#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 1.68 3.39 7.63 0.00 -1.26 -5.08 105.19 111.55 1yho n GLY 2 Ca 0.00 -0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.03 5.61 -0.20 1.61 0.01 -1.26 -4.66 113.70 112.78 1yho s SER 3 Ca 0.00 -0.80 0.02 0.00 1.31 0.00 0.00 55.95 56.47 1yho s SER 3 Cb 0.00 -2.00 0.03 0.00 0.21 0.00 0.00 66.02 64.26 1yho s SER 3 CO 0.00 -0.30 -0.17 -0.76 0.41 0.00 0.00 173.24 172.43 1yho s LEU 4 N 1.57 2.48 -0.25 2.44 1.02 -1.26 -1.97 118.68 122.70 1yho s LEU 4 Ca 0.03 -0.86 -0.08 0.00 0.02 0.00 0.00 54.13 53.23 1yho s LEU 4 Cb -0.18 -1.47 -0.04 0.00 0.02 0.00 0.00 46.19 44.52 1yho s LEU 4 CO 0.06 -0.06 0.11 0.20 0.02 0.00 0.00 176.35 176.67 1yho s ASN 5 N 1.25 5.45 -0.16 2.29 0.01 0.80 -2.19 114.94 122.39 1yho s ASN 5 Ca 0.01 -0.12 -0.04 0.00 -0.71 0.00 0.00 52.86 52.00 1yho s ASN 5 Cb -0.15 -1.99 -0.03 0.00 0.41 0.00 0.00 41.25 39.49 1yho s ASN 5 CO -0.10 -0.02 -0.03 0.00 -1.51 0.00 0.00 177.10 175.44 1yho s ILE 7 N 0.41 -0.36 0.03 0.00 2.07 -0.95 0.80 121.20 123.20 1yho s ILE 7 Ca -0.03 0.22 -0.11 0.00 -1.41 0.00 0.00 60.65 59.32 1yho s ILE 7 Cb -0.14 -0.45 0.01 0.00 0.13 0.00 0.00 42.46 42.01 1yho s ILE 7 CO 0.03 0.06 0.23 0.68 -1.91 0.00 0.00 174.94 174.03 1yho s VAL 8 N 2.37 0.09 0.10 4.00 -7.23 0.28 -4.53 120.40 115.49 1yho s VAL 8 Ca 0.03 -0.77 0.02 0.00 -1.81 0.00 0.00 61.98 59.45 1yho s VAL 8 Cb -0.13 -0.83 -0.04 0.00 0.56 0.00 0.00 36.38 35.94 1yho s VAL 8 CO -0.09 -0.43 0.17 0.00 -0.31 0.00 0.00 175.10 174.45 1yho s ALA 9 N -2.29 3.78 0.01 1.32 0.00 -1.26 -2.06 121.76 121.26 1yho s ALA 9 Ca -0.07 -1.00 -0.04 0.00 0.00 0.00 0.00 51.96 50.85 1yho s ALA 9 Cb -0.02 -1.61 -0.01 0.00 0.00 0.00 0.00 23.12 21.48 1yho s ALA 9 CO -0.02 0.69 0.07 0.14 0.00 0.00 0.00 175.76 176.64 1yho s VAL 10 N -1.56 0.09 0.71 0.00 -7.23 0.21 -4.70 120.40 107.93 1yho s VAL 10 Ca 0.32 -0.71 -0.10 0.00 -1.81 0.00 0.00 61.98 59.68 1yho s VAL 10 Cb -0.12 -0.35 0.04 0.00 0.56 0.00 0.00 36.38 36.52 1yho s VAL 10 CO 0.25 -0.39 1.07 -0.55 -0.31 0.00 0.00 175.10 175.17 1yho s SER 11 N -1.29 5.09 0.65 4.85 0.15 0.21 -0.73 113.70 122.62 1yho s SER 11 Ca -0.14 0.83 0.42 0.00 0.70 0.00 0.00 55.95 57.75 1yho s SER 11 Cb -0.08 -1.55 2.26 0.00 -1.71 0.00 0.00 66.02 64.94 1yho s SER 11 CO 0.01 -1.50 2.32 -0.61 1.20 0.00 0.00 173.24 174.66 1yho h GLN 12 N -0.67 0.00 -0.81 5.44 4.15 -1.00 -0.72 115.11 121.49 1yho h GLN 12 Ca -0.45 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 58.80 1yho h GLN 12 Cb 1.29 0.00 -0.10 0.00 0.21 0.00 0.00 27.48 28.88 1yho h GLN 12 CO 0.63 0.00 0.21 -1.71 -1.93 0.00 0.00 178.83 176.04 1yho n ASN 13 N -3.19 4.26 -2.12 -0.69 2.85 -1.26 -4.87 115.26 110.24 1yho n ASN 13 Ca -0.03 -2.95 -0.19 0.00 -0.11 0.00 0.00 54.58 51.30 1yho n ASN 13 Cb 0.10 -0.70 -0.01 0.00 1.24 0.00 0.00 39.78 40.40 1yho n ASN 13 CO 0.00 0.00 0.00 0.23 -2.11 0.00 0.00 177.26 175.38 1yho n MET 14 N -0.04 -1.50 -3.83 1.20 2.81 -0.28 -4.97 117.12 110.52 1yho n MET 14 Ca 0.32 0.93 -0.28 0.00 -1.81 0.00 0.00 57.70 56.87 1yho n MET 14 Cb 1.17 -5.47 -0.03 0.00 -0.71 0.00 0.00 33.22 28.18 1yho n MET 14 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1yho s GLY 15 N -2.19 1.88 -0.02 3.03 0.00 -1.24 -1.78 107.32 107.01 1yho s GLY 15 Ca 0.00 -0.88 -0.00 0.00 0.00 0.00 0.00 44.72 43.84 1yho s GLY 15 CO 0.00 -0.85 -0.02 0.29 0.00 0.00 0.00 173.10 172.52 1yho n ILE 16 N -0.37 0.11 -3.62 0.90 -5.35 -1.08 0.68 119.36 110.62 1yho n ILE 16 Ca -0.05 -0.04 -0.03 0.00 -0.27 0.00 0.00 62.75 62.36 1yho n ILE 16 Cb 0.53 -0.92 -0.03 0.00 -1.74 0.00 0.00 39.64 37.48 1yho n ILE 16 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1yho s GLY 17 N -4.50 -0.14 -0.07 3.28 0.00 -1.26 -4.46 107.32 100.16 1yho s GLY 17 Ca -0.03 2.11 0.03 0.00 0.00 0.00 0.00 44.72 46.83 1yho s GLY 17 CO 0.04 0.77 -0.15 1.25 0.00 0.00 0.00 173.10 175.01 1yho s LYS 18 N -1.79 2.04 -1.65 2.90 2.20 0.25 -3.54 119.74 120.16 1yho s LYS 18 Ca 0.09 -0.53 0.00 0.00 -0.36 0.00 0.00 55.97 55.17 1yho s LYS 18 Cb -0.01 -1.64 0.00 0.00 -1.51 0.00 0.00 37.83 34.68 1yho s LYS 18 CO -0.05 0.06 0.00 -1.71 -0.36 0.00 0.00 175.35 173.30 1yho n ASN 19 N 3.75 -5.20 0.00 1.43 5.15 -1.26 -1.74 115.26 117.39 1yho n ASN 19 Ca -0.22 0.13 0.00 0.00 -0.60 0.00 0.00 54.58 53.89 1yho n ASN 19 Cb 0.52 -4.27 0.00 0.00 -0.53 0.00 0.00 39.78 35.50 1yho n ASN 19 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1yho n GLY 20 N -0.94 0.39 3.01 8.20 0.00 -1.26 -5.05 105.19 109.55 1yho n GLY 20 Ca -0.20 -1.04 -0.09 0.00 0.00 0.00 0.00 46.02 44.69 1yho n GLY 20 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yho s ASP 21 N -2.98 0.24 0.50 1.61 1.11 -0.71 -4.73 116.67 111.71 1yho s ASP 21 Ca 0.00 -0.52 -0.22 0.00 0.18 0.00 0.00 52.55 51.99 1yho s ASP 21 Cb 0.00 0.13 -0.06 0.00 1.07 0.00 0.00 42.92 44.06 1yho s ASP 21 CO 0.00 -0.35 1.22 -0.76 1.18 0.00 0.00 175.17 176.46 1yho s LEU 22 N -1.64 3.93 0.15 1.23 1.43 -1.26 0.87 118.68 123.39 1yho s LEU 22 Ca -0.13 2.44 -0.12 0.00 -1.03 0.00 0.00 54.13 55.29 1yho s LEU 22 Cb -0.07 -4.29 0.00 0.00 0.03 0.00 0.00 46.19 41.86 1yho s LEU 22 CO -0.02 -1.17 1.56 1.55 0.23 0.00 0.00 176.35 178.50 1yho h PRO 23 N 1.76 0.90 -6.67 1.29 0.13 -1.85 -3.44 132.00 124.12 1yho h PRO 23 Ca -0.50 -0.35 -0.50 0.00 -0.87 0.00 0.00 66.00 63.78 1yho h PRO 23 Cb 1.27 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.32 1yho h PRO 23 CO 0.59 1.00 0.27 1.67 -0.23 0.00 0.00 178.00 181.29 1yho s TRP 24 N -4.80 3.90 0.92 1.56 -2.14 -1.26 -4.93 118.94 112.19 1yho s TRP 24 Ca -0.12 1.76 -0.13 0.00 2.66 0.00 0.00 56.10 60.27 1yho s TRP 24 Cb 0.11 -2.87 0.03 0.00 -3.10 0.00 0.00 33.47 27.64 1yho s TRP 24 CO 0.84 0.44 0.42 -2.30 -2.66 0.00 0.00 176.95 173.70 1yho n PRO 25 N 1.35 -0.20 -1.69 3.25 -0.02 -1.26 -4.78 135.00 131.64 1yho n PRO 25 Ca -0.03 -0.02 -0.56 0.00 -2.02 0.00 0.00 63.50 60.88 1yho n PRO 25 Cb 0.48 -1.85 -0.07 0.00 -0.02 0.00 0.00 33.50 32.04 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 -1.56 1.34 -3.88 0.52 -0.02 -1.26 -4.94 135.00 125.20 1yho n PRO 26 Ca 0.07 0.49 -0.35 0.00 -2.02 0.00 0.00 63.50 61.69 1yho n PRO 26 Cb 0.53 -2.22 -0.09 0.00 -0.02 0.00 0.00 33.50 31.70 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 3.86 3.96 0.15 2.45 2.96 -1.26 -4.99 118.68 125.81 1yho s LEU 27 Ca 0.98 0.12 -0.05 0.00 -0.22 0.00 0.00 54.13 54.97 1yho s LEU 27 Cb -0.99 -2.02 -0.04 0.00 0.50 0.00 0.00 46.19 43.64 1yho s LEU 27 CO 0.63 0.16 1.36 -0.09 -1.32 0.00 0.00 176.35 177.09 1yho h ARG 28 N 6.80 0.48 -0.11 1.98 2.43 -1.99 -2.23 114.38 121.74 1yho h ARG 28 Ca -0.38 -0.43 -0.22 0.00 -0.81 0.00 0.00 59.98 58.13 1yho h ARG 28 Cb 1.16 0.10 0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1yho h ARG 28 CO 0.71 1.07 -0.81 -0.97 -1.51 0.00 0.00 179.97 178.46 1yho h ASN 29 N 0.31 0.81 -0.33 -3.80 -1.24 -1.97 -1.36 115.58 107.99 1yho h ASN 29 Ca -0.05 -0.55 -0.08 0.00 0.71 0.00 0.00 56.30 56.32 1yho h ASN 29 Cb 1.43 -0.24 -0.01 0.00 0.73 0.00 0.00 38.32 40.22 1yho h ASN 29 CO 0.15 1.34 -0.10 -0.08 -1.29 0.00 0.00 177.43 177.45 1yho h GLU 30 N 0.44 0.65 0.03 6.67 4.57 -1.98 0.87 114.58 125.84 1yho h GLU 30 Ca -0.06 -0.26 -0.00 0.00 -1.18 0.00 0.00 59.36 57.86 1yho h GLU 30 Cb 1.44 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.99 1yho h GLU 30 CO 0.16 0.84 -0.01 0.74 -1.18 0.00 0.00 179.01 179.55 1yho h PHE 31 N 0.43 -0.03 -0.36 0.92 -1.00 -1.45 -0.11 116.94 115.34 1yho h PHE 31 Ca 0.08 -0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.82 1yho h PHE 31 Cb 0.61 0.01 -0.02 0.00 3.61 0.00 0.00 35.95 40.16 1yho h PHE 31 CO 0.05 0.41 0.07 -0.09 -1.61 0.00 0.00 178.31 177.15 1yho h ARG 32 N -0.49 0.53 -0.15 1.51 9.65 -1.29 0.13 114.38 124.27 1yho h ARG 32 Ca -0.00 -0.09 -0.22 0.00 -1.10 0.00 0.00 59.98 58.57 1yho h ARG 32 Cb 0.46 -0.09 0.01 0.00 -1.39 0.00 0.00 29.97 28.96 1yho h ARG 32 CO 0.01 0.51 -0.75 -0.92 2.80 0.00 0.00 179.97 181.61 1yho h TYR 33 N 0.52 1.00 -0.21 2.20 3.20 -0.79 -2.37 116.97 120.52 1yho h TYR 33 Ca 0.12 -0.43 -0.15 0.00 3.14 0.00 0.00 58.73 61.40 1yho h TYR 33 Cb 0.23 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.35 1yho h TYR 33 CO 0.01 1.25 -0.46 0.35 -1.64 0.00 0.00 178.16 177.67 1yho h PHE 34 N 0.51 0.87 0.17 -3.82 3.57 -0.63 -1.92 116.94 115.71 1yho h PHE 34 Ca -0.04 -0.32 -0.01 0.00 3.53 0.00 0.00 57.97 61.12 1yho h PHE 34 Cb 1.37 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.96 1yho h PHE 34 CO 0.08 1.11 -0.08 0.37 -2.23 0.00 0.00 178.31 177.55 1yho h GLN 35 N 0.39 -0.22 -0.35 1.11 4.15 -0.80 -2.40 115.11 117.00 1yho h GLN 35 Ca 0.00 0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.41 1yho h GLN 35 Cb 1.07 0.05 -0.02 0.00 0.21 0.00 0.00 27.48 28.79 1yho h GLN 35 CO 0.10 -0.08 0.09 0.07 -1.93 0.00 0.00 178.83 177.08 1yho h ARG 36 N -0.31 0.52 0.39 1.69 -0.00 -1.49 -1.84 114.38 113.33 1yho h ARG 36 Ca -0.02 -0.08 -0.01 0.00 -0.00 0.00 0.00 59.98 59.86 1yho h ARG 36 Cb 0.25 -0.09 -0.00 0.00 -0.00 0.00 0.00 29.97 30.12 1yho h ARG 36 CO 0.04 0.48 -0.24 1.98 -0.00 0.00 0.00 179.97 182.23 1yho h MET 37 N 0.51 -0.57 -0.13 0.08 4.05 -1.06 -1.39 114.93 116.41 1yho h MET 37 Ca 0.12 0.04 -0.05 0.00 -0.28 0.00 0.00 59.70 59.53 1yho h MET 37 Cb 0.20 0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 31.12 1yho h MET 37 CO -0.00 -0.38 -0.14 1.79 0.23 0.00 0.00 176.91 178.40 1yho h THR 38 N -0.59 1.18 -0.36 -0.77 1.35 -1.28 -2.39 112.91 110.05 1yho h THR 38 Ca -0.04 -0.78 -0.06 0.00 -0.55 0.00 0.00 66.41 64.98 1yho h THR 38 Cb 0.49 1.24 -0.02 0.00 -1.73 0.00 0.00 68.15 68.13 1yho h THR 38 CO 0.04 0.24 -0.03 0.74 -0.25 0.00 0.00 175.52 176.27 1yho h THR 39 N 0.20 1.21 -2.47 6.82 2.02 -0.91 -3.40 112.91 116.37 1yho h THR 39 Ca 0.04 -0.89 -0.55 0.00 0.77 0.00 0.00 66.41 65.79 1yho h THR 39 Cb 0.38 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 67.73 1yho h THR 39 CO 0.02 0.30 1.29 -0.89 0.37 0.00 0.00 175.52 176.62 1yho s THR 40 N -4.92 3.46 -0.04 3.16 2.01 -0.56 -4.98 115.64 113.77 1yho s THR 40 Ca -0.08 0.42 -0.03 0.00 0.31 0.00 0.00 61.69 62.31 1yho s THR 40 Cb 0.15 -3.77 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 1yho s THR 40 CO 0.78 -0.59 0.13 -0.44 -0.69 0.00 0.00 174.62 173.81 1yho s SER 41 N 6.70 6.12 0.19 3.53 0.01 -1.26 -5.00 113.70 123.99 1yho s SER 41 Ca 0.74 0.31 0.01 0.00 1.31 0.00 0.00 55.95 58.33 1yho s SER 41 Cb -0.18 -1.89 0.10 0.00 0.21 0.00 0.00 66.02 64.25 1yho s SER 41 CO 0.29 0.31 1.46 0.77 0.41 0.00 0.00 173.24 176.48 1yho h SER 42 N 4.28 0.36 -3.27 2.44 4.64 -1.97 -3.43 113.55 116.60 1yho h SER 42 Ca -0.51 -0.24 -0.67 0.00 -0.47 0.00 0.00 61.79 59.91 1yho h SER 42 Cb 1.20 -0.11 -0.31 0.00 -0.31 0.00 0.00 62.40 62.87 1yho h SER 42 CO 0.63 0.97 -0.82 -0.69 -0.87 0.00 0.00 176.83 176.05 1yho s VAL 43 N -3.55 2.52 0.37 0.95 1.01 -1.26 -5.11 120.40 115.32 1yho s VAL 43 Ca -0.04 -0.83 -0.25 0.00 0.00 0.00 0.00 61.98 60.86 1yho s VAL 43 Cb 0.11 -2.04 -0.09 0.00 0.00 0.00 0.00 36.38 34.35 1yho s VAL 43 CO 0.82 0.53 1.02 -1.61 0.00 0.00 0.00 175.10 175.86 1yho s GLU 44 N 0.75 4.33 0.00 2.72 2.02 -1.26 -3.41 118.70 123.85 1yho s GLU 44 Ca -0.07 1.48 0.00 0.00 0.02 0.00 0.00 54.97 56.40 1yho s GLU 44 Cb -0.16 -2.66 0.00 0.00 0.10 0.00 0.00 34.13 31.41 1yho s GLU 44 CO 0.01 0.01 0.00 0.41 0.02 0.00 0.00 175.26 175.71 1yho n GLY 45 N 0.45 1.48 3.79 -1.39 0.00 -1.26 -5.04 105.19 103.23 1yho n GLY 45 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.49 2.79 0.09 1.61 1.02 -1.22 -5.04 119.74 118.50 1yho s LYS 46 Ca 0.00 -1.14 0.08 0.00 0.02 0.00 0.00 55.97 54.93 1yho s LYS 46 Cb 0.00 -2.48 -0.04 0.00 -0.52 0.00 0.00 37.83 34.79 1yho s LYS 46 CO 0.00 0.38 -0.15 -0.65 -0.92 0.00 0.00 175.35 174.01 1yho s GLN 47 N -3.82 1.98 -0.09 1.68 -0.21 -0.58 -4.99 119.66 113.64 1yho s GLN 47 Ca 0.33 -1.07 -0.04 0.00 0.02 0.00 0.00 55.36 54.60 1yho s GLN 47 Cb -0.07 -2.20 -0.04 0.00 1.00 0.00 0.00 33.01 31.70 1yho s GLN 47 CO 0.24 0.51 0.07 -0.80 -2.12 0.00 0.00 175.29 173.18 1yho s ASN 48 N -1.96 5.75 -0.21 5.90 0.01 -1.26 -3.20 114.94 119.98 1yho s ASN 48 Ca 0.18 0.28 -0.06 0.00 -0.71 0.00 0.00 52.86 52.55 1yho s ASN 48 Cb -0.11 -1.73 -0.03 0.00 0.41 0.00 0.00 41.25 39.79 1yho s ASN 48 CO 0.10 0.38 0.02 -0.22 -1.51 0.00 0.00 177.10 175.87 1yho s LEU 49 N -1.02 3.32 -0.00 0.60 0.20 -0.96 -2.18 118.68 118.63 1yho s LEU 49 Ca 0.15 -0.19 0.00 0.00 0.69 0.00 0.00 54.13 54.78 1yho s LEU 49 Cb -0.12 -1.85 -0.04 0.00 -0.43 0.00 0.00 46.19 43.75 1yho s LEU 49 CO 0.04 0.05 0.04 0.68 -0.29 0.00 0.00 176.35 176.87 1yho s VAL 50 N 1.11 4.44 -0.17 1.68 -7.23 0.22 -0.93 120.40 119.52 1yho s VAL 50 Ca 0.03 -0.50 -0.04 0.00 -1.81 0.00 0.00 61.98 59.66 1yho s VAL 50 Cb -0.14 -3.01 -0.02 0.00 0.56 0.00 0.00 36.38 33.77 1yho s VAL 50 CO 0.02 0.37 -0.04 -0.63 -0.31 0.00 0.00 175.10 174.51 1yho s ILE 51 N -1.13 3.75 0.19 -0.62 -1.09 -0.15 -0.59 121.20 121.55 1yho s ILE 51 Ca 0.21 -0.40 0.08 0.00 -2.23 0.00 0.00 60.65 58.31 1yho s ILE 51 Cb -0.12 -2.66 -0.04 0.00 -1.58 0.00 0.00 42.46 38.06 1yho s ILE 51 CO 0.12 0.47 -0.16 -0.04 -1.23 0.00 0.00 174.94 174.10 1yho s MET 52 N 0.68 1.31 0.61 2.79 -1.94 0.15 -2.28 119.30 120.62 1yho s MET 52 Ca -0.02 -1.52 -0.01 0.00 -1.71 0.00 0.00 55.69 52.43 1yho s MET 52 Cb -0.14 -1.22 0.05 0.00 2.01 0.00 0.00 34.83 35.52 1yho s MET 52 CO 0.02 0.22 0.86 0.20 -0.01 0.00 0.00 175.02 176.31 1yho s GLY 53 N -3.05 1.78 0.25 -0.03 0.00 -1.19 -1.89 107.32 103.20 1yho s GLY 53 Ca 0.20 -1.22 -0.05 0.00 0.00 0.00 0.00 44.72 43.65 1yho s GLY 53 CO 0.07 -0.88 1.87 1.70 0.00 0.00 0.00 173.10 175.86 1yho h LYS 54 N -0.16 1.17 -0.16 2.90 3.64 -1.96 -0.73 116.57 121.27 1yho h LYS 54 Ca -0.43 -0.14 -0.08 0.00 -1.27 0.00 0.00 60.65 58.74 1yho h LYS 54 Cb 1.30 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1yho h LYS 54 CO 0.54 0.86 -0.22 0.87 -2.27 0.00 0.00 179.45 179.24 1yho h LYS 55 N 1.17 0.43 -0.38 1.90 6.56 -1.96 -2.21 116.57 122.09 1yho h LYS 55 Ca 0.29 -0.25 0.01 0.00 -1.06 0.00 0.00 60.65 59.65 1yho h LYS 55 Cb 0.04 0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 31.69 1yho h LYS 55 CO -0.05 0.83 0.24 1.15 -2.06 0.00 0.00 179.45 179.56 1yho h THR 56 N 0.06 1.07 -0.37 -0.16 2.02 -1.83 -0.41 112.91 113.29 1yho h THR 56 Ca 0.02 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.03 1yho h THR 56 Cb 0.78 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 1yho h THR 56 CO 0.05 0.09 0.21 -0.25 0.37 0.00 0.00 175.52 175.99 1yho h TRP 57 N 0.49 0.50 0.00 3.16 2.91 -1.16 -1.24 115.95 120.60 1yho h TRP 57 Ca 0.14 -0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.15 1yho h TRP 57 Cb -0.03 -0.16 -0.00 0.00 -0.51 0.00 0.00 29.16 28.45 1yho h TRP 57 CO -0.06 0.37 -0.04 0.74 -1.03 0.00 0.00 178.44 178.42 1yho h PHE 58 N 0.48 0.00 0.00 2.65 -1.00 -1.11 -2.36 116.94 115.60 1yho h PHE 58 Ca 0.13 0.00 -0.22 0.00 2.81 0.00 0.00 57.97 60.69 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 -0.03 0.04 -1.18 0.77 -1.61 0.00 0.00 178.31 176.30 1yho h SER 59 N 0.00 0.00 -3.54 2.17 0.02 -0.20 -3.46 113.55 108.54 1yho h SER 59 Ca -0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 1yho h SER 59 Cb 0.34 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.90 1yho h SER 59 CO 0.01 0.94 0.57 -0.63 -1.14 0.00 0.00 176.83 176.57 1yho s ILE 60 N -2.71 3.44 0.24 3.27 1.01 -0.55 -5.00 121.20 120.90 1yho s ILE 60 Ca -0.01 1.25 -0.30 0.00 0.00 0.00 0.00 60.65 61.60 1yho s ILE 60 Cb 0.09 -3.80 -0.09 0.00 0.01 0.00 0.00 42.46 38.67 1yho s ILE 60 CO 0.81 0.22 1.14 -2.16 0.00 0.00 0.00 174.94 174.96 1yho s PRO 61 N -0.50 4.57 0.61 2.79 0.04 -1.26 -4.91 135.00 136.33 1yho s PRO 61 Ca 0.52 1.84 0.30 0.00 0.04 0.00 0.00 61.00 63.70 1yho s PRO 61 Cb -0.34 -3.21 1.71 0.00 0.04 0.00 0.00 34.50 32.70 1yho s PRO 61 CO 0.39 0.08 2.07 1.49 0.04 0.00 0.00 177.00 181.07 1yho h GLU 62 N 4.38 0.00 -0.34 4.56 4.81 -1.94 -0.61 114.58 125.44 1yho h GLU 62 Ca -0.46 0.00 0.10 0.00 -0.13 0.00 0.00 59.36 58.87 1yho h GLU 62 Cb 1.21 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.58 1yho h GLU 62 CO 0.70 0.00 0.25 0.87 -0.73 0.00 0.00 179.01 180.10 1yho h LYS 63 N 0.00 0.00 -0.51 1.92 6.56 -2.02 -0.07 116.57 122.46 1yho h LYS 63 Ca 0.08 0.00 -0.24 0.00 -1.06 0.00 0.00 60.65 59.43 1yho h LYS 63 Cb 0.55 0.00 -0.14 0.00 -0.57 0.00 0.00 32.23 32.07 1yho h LYS 63 CO -0.00 0.00 0.11 0.09 -2.06 0.00 0.00 179.45 177.59 1yho n ASN 64 N -4.43 3.01 -3.90 0.86 3.02 -0.24 -4.96 115.26 108.62 1yho n ASN 64 Ca 0.05 -3.64 -0.13 0.00 -0.03 0.00 0.00 54.58 50.83 1yho n ASN 64 Cb 0.43 -0.68 -0.14 0.00 -0.61 0.00 0.00 39.78 38.77 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 -3.21 0.15 0.24 3.52 0.52 -0.04 -3.02 118.95 117.12 1yho s ARG 65 Ca 0.48 -0.07 -0.30 0.00 -0.52 0.00 0.00 55.73 55.32 1yho s ARG 65 Cb 0.42 -0.15 -0.09 0.00 0.52 0.00 0.00 34.95 35.65 1yho s ARG 65 CO 0.04 0.04 1.25 -1.25 0.02 0.00 0.00 175.30 175.39 1yho s PRO 66 N -0.03 4.45 -0.22 3.54 0.04 -1.26 -4.90 135.00 136.62 1yho s PRO 66 Ca 0.01 2.00 -0.29 0.00 0.04 0.00 0.00 61.00 62.76 1yho s PRO 66 Cb -0.01 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.31 1yho s PRO 66 CO -0.00 -0.12 1.94 -1.17 0.04 0.00 0.00 177.00 177.69 1yho s LEU 67 N -0.72 3.68 0.49 -3.56 2.96 -1.17 -4.96 118.68 115.39 1yho s LEU 67 Ca 0.52 1.77 -0.21 0.00 -0.22 0.00 0.00 54.13 55.99 1yho s LEU 67 Cb -0.35 -3.52 -0.08 0.00 0.50 0.00 0.00 46.19 42.74 1yho s LEU 67 CO 0.41 -1.63 1.07 -0.75 -1.32 0.00 0.00 176.35 174.14 1yho s LYS 68 N 5.57 3.73 0.00 1.98 2.20 -1.26 -3.52 119.74 128.44 1yho s LYS 68 Ca 0.87 1.48 0.00 0.00 -0.36 0.00 0.00 55.97 57.96 1yho s LYS 68 Cb -0.30 -2.15 0.00 0.00 -1.51 0.00 0.00 37.83 33.87 1yho s LYS 68 CO 0.34 -0.51 0.00 0.41 -0.36 0.00 0.00 175.35 175.23 1yho n GLY 69 N -0.01 2.83 3.16 5.54 0.00 -1.26 -4.99 105.19 110.46 1yho n GLY 69 Ca 0.09 -0.26 -0.18 0.00 0.00 0.00 0.00 46.02 45.68 1yho n GLY 69 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1yho s ARG 70 N 0.00 0.80 -0.29 1.61 6.06 -1.23 -4.70 118.95 121.20 1yho s ARG 70 Ca 0.00 -0.91 -0.19 0.00 -2.50 0.00 0.00 55.73 52.13 1yho s ARG 70 Cb 0.00 -0.78 -0.02 0.00 0.06 0.00 0.00 34.95 34.21 1yho s ARG 70 CO 0.00 0.17 0.57 0.42 -2.50 0.00 0.00 175.30 173.96 1yho s ILE 71 N -1.23 5.00 -0.13 4.11 1.01 -0.93 -4.69 121.20 124.34 1yho s ILE 71 Ca -0.02 0.79 -0.17 0.00 0.00 0.00 0.00 60.65 61.25 1yho s ILE 71 Cb -0.10 -3.93 -0.04 0.00 0.01 0.00 0.00 42.46 38.40 1yho s ILE 71 CO 0.02 -0.06 0.43 0.20 0.00 0.00 0.00 174.94 175.52 1yho s ASN 72 N 1.62 6.62 -0.02 3.58 0.01 -1.26 -0.61 114.94 124.87 1yho s ASN 72 Ca 0.23 0.73 0.06 0.00 -0.71 0.00 0.00 52.86 53.17 1yho s ASN 72 Cb -0.15 -2.26 -0.01 0.00 0.41 0.00 0.00 41.25 39.24 1yho s ASN 72 CO 0.11 0.02 -0.20 -0.22 -1.51 0.00 0.00 177.10 175.30 1yho s LEU 73 N 0.60 2.02 -0.09 0.60 0.20 0.24 -1.83 118.68 120.42 1yho s LEU 73 Ca 0.23 -0.37 -0.01 0.00 0.69 0.00 0.00 54.13 54.67 1yho s LEU 73 Cb -0.15 -1.05 -0.03 0.00 -0.43 0.00 0.00 46.19 44.53 1yho s LEU 73 CO 0.09 0.24 -0.04 -0.69 -0.29 0.00 0.00 176.35 175.65 1yho s VAL 74 N -0.38 3.89 -0.39 1.68 1.01 -0.85 0.33 120.40 125.70 1yho s VAL 74 Ca 0.05 -0.40 -0.10 0.00 0.00 0.00 0.00 61.98 61.54 1yho s VAL 74 Cb -0.09 -2.63 0.05 0.00 0.00 0.00 0.00 36.38 33.71 1yho s VAL 74 CO -0.00 0.58 0.22 -0.76 0.00 0.00 0.00 175.10 175.14 1yho s LEU 75 N -0.59 4.86 -0.04 3.92 1.43 -0.79 -1.89 118.68 125.59 1yho s LEU 75 Ca 0.09 -1.18 -0.02 0.00 -1.03 0.00 0.00 54.13 51.99 1yho s LEU 75 Cb -0.12 -2.01 0.03 0.00 0.03 0.00 0.00 46.19 44.12 1yho s LEU 75 CO 0.02 -0.44 0.09 -0.55 0.23 0.00 0.00 176.35 175.70 1yho s SER 76 N 1.76 -0.05 -0.14 2.29 0.15 -0.74 -4.27 113.70 112.70 1yho s SER 76 Ca 0.02 0.19 0.18 0.00 0.70 0.00 0.00 55.95 57.04 1yho s SER 76 Cb -0.21 0.11 -0.27 0.00 -1.71 0.00 0.00 66.02 63.94 1yho s SER 76 CO 0.05 -0.11 0.20 -1.14 1.20 0.00 0.00 173.24 173.44 1yho n ARG 77 N 3.87 0.77 0.12 5.44 0.63 -1.26 -3.92 116.66 122.32 1yho n ARG 77 Ca -0.23 -0.07 -0.20 0.00 -0.92 0.00 0.00 57.85 56.43 1yho n ARG 77 Cb 0.53 -1.50 -0.14 0.00 0.45 0.00 0.00 32.46 31.80 1yho n ARG 77 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1yho h GLU 78 N 0.00 0.41 -6.79 -0.14 5.08 -1.96 -3.45 114.58 107.73 1yho h GLU 78 Ca -0.35 -0.68 -0.48 0.00 -1.00 0.00 0.00 59.36 56.85 1yho h GLU 78 Cb 1.77 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 31.25 1yho h GLU 78 CO 0.02 1.32 0.31 -0.51 -1.00 0.00 0.00 179.01 179.15 1yho s LEU 79 N -7.39 4.44 -0.20 1.33 1.43 -1.26 -4.98 118.68 112.06 1yho s LEU 79 Ca -0.06 1.81 0.14 0.00 -1.03 0.00 0.00 54.13 54.99 1yho s LEU 79 Cb 0.06 -3.81 -0.23 0.00 0.03 0.00 0.00 46.19 42.23 1yho s LEU 79 CO 0.91 0.02 0.06 1.17 0.23 0.00 0.00 176.35 178.75 1yho n LYS 80 N 0.90 0.68 -4.12 1.70 4.81 -1.26 -4.91 118.16 115.96 1yho n LYS 80 Ca -0.00 0.05 -0.31 0.00 -0.87 0.00 0.00 58.31 57.18 1yho n LYS 80 Cb 0.49 -1.55 -0.07 0.00 0.02 0.00 0.00 35.03 33.92 1yho n LYS 80 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 1yho s GLU 81 N -2.51 2.79 0.22 1.64 2.02 -1.26 -5.08 118.70 116.52 1yho s GLU 81 Ca -0.15 -0.69 -0.30 0.00 0.02 0.00 0.00 54.97 53.85 1yho s GLU 81 Cb 0.07 -2.68 -0.09 0.00 0.10 0.00 0.00 34.13 31.53 1yho s GLU 81 CO 0.78 0.58 1.23 -1.25 0.02 0.00 0.00 175.26 176.62 1yho s PRO 82 N -2.13 4.47 0.75 0.39 0.04 -1.26 -4.99 135.00 132.27 1yho s PRO 82 Ca 0.26 1.96 -0.15 0.00 0.04 0.00 0.00 61.00 63.10 1yho s PRO 82 Cb -0.12 -3.20 -0.00 0.00 0.04 0.00 0.00 34.50 31.22 1yho s PRO 82 CO 0.18 -0.10 0.75 -2.30 0.04 0.00 0.00 177.00 175.57 1yho n PRO 83 N 2.12 0.30 -1.90 0.56 -0.02 -1.26 -4.87 135.00 129.93 1yho n PRO 83 Ca 0.03 0.15 -0.42 0.00 -2.02 0.00 0.00 63.50 61.25 1yho n PRO 83 Cb 0.44 -2.04 -0.03 0.00 -0.02 0.00 0.00 33.50 31.85 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 -3.20 4.19 0.00 -0.52 -0.44 -1.26 -2.02 119.66 116.41 1yho s GLN 84 Ca 0.68 2.37 0.00 0.00 -2.50 0.00 0.00 55.36 55.92 1yho s GLN 84 Cb -0.33 -3.55 0.00 0.00 -1.64 0.00 0.00 33.01 27.49 1yho s GLN 84 CO 0.55 -0.74 0.00 0.41 0.50 0.00 0.00 175.29 176.02 1yho n GLY 85 N 4.00 3.17 3.79 2.59 0.00 -1.26 -5.02 105.19 112.46 1yho n GLY 85 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.88 2.92 0.01 4.61 0.00 -0.86 -4.29 121.76 121.27 1yho s ALA 86 Ca 0.00 0.66 -0.18 0.00 0.00 0.00 0.00 51.96 52.44 1yho s ALA 86 Cb 0.00 -3.27 -0.30 0.00 0.00 0.00 0.00 23.12 19.55 1yho s ALA 86 CO 0.00 -0.33 1.02 0.45 0.00 0.00 0.00 175.76 176.91 1yho h HIS 87 N 1.80 0.81 -3.13 0.00 3.86 -1.68 -3.47 115.15 113.33 1yho h HIS 87 Ca -0.49 -0.53 -0.05 0.00 -1.16 0.00 0.00 60.37 58.14 1yho h HIS 87 Cb 1.22 -0.06 -0.14 0.00 1.06 0.00 0.00 27.41 29.50 1yho h HIS 87 CO 0.57 1.39 0.01 -0.06 0.86 0.00 0.00 177.93 180.69 1yho s PHE 88 N -2.80 -0.33 -0.08 2.45 0.08 -1.23 -5.07 117.98 111.00 1yho s PHE 88 Ca -0.11 0.14 0.01 0.00 0.12 0.00 0.00 56.93 57.09 1yho s PHE 88 Cb 0.04 0.33 0.02 0.00 -0.57 0.00 0.00 43.02 42.84 1yho s PHE 88 CO 0.89 -0.71 -0.09 -1.17 -0.10 0.00 0.00 175.22 174.04 1yho s LEU 89 N -2.52 1.41 0.03 -0.37 2.96 -1.26 -2.00 118.68 116.92 1yho s LEU 89 Ca -0.00 -0.28 0.06 0.00 -0.22 0.00 0.00 54.13 53.69 1yho s LEU 89 Cb 0.00 -0.79 -0.03 0.00 0.50 0.00 0.00 46.19 45.88 1yho s LEU 89 CO -0.09 -0.04 -0.14 -0.44 -1.32 0.00 0.00 176.35 174.32 1yho s SER 90 N 1.14 4.08 -0.01 3.68 0.01 -0.79 -4.93 113.70 116.89 1yho s SER 90 Ca -0.06 -0.33 -0.23 0.00 1.31 0.00 0.00 55.95 56.65 1yho s SER 90 Cb -0.14 -0.77 -0.20 0.00 0.21 0.00 0.00 66.02 65.11 1yho s SER 90 CO -0.02 0.26 1.17 0.03 0.41 0.00 0.00 173.24 175.10 1yho h ARG 91 N 4.53 0.24 -4.69 12.44 3.08 -1.89 -1.97 114.38 126.13 1yho h ARG 91 Ca -0.48 -0.19 -0.28 0.00 0.07 0.00 0.00 59.98 59.11 1yho h ARG 91 Cb 1.16 0.04 -0.15 0.00 0.08 0.00 0.00 29.97 31.10 1yho h ARG 91 CO 0.50 0.83 -0.62 0.45 -1.07 0.00 0.00 179.97 180.06 1yho s SER 92 N -6.23 0.50 0.35 7.04 0.15 -1.26 -4.02 113.70 110.24 1yho s SER 92 Ca -0.15 -1.38 0.03 0.00 0.70 0.00 0.00 55.95 55.15 1yho s SER 92 Cb 0.03 0.30 0.66 0.00 -1.71 0.00 0.00 66.02 65.30 1yho s SER 92 CO 0.75 -0.80 1.99 -0.07 1.20 0.00 0.00 173.24 176.31 1yho h LEU 93 N 2.55 0.65 -0.94 3.45 3.38 -1.99 -2.12 115.31 120.30 1yho h LEU 93 Ca -0.37 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1yho h LEU 93 Cb 1.25 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.79 1yho h LEU 93 CO 0.56 0.52 0.60 0.44 0.09 0.00 0.00 178.44 180.64 1yho h ASP 94 N 0.75 1.09 -0.09 -0.43 5.19 -1.97 0.51 116.42 121.48 1yho h ASP 94 Ca 0.20 -0.04 -0.02 0.00 -0.62 0.00 0.00 57.03 56.54 1yho h ASP 94 Cb -0.01 -0.27 -0.00 0.00 0.18 0.00 0.00 39.33 39.22 1yho h ASP 94 CO -0.04 0.81 -0.02 -0.78 -3.12 0.00 0.00 179.24 176.09 1yho h ASP 95 N 1.28 0.18 0.13 6.45 3.58 -1.81 -0.40 116.42 125.83 1yho h ASP 95 Ca 0.34 -0.37 -0.10 0.00 0.42 0.00 0.00 57.03 57.32 1yho h ASP 95 Cb -0.11 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 40.88 1yho h ASP 95 CO -0.07 0.51 -0.33 0.00 -2.88 0.00 0.00 179.24 176.47 1yho h ALA 96 N 0.67 1.16 -0.23 -0.78 0.00 -1.21 -2.12 119.26 116.76 1yho h ALA 96 Ca 0.02 -0.36 -0.14 0.00 0.00 0.00 0.00 54.91 54.43 1yho h ALA 96 Cb 0.43 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1yho h ALA 96 CO 0.01 0.55 -0.41 -0.07 0.00 0.00 0.00 179.25 179.33 1yho h LEU 97 N 0.26 0.75 -0.68 0.00 3.38 0.10 -2.06 115.31 117.06 1yho h LEU 97 Ca 0.03 -0.53 -0.07 0.00 0.09 0.00 0.00 57.88 57.39 1yho h LEU 97 Cb 0.72 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 1yho h LEU 97 CO 0.05 1.14 0.14 0.50 0.09 0.00 0.00 178.44 180.37 1yho h LYS 98 N 0.39 1.11 -0.16 1.13 1.63 -0.95 -1.10 116.57 118.62 1yho h LYS 98 Ca 0.01 -0.28 -0.02 0.00 -0.85 0.00 0.00 60.65 59.51 1yho h LYS 98 Cb 1.00 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 32.49 1yho h LYS 98 CO 0.09 1.00 0.01 1.25 -3.45 0.00 0.00 179.45 178.35 1yho h LEU 99 N 1.04 0.27 -1.78 5.20 5.85 -1.38 -0.08 115.31 124.42 1yho h LEU 99 Ca 0.21 -0.29 -0.03 0.00 0.84 0.00 0.00 57.88 58.61 1yho h LEU 99 Cb 0.41 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.36 1yho h LEU 99 CO 0.01 0.49 -0.15 0.71 -0.34 0.00 0.00 178.44 179.15 1yho h THR 100 N 0.04 0.66 0.00 1.05 1.35 -1.28 -2.17 112.91 112.56 1yho h THR 100 Ca 0.05 -0.64 -0.04 0.00 -0.55 0.00 0.00 66.41 65.23 1yho h THR 100 Cb 0.34 1.40 -0.01 0.00 -1.73 0.00 0.00 68.15 68.16 1yho h THR 100 CO 0.01 0.15 -0.76 -0.08 -0.25 0.00 0.00 175.52 174.58 1yho h GLU 101 N 0.00 0.00 -6.82 4.72 4.81 -0.92 -3.38 114.58 112.99 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 0.39 0.00 0.07 0.00 0.63 0.00 0.00 28.75 29.84 1yho h GLU 101 CO 0.02 0.10 0.74 -1.14 -0.73 0.00 0.00 179.01 178.00 1yho s GLN 102 N -3.21 4.26 0.45 1.92 0.74 -0.07 -4.61 119.66 119.13 1yho s GLN 102 Ca 0.01 2.34 0.18 0.00 0.05 0.00 0.00 55.36 57.94 1yho s GLN 102 Cb 0.08 -3.07 1.13 0.00 1.10 0.00 0.00 33.01 32.24 1yho s GLN 102 CO 0.76 -0.39 1.94 -1.35 -0.55 0.00 0.00 175.29 175.70 1yho h PRO 103 N 4.27 0.32 -0.46 1.67 0.11 -1.90 0.30 132.00 136.30 1yho h PRO 103 Ca -0.48 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.67 1yho h PRO 103 Cb 1.22 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 1yho h PRO 103 CO 0.72 0.21 0.31 1.49 -0.21 0.00 0.00 178.00 180.52 1yho h GLU 104 N 0.33 0.36 0.00 1.05 4.81 -1.90 -2.47 114.58 116.76 1yho h GLU 104 Ca 0.35 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.46 1yho h GLU 104 Cb 0.89 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 1yho h GLU 104 CO -0.09 0.24 -2.00 1.28 -0.73 0.00 0.00 179.01 177.71 1yho n LEU 105 N -4.47 0.00 0.10 1.64 4.32 -0.16 -4.36 117.00 114.07 1yho n LEU 105 Ca 0.06 0.00 0.19 0.00 -0.02 0.00 0.00 56.01 56.24 1yho n LEU 105 Cb 0.25 0.13 0.75 0.00 -1.62 0.00 0.00 43.42 42.94 1yho n LEU 105 CO 0.35 0.13 1.17 0.00 -1.22 0.00 0.00 177.39 177.82 1yho h ALA 106 N 1.52 2.14 -0.02 -1.18 0.00 -0.02 0.72 119.26 122.42 1yho h ALA 106 Ca -0.15 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 1yho h ALA 106 Cb 1.26 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 1yho h ALA 106 CO 0.01 -0.53 -0.61 -0.97 0.00 0.00 0.00 179.25 177.14 1yho h ASN 107 N 0.00 0.08 0.00 0.00 -0.73 -1.74 -3.36 115.58 109.82 1yho h ASN 107 Ca 0.18 -0.04 -0.17 0.00 1.87 0.00 0.00 56.30 58.13 1yho h ASN 107 Cb 0.86 -0.02 -0.03 0.00 0.27 0.00 0.00 38.32 39.40 1yho h ASN 107 CO -0.00 0.67 -1.39 1.17 -0.37 0.00 0.00 177.43 177.51 1yho n LYS 108 N -3.83 0.54 -4.22 6.67 3.00 0.65 -4.86 118.16 116.11 1yho n LYS 108 Ca -0.02 0.35 -0.31 0.00 -0.00 0.00 0.00 58.31 58.33 1yho n LYS 108 Cb 0.61 -1.55 -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 0.14 0.00 0.00 0.00 177.40 177.54 1yho s VAL 109 N -2.57 4.09 0.05 3.15 -7.23 0.22 -1.52 120.40 116.59 1yho s VAL 109 Ca -0.29 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.11 1yho s VAL 109 Cb 0.07 -2.88 0.00 0.00 0.56 0.00 0.00 36.38 34.13 1yho s VAL 109 CO 0.43 0.26 0.00 -0.67 -0.31 0.00 0.00 175.10 174.81 1yho n ASP 110 N 1.03 0.12 -4.74 4.85 2.03 -1.19 -3.66 116.55 114.99 1yho n ASP 110 Ca -0.13 0.09 -0.28 0.00 0.52 0.00 0.00 54.79 54.99 1yho n ASP 110 Cb 0.52 0.01 -0.07 0.00 -0.72 0.00 0.00 41.12 40.87 1yho n ASP 110 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1yho s MET 111 N -2.00 2.71 -0.02 -0.67 -1.94 -1.26 -4.23 119.30 111.89 1yho s MET 111 Ca 0.00 -0.88 0.08 0.00 -1.71 0.00 0.00 55.69 53.18 1yho s MET 111 Cb 0.00 -2.58 -0.02 0.00 2.01 0.00 0.00 34.83 34.24 1yho s MET 111 CO 0.00 0.51 -0.25 0.08 -0.01 0.00 0.00 175.02 175.34 1yho s VAL 112 N -1.58 2.11 -0.16 -6.03 1.01 -0.83 -2.27 120.40 112.65 1yho s VAL 112 Ca 0.29 -1.10 0.01 0.00 0.00 0.00 0.00 61.98 61.18 1yho s VAL 112 Cb -0.11 -1.73 0.02 0.00 0.00 0.00 0.00 36.38 34.56 1yho s VAL 112 CO 0.21 0.57 -0.17 0.26 0.00 0.00 0.00 175.10 175.97 1yho s TRP 113 N -0.62 2.43 -0.25 5.22 0.52 -0.10 -0.14 118.94 125.99 1yho s TRP 113 Ca 0.10 -1.38 -0.18 0.00 0.02 0.00 0.00 56.10 54.67 1yho s TRP 113 Cb -0.10 -1.73 -0.03 0.00 -1.15 0.00 0.00 33.47 30.47 1yho s TRP 113 CO -0.01 -0.71 0.52 0.42 0.02 0.00 0.00 176.95 177.19 1yho s ILE 114 N 1.32 5.08 -0.30 2.03 1.09 0.17 -0.98 121.20 129.60 1yho s ILE 114 Ca 0.03 0.90 0.08 0.00 -1.10 0.00 0.00 60.65 60.56 1yho s ILE 114 Cb -0.13 -3.83 0.46 0.00 -1.06 0.00 0.00 42.46 37.89 1yho s ILE 114 CO -0.10 0.10 1.18 1.33 -0.10 0.00 0.00 174.94 177.35 1yho n VAL 115 N 5.02 2.44 0.00 2.92 0.24 -0.97 -2.24 118.33 125.74 1yho n VAL 115 Ca -0.04 -4.20 0.00 0.00 -2.04 0.00 0.00 64.34 58.06 1yho n VAL 115 Cb 0.50 -1.00 0.00 0.00 -1.47 0.00 0.00 33.84 31.87 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 -0.68 1.38 0.00 7.63 0.00 -1.26 -4.81 105.19 107.45 1yho n GLY 116 Ca 0.41 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1yho n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yho n GLY 117 N 1.42 0.27 0.27 -0.02 0.00 -1.26 -3.18 105.19 102.68 1yho n GLY 117 Ca 0.00 -1.79 0.01 0.00 0.00 0.00 0.00 46.02 44.24 1yho n GLY 117 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yho h SER 118 N 0.00 0.42 -0.54 1.61 4.64 -1.99 -2.46 113.55 115.22 1yho h SER 118 Ca 0.00 -0.07 0.03 0.00 -0.47 0.00 0.00 61.79 61.27 1yho h SER 118 Cb 0.00 -0.11 -0.04 0.00 -0.31 0.00 0.00 62.40 61.94 1yho h SER 118 CO 0.00 0.49 0.33 0.28 -0.87 0.00 0.00 176.83 177.06 1yho h SER 119 N 0.44 0.52 -0.51 4.97 0.02 -2.00 -0.96 113.55 116.03 1yho h SER 119 Ca 0.10 0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 60.94 1yho h SER 119 Cb 0.30 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.72 1yho h SER 119 CO 0.01 0.37 -0.13 0.58 -1.14 0.00 0.00 176.83 176.52 1yho h VAL 120 N 0.64 1.27 -0.95 2.27 2.07 -1.79 -2.50 116.25 117.25 1yho h VAL 120 Ca 0.22 -1.28 -0.00 0.00 0.82 0.00 0.00 66.70 66.46 1yho h VAL 120 Cb 0.03 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 30.75 1yho h VAL 120 CO -0.10 0.45 0.59 1.88 0.02 0.00 0.00 177.57 180.40 1yho h TYR 121 N 0.89 1.24 0.13 1.57 -1.99 -0.98 0.24 116.97 118.06 1yho h TYR 121 Ca 0.13 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.86 1yho h TYR 121 Cb 0.69 -0.41 0.00 0.00 2.00 0.00 0.00 36.73 39.01 1yho h TYR 121 CO 0.05 0.82 -0.06 -0.22 -0.00 0.00 0.00 178.16 178.74 1yho h LYS 122 N 1.31 -0.16 -0.25 4.88 1.63 -1.02 0.29 116.57 123.24 1yho h LYS 122 Ca 0.34 0.01 0.01 0.00 -0.85 0.00 0.00 60.65 60.17 1yho h LYS 122 Cb -0.08 0.04 -0.02 0.00 -0.60 0.00 0.00 32.23 31.57 1yho h LYS 122 CO -0.07 0.11 0.14 1.49 -3.45 0.00 0.00 179.45 177.67 1yho h GLU 123 N -0.44 0.28 0.00 1.90 4.57 -1.27 -1.86 114.58 117.77 1yho h GLU 123 Ca -0.02 -0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.11 1yho h GLU 123 Cb 0.35 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.87 1yho h GLU 123 CO 0.03 0.19 -0.17 0.00 -1.18 0.00 0.00 179.01 177.87 1yho h ALA 124 N 1.12 1.29 0.00 2.92 0.00 -0.95 -2.36 119.26 121.29 1yho h ALA 124 Ca 0.10 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1yho h ALA 124 Cb 0.01 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1yho h ALA 124 CO -0.06 0.22 0.00 1.98 0.00 0.00 0.00 179.25 181.39 1yho h MET 125 N 0.00 0.00 -0.74 0.00 -1.53 -0.05 -0.31 114.93 112.30 1yho h MET 125 Ca -0.00 0.00 -0.03 0.00 -3.44 0.00 0.00 59.70 56.23 1yho h MET 125 Cb 0.43 0.00 -0.02 0.00 -0.55 0.00 0.00 31.60 31.47 1yho h MET 125 CO 0.02 0.00 0.03 -1.71 0.14 0.00 0.00 176.91 175.40 1yho n ASN 126 N -3.01 4.14 -4.58 1.39 2.85 -0.89 -4.88 115.26 110.28 1yho n ASN 126 Ca -0.03 -2.66 -0.43 0.00 -0.11 0.00 0.00 54.58 51.36 1yho n ASN 126 Cb 0.07 -0.63 -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 -2.19 3.03 0.24 1.20 3.76 -0.13 -4.93 115.29 116.28 1yho s HIS 127 Ca 0.37 0.49 -0.02 0.00 -0.15 0.00 0.00 55.06 55.75 1yho s HIS 127 Cb 0.28 -3.67 0.28 0.00 1.11 0.00 0.00 32.58 30.58 1yho s HIS 127 CO 0.10 -0.91 1.71 -1.35 -0.85 0.00 0.00 174.74 173.44 1yho h PRO 128 N 8.74 0.76 -7.09 8.40 0.11 -1.89 -3.45 132.00 137.57 1yho h PRO 128 Ca -0.24 -0.25 -0.39 0.00 0.11 0.00 0.00 66.00 65.24 1yho h PRO 128 Cb 1.08 -0.07 0.21 0.00 0.11 0.00 0.00 31.00 32.34 1yho h PRO 128 CO 0.97 0.84 -0.08 0.20 -0.21 0.00 0.00 178.00 179.72 1yho s GLY 129 N -3.80 1.44 0.15 -0.55 0.00 -1.26 -4.38 107.32 98.92 1yho s GLY 129 Ca -0.09 -0.87 -0.31 0.00 0.00 0.00 0.00 44.72 43.44 1yho s GLY 129 CO 0.82 0.14 1.76 0.30 0.00 0.00 0.00 173.10 176.11 1yho s HIS 130 N -2.38 2.48 -0.09 1.90 3.76 -1.26 -4.91 115.29 114.79 1yho s HIS 130 Ca 0.69 0.17 -0.06 0.00 -0.15 0.00 0.00 55.06 55.71 1yho s HIS 130 Cb -0.12 -4.13 0.04 0.00 1.11 0.00 0.00 32.58 29.48 1yho s HIS 130 CO 0.57 -4.50 0.23 -1.17 -0.85 0.00 0.00 174.74 169.03 1yho s LEU 131 N 2.11 0.75 -0.13 0.89 2.96 -1.26 -4.22 118.68 119.78 1yho s LEU 131 Ca 0.78 0.48 -0.06 0.00 -0.22 0.00 0.00 54.13 55.10 1yho s LEU 131 Cb -0.46 0.73 -0.04 0.00 0.50 0.00 0.00 46.19 46.92 1yho s LEU 131 CO 0.34 -0.13 0.09 -0.54 -1.32 0.00 0.00 176.35 174.79 1yho s LYS 132 N 0.75 3.53 -0.16 1.98 3.01 -0.93 -1.62 119.74 126.30 1yho s LYS 132 Ca -0.05 -0.26 -0.01 0.00 -1.01 0.00 0.00 55.97 54.64 1yho s LYS 132 Cb -0.07 -3.12 0.04 0.00 -1.01 0.00 0.00 37.83 33.68 1yho s LYS 132 CO -0.04 0.59 -0.04 -1.17 0.51 0.00 0.00 175.35 175.20 1yho s LEU 133 N -0.52 1.49 -0.29 3.17 0.20 0.74 0.98 118.68 124.44 1yho s LEU 133 Ca 0.11 -0.63 -0.07 0.00 0.69 0.00 0.00 54.13 54.22 1yho s LEU 133 Cb -0.12 -0.84 -0.00 0.00 -0.43 0.00 0.00 46.19 44.80 1yho s LEU 133 CO 0.02 -0.20 0.09 -0.36 -0.29 0.00 0.00 176.35 175.61 1yho s PHE 134 N 1.68 3.14 -0.21 5.38 0.40 0.24 0.10 117.98 128.71 1yho s PHE 134 Ca 0.01 -0.80 -0.03 0.00 -0.60 0.00 0.00 56.93 55.51 1yho s PHE 134 Cb -0.15 -2.27 -0.00 0.00 0.51 0.00 0.00 43.02 41.11 1yho s PHE 134 CO -0.07 -0.52 -0.08 0.08 0.70 0.00 0.00 175.22 175.33 1yho s VAL 135 N 1.54 3.05 -0.32 -0.44 1.01 -0.16 -0.56 120.40 124.52 1yho s VAL 135 Ca 0.04 -0.61 -0.12 0.00 0.00 0.00 0.00 61.98 61.29 1yho s VAL 135 Cb -0.17 -2.37 -0.02 0.00 0.00 0.00 0.00 36.38 33.83 1yho s VAL 135 CO 0.03 0.45 0.20 -0.89 0.00 0.00 0.00 175.10 174.89 1yho s THR 136 N 1.43 5.05 -0.17 3.92 2.01 -0.87 -1.22 115.64 125.78 1yho s THR 136 Ca 0.06 -0.25 -0.21 0.00 0.31 0.00 0.00 61.69 61.60 1yho s THR 136 Cb -0.14 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.78 1yho s THR 136 CO -0.06 0.04 0.63 -0.13 -0.69 0.00 0.00 174.62 174.42 1yho s ARG 137 N 1.69 4.25 -0.32 4.92 0.52 -0.21 0.68 118.95 130.49 1yho s ARG 137 Ca 0.06 0.65 -0.10 0.00 -0.52 0.00 0.00 55.73 55.81 1yho s ARG 137 Cb -0.17 -3.55 -0.00 0.00 0.52 0.00 0.00 34.95 31.75 1yho s ARG 137 CO 0.09 -0.17 0.16 0.42 0.02 0.00 0.00 175.30 175.82 1yho s ILE 138 N 1.66 4.60 -1.27 1.52 -1.09 0.09 -0.28 121.20 126.42 1yho s ILE 138 Ca 0.30 -0.46 -0.19 0.00 -2.23 0.00 0.00 60.65 58.06 1yho s ILE 138 Cb -0.16 -3.37 0.03 0.00 -1.58 0.00 0.00 42.46 37.38 1yho s ILE 138 CO 0.11 0.04 1.80 0.23 -1.23 0.00 0.00 174.94 175.90 1yho n MET 139 N 4.98 2.77 -3.50 2.79 2.81 -0.27 -0.57 117.12 126.14 1yho n MET 139 Ca -0.14 -3.04 0.00 0.00 -1.81 0.00 0.00 57.70 52.71 1yho n MET 139 Cb 0.49 -3.55 -0.05 0.00 -0.71 0.00 0.00 33.22 29.40 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 4.77 0.31 0.01 0.03 -1.52 -1.26 -4.34 119.66 117.66 1yho s GLN 140 Ca 0.57 0.66 -0.30 0.00 -1.95 0.00 0.00 55.36 54.35 1yho s GLN 140 Cb 0.03 0.28 -0.06 0.00 -0.22 0.00 0.00 33.01 33.04 1yho s GLN 140 CO 0.09 -0.09 1.45 0.34 -0.25 0.00 0.00 175.29 176.83 1yho s ASP 141 N 1.97 6.80 0.08 5.90 -1.08 -1.26 -4.22 116.67 124.86 1yho s ASP 141 Ca -0.05 2.18 -0.13 0.00 -0.52 0.00 0.00 52.55 54.03 1yho s ASP 141 Cb -0.05 -2.56 0.02 0.00 -1.46 0.00 0.00 42.92 38.87 1yho s ASP 141 CO -0.16 -0.76 0.30 -0.36 0.52 0.00 0.00 175.17 174.71 1yho s PHE 142 N 2.49 -0.05 0.12 -5.34 0.08 -1.26 -5.10 117.98 108.92 1yho s PHE 142 Ca 0.66 -0.24 -0.30 0.00 0.12 0.00 0.00 56.93 57.16 1yho s PHE 142 Cb -0.33 0.10 -0.06 0.00 -0.57 0.00 0.00 43.02 42.16 1yho s PHE 142 CO 0.27 -0.58 0.98 -1.21 -0.10 0.00 0.00 175.22 174.58 1yho s GLU 143 N -3.40 4.69 -0.00 0.44 8.01 -1.26 -4.90 118.70 122.28 1yho s GLU 143 Ca 0.01 1.49 -0.01 0.00 0.01 0.00 0.00 54.97 56.47 1yho s GLU 143 Cb 0.02 -3.36 -0.00 0.00 -4.31 0.00 0.00 34.13 26.48 1yho s GLU 143 CO -0.09 0.20 0.02 -1.12 0.01 0.00 0.00 175.26 174.28 1yho s SER 144 N -0.03 0.03 -0.17 -0.19 0.01 -1.26 -4.69 113.70 107.39 1yho s SER 144 Ca 0.47 -0.08 0.08 0.00 1.31 0.00 0.00 55.95 57.74 1yho s SER 144 Cb -0.24 0.07 -0.22 0.00 0.21 0.00 0.00 66.02 65.83 1yho s SER 144 CO 0.30 -0.09 0.14 0.47 0.41 0.00 0.00 173.24 174.48 1yho n ASP 145 N 2.68 1.09 -4.55 2.44 8.00 -1.23 -4.91 116.55 120.06 1yho n ASP 145 Ca -0.15 0.07 -0.34 0.00 0.71 0.00 0.00 54.79 55.08 1yho n ASP 145 Cb 0.59 0.08 -0.11 0.00 -0.02 0.00 0.00 41.12 41.66 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 -2.53 4.01 0.05 -3.53 2.01 -1.23 -5.09 115.64 109.33 1yho s THR 146 Ca -0.18 -0.33 0.04 0.00 0.31 0.00 0.00 61.69 61.53 1yho s THR 146 Cb 0.07 -2.74 -0.04 0.00 0.01 0.00 0.00 72.50 69.81 1yho s THR 146 CO 0.75 0.52 -0.05 -0.36 -0.69 0.00 0.00 174.62 174.80 1yho s PHE 147 N -0.00 2.90 -0.06 4.92 0.40 -1.26 -2.62 117.98 122.27 1yho s PHE 147 Ca 0.01 -0.05 -0.19 0.00 -0.60 0.00 0.00 56.93 56.10 1yho s PHE 147 Cb -0.13 -1.55 -0.05 0.00 0.51 0.00 0.00 43.02 41.80 1yho s PHE 147 CO 0.02 0.42 0.52 0.12 0.70 0.00 0.00 175.22 177.01 1yho s PHE 148 N -1.15 3.61 0.63 0.36 5.36 -0.73 -4.98 117.98 121.08 1yho s PHE 148 Ca 0.21 1.04 -0.18 0.00 -0.96 0.00 0.00 56.93 57.04 1yho s PHE 148 Cb -0.11 -2.55 -0.04 0.00 -0.34 0.00 0.00 43.02 39.97 1yho s PHE 148 CO 0.12 0.30 0.84 -2.30 -1.46 0.00 0.00 175.22 172.73 1yho n PRO 149 N 3.06 0.70 -2.27 10.12 -0.02 -1.26 -4.89 135.00 140.43 1yho n PRO 149 Ca -0.08 0.28 -0.43 0.00 -2.02 0.00 0.00 63.50 61.26 1yho n PRO 149 Cb 0.51 -2.06 -0.02 0.00 -0.02 0.00 0.00 33.50 31.91 1yho n PRO 149 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1yho s GLU 150 N -2.74 4.23 0.20 -0.52 2.12 -1.26 -4.99 118.70 115.74 1yho s GLU 150 Ca 0.74 1.87 -0.30 0.00 0.36 0.00 0.00 54.97 57.64 1yho s GLU 150 Cb -0.40 -3.78 -0.08 0.00 0.26 0.00 0.00 34.13 30.13 1yho s GLU 150 CO 0.49 -0.71 1.09 0.42 -0.54 0.00 0.00 175.26 176.02 1yho s ILE 151 N 3.39 3.81 -0.13 -3.70 1.01 -1.26 -5.04 121.20 119.28 1yho s ILE 151 Ca 0.62 1.61 -0.07 0.00 0.00 0.00 0.00 60.65 62.81 1yho s ILE 151 Cb -0.27 -4.03 -0.04 0.00 0.01 0.00 0.00 42.46 38.13 1yho s ILE 151 CO 0.21 0.30 0.13 -1.81 0.00 0.00 0.00 174.94 173.78 1yho s ASP 152 N -0.27 6.31 0.24 3.58 1.11 -1.26 -5.00 116.67 121.39 1yho s ASP 152 Ca 0.48 0.42 0.10 0.00 0.18 0.00 0.00 52.55 53.74 1yho s ASP 152 Cb -0.30 -2.05 0.21 0.00 1.07 0.00 0.00 42.92 41.86 1yho s ASP 152 CO 0.36 0.37 1.52 -0.07 1.18 0.00 0.00 175.17 178.53 1yho h LEU 153 N 5.24 0.00 -1.33 1.23 3.38 -1.97 0.38 115.31 122.25 1yho h LEU 153 Ca -0.53 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.38 1yho h LEU 153 Cb 1.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 1yho h LEU 153 CO 0.61 0.70 -0.29 -0.08 0.09 0.00 0.00 178.44 179.47 1yho h GLU 154 N 0.00 0.08 0.00 1.13 4.57 -2.01 -3.23 114.58 115.12 1yho h GLU 154 Ca -0.01 -0.02 -0.38 0.00 -1.18 0.00 0.00 59.36 57.77 1yho h GLU 154 Cb 1.28 -0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 29.79 1yho h GLU 154 CO 0.09 0.36 -2.45 1.63 -1.18 0.00 0.00 179.01 177.47 1yho n LYS 155 N -4.17 0.66 -4.26 1.92 5.02 -1.17 -4.98 118.16 111.17 1yho n LYS 155 Ca -0.02 0.11 -0.31 0.00 -2.02 0.00 0.00 58.31 56.08 1yho n LYS 155 Cb 0.35 -1.52 -0.09 0.00 -0.02 0.00 0.00 35.03 33.75 1yho n LYS 155 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1yho s TYR 156 N -2.51 2.87 -0.25 2.13 1.51 0.13 -2.07 117.35 119.16 1yho s TYR 156 Ca -0.28 -0.08 -0.10 0.00 -1.01 0.00 0.00 57.07 55.60 1yho s TYR 156 Cb 0.08 -1.52 -0.05 0.00 -0.11 0.00 0.00 41.96 40.36 1yho s TYR 156 CO 0.65 0.43 0.15 0.21 -1.11 0.00 0.00 175.55 175.88 1yho s LYS 157 N -2.00 3.95 -0.31 -0.62 2.20 -0.21 -4.01 119.74 118.74 1yho s LYS 157 Ca 0.22 -0.33 -0.29 0.00 -0.36 0.00 0.00 55.97 55.21 1yho s LYS 157 Cb -0.11 -3.52 -0.00 0.00 -1.51 0.00 0.00 37.83 32.68 1yho s LYS 157 CO 0.13 -0.06 1.41 -1.17 -0.36 0.00 0.00 175.35 175.30 1yho s LEU 158 N 1.36 3.80 -0.55 5.43 0.20 -1.26 -1.98 118.68 125.68 1yho s LEU 158 Ca 0.07 1.19 0.01 0.00 0.69 0.00 0.00 54.13 56.09 1yho s LEU 158 Cb -0.15 -3.54 0.14 0.00 -0.43 0.00 0.00 46.19 42.22 1yho s LEU 158 CO 0.07 -1.22 0.31 -0.76 -0.29 0.00 0.00 176.35 174.45 1yho s LEU 159 N 4.88 4.67 0.08 -0.68 1.02 0.12 -4.99 118.68 123.78 1yho s LEU 159 Ca 0.61 -2.91 -0.29 0.00 0.02 0.00 0.00 54.13 51.56 1yho s LEU 159 Cb -0.18 -1.72 -0.13 0.00 0.02 0.00 0.00 46.19 44.19 1yho s LEU 159 CO 0.27 -0.29 1.46 -0.65 0.02 0.00 0.00 176.35 177.16 1yho h PRO 160 N 6.75 -0.69 -5.04 1.29 0.11 -1.93 -1.72 132.00 130.78 1yho h PRO 160 Ca -0.06 0.05 -0.66 0.00 0.11 0.00 0.00 66.00 65.44 1yho h PRO 160 Cb 0.92 0.16 -0.29 0.00 0.11 0.00 0.00 31.00 31.90 1yho h PRO 160 CO 0.69 -0.46 -0.75 -1.83 -0.21 0.00 0.00 178.00 175.44 1yho s GLU 161 N -5.30 3.30 0.02 1.05 -1.05 -1.26 -4.34 118.70 111.11 1yho s GLU 161 Ca -0.14 -0.67 0.07 0.00 -0.15 0.00 0.00 54.97 54.08 1yho s GLU 161 Cb 0.04 -2.88 -0.02 0.00 -0.44 0.00 0.00 34.13 30.83 1yho s GLU 161 CO 0.50 -0.16 -0.21 -0.47 0.95 0.00 0.00 175.26 175.86 1yho s TYR 162 N 1.33 1.88 0.24 4.83 6.14 -1.26 -5.07 117.35 125.43 1yho s TYR 162 Ca 0.04 -0.37 -0.31 0.00 0.64 0.00 0.00 57.07 57.07 1yho s TYR 162 Cb -0.14 -1.16 -0.14 0.00 0.42 0.00 0.00 41.96 40.94 1yho s TYR 162 CO -0.04 0.03 1.38 -2.30 0.64 0.00 0.00 175.55 175.26 1yho n PRO 163 N 2.19 1.96 0.00 4.97 -0.02 -1.26 -1.96 135.00 140.88 1yho n PRO 163 Ca -0.16 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.02 1yho n PRO 163 Cb 0.53 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 1yho n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yho n GLY 164 N 2.07 2.74 3.89 -1.23 0.00 -1.26 -5.01 105.19 106.39 1yho n GLY 164 Ca 0.11 -0.42 -0.36 0.00 0.00 0.00 0.00 46.02 45.36 1yho n GLY 164 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yho s VAL 165 N -1.38 5.47 0.12 1.61 0.11 -0.83 -5.07 120.40 120.44 1yho s VAL 165 Ca 0.00 0.11 -0.30 0.00 -2.93 0.00 0.00 61.98 58.86 1yho s VAL 165 Cb 0.00 -3.45 -0.07 0.00 -1.53 0.00 0.00 36.38 31.33 1yho s VAL 165 CO 0.00 0.53 1.24 -0.76 -3.33 0.00 0.00 175.10 172.77 1yho s LEU 166 N -1.32 4.40 -0.13 2.54 1.43 -1.26 -4.44 118.68 119.91 1yho s LEU 166 Ca 0.19 2.17 0.17 0.00 -1.03 0.00 0.00 54.13 55.63 1yho s LEU 166 Cb -0.12 -3.59 -0.24 0.00 0.03 0.00 0.00 46.19 42.26 1yho s LEU 166 CO 0.09 -0.47 0.30 -1.20 0.23 0.00 0.00 176.35 175.30 1yho n SER 167 N 3.34 0.29 -4.76 2.29 7.64 -1.26 -4.55 113.62 116.61 1yho n SER 167 Ca 0.08 0.14 -0.38 0.00 1.01 0.00 0.00 58.87 59.71 1yho n SER 167 Cb 0.45 0.72 0.01 0.00 -1.01 0.00 0.00 64.21 64.38 1yho n SER 167 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1yho s ASP 168 N -5.62 5.81 0.25 6.43 1.11 -1.26 -4.69 116.67 118.70 1yho s ASP 168 Ca -0.08 2.64 -0.30 0.00 0.18 0.00 0.00 52.55 55.00 1yho s ASP 168 Cb 0.07 -2.63 -0.10 0.00 1.07 0.00 0.00 42.92 41.33 1yho s ASP 168 CO 0.83 -1.19 1.37 -0.69 1.18 0.00 0.00 175.17 176.66 1yho s VAL 169 N -1.34 2.86 0.23 -1.27 1.01 -1.26 -4.76 120.40 115.86 1yho s VAL 169 Ca 0.65 0.74 0.06 0.00 0.00 0.00 0.00 61.98 63.43 1yho s VAL 169 Cb -0.37 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 1yho s VAL 169 CO 0.46 0.13 0.21 -1.10 0.00 0.00 0.00 175.10 174.80 1yho s GLN 170 N -0.60 3.02 -0.14 2.72 1.11 -0.75 -4.97 119.66 120.04 1yho s GLN 170 Ca 0.56 -0.95 -0.07 0.00 0.01 0.00 0.00 55.36 54.91 1yho s GLN 170 Cb -0.40 -2.65 0.06 0.00 -1.01 0.00 0.00 33.01 29.02 1yho s GLN 170 CO 0.44 0.43 0.33 -2.00 0.01 0.00 0.00 175.29 174.49 1yho s GLU 171 N -3.68 0.27 -0.04 2.91 2.12 -1.26 -1.50 118.70 117.53 1yho s GLU 171 Ca 0.33 0.73 -0.01 0.00 0.36 0.00 0.00 54.97 56.37 1yho s GLU 171 Cb -0.09 -0.01 0.03 0.00 0.26 0.00 0.00 34.13 34.33 1yho s GLU 171 CO 0.25 -0.20 0.07 -1.21 -0.54 0.00 0.00 175.26 173.64 1yho s GLU 172 N 1.73 -0.02 -1.62 4.30 8.01 0.33 -4.83 118.70 126.59 1yho s GLU 172 Ca -0.06 0.32 -0.01 0.00 0.01 0.00 0.00 54.97 55.23 1yho s GLU 172 Cb -0.10 -0.32 0.00 0.00 -4.31 0.00 0.00 34.13 29.40 1yho s GLU 172 CO -0.11 -0.24 0.07 1.17 0.01 0.00 0.00 175.26 176.17 1yho n LYS 173 N 4.67 -2.13 -0.41 1.61 4.81 -1.26 -0.52 118.16 124.93 1yho n LYS 173 Ca -0.17 0.92 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 1yho n LYS 173 Cb 0.50 -5.59 0.00 0.00 0.02 0.00 0.00 35.03 29.96 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 1.26 3.54 3.14 0.00 -1.26 -5.02 105.19 105.83 1yho n GLY 174 Ca -0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 1yho n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yho s ILE 175 N -3.07 5.16 0.00 -0.61 1.01 0.32 -5.07 121.20 118.94 1yho s ILE 175 Ca 0.00 0.07 -0.00 0.00 0.00 0.00 0.00 60.65 60.72 1yho s ILE 175 Cb 0.00 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 1yho s ILE 175 CO 0.00 -0.10 0.10 -0.75 0.00 0.00 0.00 174.94 174.18 1yho s LYS 176 N 2.04 3.10 0.11 2.79 2.20 -1.26 -0.51 119.74 128.22 1yho s LYS 176 Ca 0.12 -0.48 -0.17 0.00 -0.36 0.00 0.00 55.97 55.08 1yho s LYS 176 Cb -0.16 -2.88 0.04 0.00 -1.51 0.00 0.00 37.83 33.31 1yho s LYS 176 CO 0.12 0.64 0.41 1.52 -0.36 0.00 0.00 175.35 177.68 1yho s TYR 177 N -1.23 -0.23 -0.05 4.03 1.13 -0.56 -1.11 117.35 119.32 1yho s TYR 177 Ca 0.24 -0.03 0.06 0.00 -1.41 0.00 0.00 57.07 55.93 1yho s TYR 177 Cb -0.12 0.27 -0.01 0.00 -1.10 0.00 0.00 41.96 41.00 1yho s TYR 177 CO 0.15 -0.68 -0.22 0.15 -2.51 0.00 0.00 175.55 172.44 1yho s LYS 178 N -3.55 2.28 -0.22 -3.49 1.02 0.61 -1.82 119.74 114.57 1yho s LYS 178 Ca 0.01 -0.81 -0.21 0.00 0.02 0.00 0.00 55.97 54.99 1yho s LYS 178 Cb 0.01 -1.95 -0.02 0.00 -0.52 0.00 0.00 37.83 35.35 1yho s LYS 178 CO -0.10 0.34 0.65 -0.06 -0.92 0.00 0.00 175.35 175.25 1yho s PHE 179 N -0.11 3.34 -0.05 3.18 0.08 -1.26 -1.04 117.98 122.12 1yho s PHE 179 Ca -0.03 0.91 0.05 0.00 0.12 0.00 0.00 56.93 57.98 1yho s PHE 179 Cb -0.13 -2.83 -0.02 0.00 -0.57 0.00 0.00 43.02 39.47 1yho s PHE 179 CO 0.03 -0.24 -0.20 -2.00 -0.10 0.00 0.00 175.22 172.71 1yho s GLU 180 N 2.17 2.52 -0.14 0.44 2.12 -0.36 -4.84 118.70 120.62 1yho s GLU 180 Ca 0.28 -0.82 -0.03 0.00 0.36 0.00 0.00 54.97 54.77 1yho s GLU 180 Cb -0.16 -2.26 -0.03 0.00 0.26 0.00 0.00 34.13 31.95 1yho s GLU 180 CO 0.10 0.49 -0.04 0.08 -0.54 0.00 0.00 175.26 175.34 1yho s VAL 181 N -0.40 3.92 -0.05 3.70 1.01 -0.65 -0.98 120.40 126.95 1yho s VAL 181 Ca 0.04 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 61.70 1yho s VAL 181 Cb -0.12 -2.69 -0.00 0.00 0.00 0.00 0.00 36.38 33.56 1yho s VAL 181 CO 0.02 0.52 -0.17 -0.31 0.00 0.00 0.00 175.10 175.15 1yho s TYR 182 N 0.06 1.76 0.08 5.22 2.02 0.29 0.10 117.35 126.88 1yho s TYR 182 Ca -0.00 -0.52 0.04 0.00 -0.37 0.00 0.00 57.07 56.22 1yho s TYR 182 Cb -0.13 -1.19 -0.04 0.00 -0.40 0.00 0.00 41.96 40.20 1yho s TYR 182 CO 0.03 -0.18 -0.00 -2.00 -1.57 0.00 0.00 175.55 171.82 1yho s GLU 183 N 0.08 2.58 -0.35 -0.62 2.12 -0.84 -0.19 118.70 121.48 1yho s GLU 183 Ca -0.05 -0.80 -0.12 0.00 0.36 0.00 0.00 54.97 54.35 1yho s GLU 183 Cb -0.12 -2.56 -0.00 0.00 0.26 0.00 0.00 34.13 31.71 1yho s GLU 183 CO 0.03 0.55 0.23 0.21 -0.54 0.00 0.00 175.26 175.74 1yho s LYS 184 N -2.19 3.24 -0.08 4.30 2.36 -0.64 -1.04 119.74 125.69 1yho s LYS 184 Ca 0.25 -0.81 0.01 0.00 -2.55 0.00 0.00 55.97 52.87 1yho s LYS 184 Cb -0.12 -3.78 -0.03 0.00 -1.05 0.00 0.00 37.83 32.85 1yho s LYS 184 CO 0.17 -0.54 -0.11 1.21 1.55 0.00 0.00 175.35 177.63 1yho s ASN 185 N 1.67 4.31 0.00 1.43 3.04 -0.88 -4.22 114.94 120.29 1yho s ASN 185 Ca 0.05 -0.15 0.00 0.00 0.04 0.00 0.00 52.86 52.80 1yho s ASN 185 Cb -0.18 -1.17 0.00 0.00 -1.54 0.00 0.00 41.25 38.37 1yho s ASN 185 CO 0.09 0.31 0.00 -0.67 -3.04 0.00 0.00 177.10 173.79