0.07 0.00 -0.37 0.00 0.00 57.07 56.28 1yho s TYR 182 Cb -0.13 -1.18 -0.04 0.00 -0.40 0.00 0.00 41.96 40.21 1yho s TYR 182 CO 0.02 -0.19 -0.10 -2.00 -1.57 0.00 0.00 175.55 171.71 1yho s GLU 183 N 0.12 2.11 -0.24 -0.62 2.56 -0.85 0.57 118.70 122.34 1yho s GLU 183 Ca -0.06 -1.06 -0.10 0.00 0.00 0.00 0.00 54.97 53.75 1yho s GLU 183 Cb -0.12 -2.28 -0.05 0.00 2.00 0.00 0.00 34.13 33.68 1yho s GLU 183 CO 0.03 0.50 0.15 0.15 -0.56 0.00 0.00 175.26 175.52 1yho s LYS 184 N -2.30 4.04 0.17 4.30 1.02 -0.32 -0.16 119.74 126.49 1yho s LYS 184 Ca 0.22 -0.29 -0.30 0.00 0.02 0.00 0.00 55.97 55.62 1yho s LYS 184 Cb -0.11 -3.51 -0.08 0.00 -0.52 0.00 0.00 37.83 33.62 1yho s LYS 184 CO 0.14 0.05 1.19 1.21 -0.92 0.00 0.00 175.35 177.02 1yho s ASN 185 N 1.07 7.10 0.00 2.83 3.04 -0.92 -4.22 114.94 123.84 1yho s ASN 185 Ca 0.07 2.20 0.29 0.00 0.04 0.00 0.00 52.86 55.46 1yho s ASN 185 Cb -0.14 -2.60 1.31 0.00 -1.54 0.00 0.00 41.25 38.28 1yho s ASN 185 CO 0.04 -0.38 1.89 -0.90 -3.04 0.00 0.00 177.10 174.72