#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 0.66 3.08 7.63 0.00 -1.26 -4.95 105.19 110.35 1yho n GLY 2 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.98 4.43 -0.27 1.61 0.01 -1.26 -4.85 113.70 110.40 1yho s SER 3 Ca 0.00 -1.36 -0.04 0.00 1.31 0.00 0.00 55.95 55.86 1yho s SER 3 Cb 0.00 -1.56 0.01 0.00 0.21 0.00 0.00 66.02 64.68 1yho s SER 3 CO 0.00 -0.19 0.01 -0.76 0.41 0.00 0.00 173.24 172.71 1yho s LEU 4 N 1.12 3.48 -0.02 2.44 1.02 -1.26 -1.97 118.68 123.48 1yho s LEU 4 Ca -0.08 -0.72 0.05 0.00 0.02 0.00 0.00 54.13 53.39 1yho s LEU 4 Cb -0.20 -1.78 -0.03 0.00 0.02 0.00 0.00 46.19 44.20 1yho s LEU 4 CO -0.05 -0.14 -0.15 0.20 0.02 0.00 0.00 176.35 176.22 1yho s ASN 5 N 1.43 3.96 0.02 2.29 -0.87 0.95 -1.97 114.94 120.75 1yho s ASN 5 Ca 0.02 -0.26 0.03 0.00 -1.57 0.00 0.00 52.86 51.08 1yho s ASN 5 Cb -0.17 -0.78 -0.02 0.00 -0.02 0.00 0.00 41.25 40.27 1yho s ASN 5 CO -0.01 0.32 -0.10 0.00 -2.57 0.00 0.00 177.10 174.74 1yho s ILE 7 N -0.68 -0.25 0.04 0.00 2.07 -0.94 0.98 121.20 122.41 1yho s ILE 7 Ca -0.00 0.14 -0.15 0.00 -1.41 0.00 0.00 60.65 59.23 1yho s ILE 7 Cb -0.06 -0.58 0.02 0.00 0.13 0.00 0.00 42.46 41.97 1yho s ILE 7 CO 0.00 0.06 0.32 0.68 -1.91 0.00 0.00 174.94 174.10 1yho s VAL 8 N 1.85 0.07 0.08 4.00 -7.23 0.14 -4.59 120.40 114.72 1yho s VAL 8 Ca -0.06 -0.62 0.02 0.00 -1.81 0.00 0.00 61.98 59.51 1yho s VAL 8 Cb -0.10 -0.91 -0.04 0.00 0.56 0.00 0.00 36.38 35.89 1yho s VAL 8 CO -0.12 -0.34 0.16 0.00 -0.31 0.00 0.00 175.10 174.49 1yho s ALA 9 N -2.41 3.80 -0.02 1.32 0.00 -1.26 -1.49 121.76 121.71 1yho s ALA 9 Ca -0.06 -0.94 -0.05 0.00 0.00 0.00 0.00 51.96 50.91 1yho s ALA 9 Cb -0.01 -1.64 0.00 0.00 0.00 0.00 0.00 23.12 21.47 1yho s ALA 9 CO -0.02 0.76 0.11 0.14 0.00 0.00 0.00 175.76 176.75 1yho s VAL 10 N -1.48 0.05 0.78 0.00 -7.23 0.21 -4.72 120.40 108.01 1yho s VAL 10 Ca 0.32 -0.39 -0.12 0.00 -1.81 0.00 0.00 61.98 59.99 1yho s VAL 10 Cb -0.12 -0.29 0.06 0.00 0.56 0.00 0.00 36.38 36.59 1yho s VAL 10 CO 0.25 -0.21 1.12 -0.94 -0.31 0.00 0.00 175.10 175.01 1yho s SER 11 N -0.70 4.74 0.63 4.85 1.04 0.82 -0.23 113.70 124.84 1yho s SER 11 Ca -0.08 1.07 0.36 0.00 0.48 0.00 0.00 55.95 57.79 1yho s SER 11 Cb -0.05 -1.76 2.09 0.00 0.10 0.00 0.00 66.02 66.40 1yho s SER 11 CO 0.01 -1.79 2.30 -0.61 0.98 0.00 0.00 173.24 174.12 1yho h GLN 12 N -0.97 0.00 -0.82 4.02 4.15 -1.14 -0.15 115.11 120.20 1yho h GLN 12 Ca -0.46 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 58.75 1yho h GLN 12 Cb 1.28 0.00 -0.12 0.00 0.21 0.00 0.00 27.48 28.85 1yho h GLN 12 CO 0.63 0.00 0.26 0.09 -1.93 0.00 0.00 178.83 177.87 1yho n ASN 13 N -3.49 4.27 -2.17 -0.69 4.13 -1.26 -4.87 115.26 111.18 1yho n ASN 13 Ca -0.03 -3.02 -0.19 0.00 1.68 0.00 0.00 54.58 53.03 1yho n ASN 13 Cb 0.09 -0.71 -0.00 0.00 -1.54 0.00 0.00 39.78 37.62 1yho n ASN 13 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 1yho n MET 14 N -0.13 -1.82 -3.28 3.52 2.81 -0.07 -4.94 117.12 113.20 1yho n MET 14 Ca 0.35 0.88 -0.25 0.00 -1.81 0.00 0.00 57.70 56.87 1yho n MET 14 Cb 1.23 -5.42 -0.01 0.00 -0.71 0.00 0.00 33.22 28.31 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 -2.24 1.45 0.00 3.03 0.00 -1.23 -1.63 107.32 106.70 1yho s GLY 15 Ca 0.03 -0.80 0.00 0.00 0.00 0.00 0.00 44.72 43.95 1yho s GLY 15 CO 0.04 -0.72 0.00 0.29 0.00 0.00 0.00 173.10 172.71 1yho n ILE 16 N -1.69 0.00 0.00 0.90 -6.64 -1.18 -0.13 119.36 110.63 1yho n ILE 16 Ca -0.04 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.94 1yho n ILE 16 Cb 0.56 -0.38 0.00 0.00 -1.44 0.00 0.00 39.64 38.37 1yho n ILE 16 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 1yho n GLY 17 N 2.83 1.69 3.23 3.28 0.00 -1.26 -4.40 105.19 110.55 1yho n GLY 17 Ca 0.00 -0.47 -0.32 0.00 0.00 0.00 0.00 46.02 45.23 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 3.11 -1.68 1.61 -2.85 0.18 -2.98 119.74 115.13 1yho s LYS 18 Ca 0.00 -0.83 0.00 0.00 -1.00 0.00 0.00 55.97 54.14 1yho s LYS 18 Cb 0.00 -2.44 0.00 0.00 -2.06 0.00 0.00 37.83 33.33 1yho s LYS 18 CO 0.00 0.09 0.00 0.09 0.10 0.00 0.00 175.35 175.63 1yho n ASN 19 N 3.79 -5.36 0.00 0.03 3.02 -1.26 -1.67 115.26 113.81 1yho n ASN 19 Ca -0.19 0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.45 1yho n ASN 19 Cb 0.52 -4.44 0.00 0.00 -0.61 0.00 0.00 39.78 35.26 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 -0.94 0.42 3.09 7.41 0.00 -1.26 -5.05 105.19 108.86 1yho n GLY 20 Ca -0.21 -1.01 -0.16 0.00 0.00 0.00 0.00 46.02 44.63 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 -2.95 1.20 0.40 1.61 1.11 -0.67 -4.94 116.67 112.44 1yho s ASP 21 Ca 0.00 -0.47 -0.26 0.00 0.18 0.00 0.00 52.55 52.00 1yho s ASP 21 Cb 0.00 -0.03 -0.09 0.00 1.07 0.00 0.00 42.92 43.87 1yho s ASP 21 CO 0.00 -0.08 1.28 -0.76 1.18 0.00 0.00 175.17 176.79 1yho s LEU 22 N -1.28 4.21 0.29 1.23 1.43 -1.26 0.50 118.68 123.80 1yho s LEU 22 Ca -0.04 2.60 0.01 0.00 -1.03 0.00 0.00 54.13 55.67 1yho s LEU 22 Cb -0.08 -3.92 0.54 0.00 0.03 0.00 0.00 46.19 42.75 1yho s LEU 22 CO 0.01 -0.82 1.88 -0.65 0.23 0.00 0.00 176.35 177.00 1yho h PRO 23 N 2.68 0.99 -5.87 1.29 0.11 -1.86 -3.42 132.00 125.92 1yho h PRO 23 Ca -0.49 -0.06 -0.63 0.00 0.11 0.00 0.00 66.00 64.93 1yho h PRO 23 Cb 1.24 -0.22 -0.05 0.00 0.11 0.00 0.00 31.00 32.08 1yho h PRO 23 CO 0.63 0.66 -0.45 1.67 -0.21 0.00 0.00 178.00 180.29 1yho s TRP 24 N -5.93 3.55 1.30 0.65 -2.14 -1.26 -4.83 118.94 110.28 1yho s TRP 24 Ca -0.12 0.42 -0.20 0.00 2.66 0.00 0.00 56.10 58.87 1yho s TRP 24 Cb 0.21 -1.88 0.31 0.00 -3.10 0.00 0.00 33.47 29.00 1yho s TRP 24 CO 0.80 0.62 0.70 -2.30 -2.66 0.00 0.00 176.95 174.11 1yho n PRO 25 N 0.87 -3.85 -1.68 3.25 -0.02 -1.26 -4.81 135.00 127.50 1yho n PRO 25 Ca -0.10 -1.14 -0.49 0.00 -2.02 0.00 0.00 63.50 59.75 1yho n PRO 25 Cb 0.52 -1.79 -0.05 0.00 -0.02 0.00 0.00 33.50 32.17 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 -4.38 2.02 -3.68 0.52 -0.02 -1.26 -4.95 135.00 123.25 1yho n PRO 26 Ca 0.10 0.74 -0.39 0.00 -2.02 0.00 0.00 63.50 61.93 1yho n PRO 26 Cb 0.51 -2.55 -0.11 0.00 -0.02 0.00 0.00 33.50 31.33 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 3.56 4.99 0.29 2.45 2.96 -1.26 -4.96 118.68 126.71 1yho s LEU 27 Ca 0.92 -1.57 -0.00 0.00 -0.22 0.00 0.00 54.13 53.26 1yho s LEU 27 Cb -0.75 -1.92 0.50 0.00 0.50 0.00 0.00 46.19 44.52 1yho s LEU 27 CO 0.52 -0.50 1.89 0.03 -1.32 0.00 0.00 176.35 176.97 1yho h ARG 28 N 8.28 1.04 -0.66 1.98 2.47 -1.96 -0.67 114.38 124.86 1yho h ARG 28 Ca -0.21 -0.06 0.01 0.00 -1.26 0.00 0.00 59.98 58.46 1yho h ARG 28 Cb 1.07 -0.23 -0.03 0.00 -1.65 0.00 0.00 29.97 29.12 1yho h ARG 28 CO 0.71 0.69 0.44 -0.97 0.56 0.00 0.00 179.97 181.40 1yho h ASN 29 N 1.07 0.74 0.01 7.04 -1.24 -1.97 0.16 115.58 121.40 1yho h ASN 29 Ca 0.42 -0.02 -0.18 0.00 0.71 0.00 0.00 56.30 57.24 1yho h ASN 29 Cb 0.24 -0.18 0.02 0.00 0.73 0.00 0.00 38.32 39.12 1yho h ASN 29 CO -0.17 0.53 -0.71 -0.08 -1.29 0.00 0.00 177.43 175.71 1yho h GLU 30 N 0.87 0.46 -0.61 6.67 4.81 -1.64 -1.99 114.58 123.16 1yho h GLU 30 Ca 0.25 -0.51 -0.06 0.00 -0.13 0.00 0.00 59.36 58.91 1yho h GLU 30 Cb -0.06 0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 1yho h GLU 30 CO -0.06 1.16 0.14 0.74 -0.73 0.00 0.00 179.01 180.26 1yho h PHE 31 N -0.03 0.99 -0.19 0.92 0.04 -0.83 0.22 116.94 118.06 1yho h PHE 31 Ca -0.09 -0.11 -0.16 0.00 2.80 0.00 0.00 57.97 60.41 1yho h PHE 31 Cb 1.42 -0.28 0.00 0.00 2.20 0.00 0.00 35.95 39.29 1yho h PHE 31 CO 0.14 0.82 -0.51 -0.09 -0.60 0.00 0.00 178.31 178.08 1yho h ARG 32 N 0.91 0.69 -0.27 1.51 2.43 -0.76 -2.31 114.38 116.58 1yho h ARG 32 Ca 0.19 -0.48 -0.09 0.00 -0.81 0.00 0.00 59.98 58.80 1yho h ARG 32 Cb 0.34 0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1yho h ARG 32 CO 0.00 1.10 -0.17 -0.92 -1.51 0.00 0.00 179.97 178.48 1yho h TYR 33 N 0.39 0.68 -0.07 2.20 3.20 -1.18 0.14 116.97 122.33 1yho h TYR 33 Ca -0.01 -0.18 0.00 0.00 3.14 0.00 0.00 58.73 61.69 1yho h TYR 33 Cb 1.12 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 39.23 1yho h TYR 33 CO 0.09 0.85 0.03 0.35 -1.64 0.00 0.00 178.16 177.84 1yho h PHE 34 N 0.32 0.06 -0.30 -3.82 3.04 -0.62 0.28 116.94 115.90 1yho h PHE 34 Ca 0.06 0.00 -0.10 0.00 3.98 0.00 0.00 57.97 61.91 1yho h PHE 34 Cb 0.69 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.18 1yho h PHE 34 CO 0.07 0.03 -0.20 0.37 -2.02 0.00 0.00 178.31 176.56 1yho h GLN 35 N 0.07 0.66 -0.04 1.11 5.75 -1.43 -2.26 115.11 118.97 1yho h GLN 35 Ca 0.03 -0.31 -0.00 0.00 -0.15 0.00 0.00 58.65 58.22 1yho h GLN 35 Cb 0.01 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.55 1yho h GLN 35 CO -0.02 0.91 0.03 -0.09 -2.65 0.00 0.00 178.83 177.00 1yho h ARG 36 N 0.40 0.06 -0.85 1.69 2.43 -0.57 0.82 114.38 118.35 1yho h ARG 36 Ca 0.06 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.25 1yho h ARG 36 Cb 0.74 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 30.23 1yho h ARG 36 CO 0.05 0.09 0.56 1.98 -1.51 0.00 0.00 179.97 181.14 1yho h MET 37 N 0.01 1.07 -0.05 0.20 4.05 -0.47 0.11 114.93 119.85 1yho h MET 37 Ca 0.02 -0.06 -0.16 0.00 -0.28 0.00 0.00 59.70 59.21 1yho h MET 37 Cb 0.04 -0.24 0.01 0.00 -0.80 0.00 0.00 31.60 30.61 1yho h MET 37 CO -0.00 0.71 -0.61 1.79 0.23 0.00 0.00 176.91 179.03 1yho h THR 38 N 1.10 1.38 -0.58 -0.77 1.35 -1.15 -3.25 112.91 110.99 1yho h THR 38 Ca 0.33 -1.98 -0.02 0.00 -0.55 0.00 0.00 66.41 64.19 1yho h THR 38 Cb -0.04 2.38 -0.03 0.00 -1.73 0.00 0.00 68.15 68.73 1yho h THR 38 CO -0.10 0.59 0.27 0.74 -0.25 0.00 0.00 175.52 176.77 1yho h THR 39 N 0.07 1.19 -1.99 6.82 2.02 0.90 -3.39 112.91 118.53 1yho h THR 39 Ca -0.06 -0.55 -0.50 0.00 0.77 0.00 0.00 66.41 66.06 1yho h THR 39 Cb 1.28 0.45 -0.03 0.00 -1.74 0.00 0.00 68.15 68.12 1yho h THR 39 CO 0.12 0.23 1.39 0.42 0.37 0.00 0.00 175.52 178.05 1yho s THR 40 N -5.47 3.32 0.12 3.16 -4.23 0.35 -4.96 115.64 107.93 1yho s THR 40 Ca -0.10 0.20 -0.10 0.00 -1.18 0.00 0.00 61.69 60.52 1yho s THR 40 Cb 0.17 -3.80 -0.06 0.00 1.34 0.00 0.00 72.50 70.15 1yho s THR 40 CO 0.78 -0.75 0.44 -0.44 -0.54 0.00 0.00 174.62 174.11 1yho s SER 41 N 8.47 6.64 -0.01 3.99 0.01 -1.26 -4.94 113.70 126.60 1yho s SER 41 Ca 0.72 0.82 0.09 0.00 1.31 0.00 0.00 55.95 58.90 1yho s SER 41 Cb -0.14 -2.19 -0.23 0.00 0.21 0.00 0.00 66.02 63.67 1yho s SER 41 CO 0.22 0.10 0.79 0.28 0.41 0.00 0.00 173.24 175.05 1yho h SER 42 N 3.35 0.06 -3.55 2.44 0.02 -1.96 -3.45 113.55 110.45 1yho h SER 42 Ca -0.48 -0.10 -0.67 0.00 -0.84 0.00 0.00 61.79 59.70 1yho h SER 42 Cb 1.18 -0.02 -0.27 0.00 0.14 0.00 0.00 62.40 63.44 1yho h SER 42 CO 0.68 1.09 -0.78 0.54 -1.14 0.00 0.00 176.83 177.21 1yho s VAL 43 N -2.62 2.92 0.21 2.27 0.11 -1.26 -5.12 120.40 116.92 1yho s VAL 43 Ca -0.05 -0.73 -0.19 0.00 -2.93 0.00 0.00 61.98 58.08 1yho s VAL 43 Cb 0.08 -2.19 -0.08 0.00 -1.53 0.00 0.00 36.38 32.66 1yho s VAL 43 CO 0.82 0.55 0.70 -1.61 -3.33 0.00 0.00 175.10 172.23 1yho s GLU 44 N 0.04 4.21 0.00 1.54 8.01 -1.26 -4.02 118.70 127.23 1yho s GLU 44 Ca -0.05 0.82 0.00 0.00 0.01 0.00 0.00 54.97 55.74 1yho s GLU 44 Cb -0.15 -2.88 0.00 0.00 -4.31 0.00 0.00 34.13 26.80 1yho s GLU 44 CO 0.05 0.40 0.00 0.41 0.01 0.00 0.00 175.26 176.13 1yho n GLY 45 N 0.71 0.74 3.20 -1.39 0.00 -1.26 -5.07 105.19 102.12 1yho n GLY 45 Ca -0.03 -0.23 -0.12 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.71 0.91 0.15 1.61 -0.14 -1.26 -5.04 119.74 115.27 1yho s LYS 46 Ca 0.00 -1.37 0.09 0.00 -1.36 0.00 0.00 55.97 53.33 1yho s LYS 46 Cb 0.00 -0.36 -0.04 0.00 -1.68 0.00 0.00 37.83 35.75 1yho s LYS 46 CO 0.00 0.02 -0.15 -0.65 -0.76 0.00 0.00 175.35 173.81 1yho s GLN 47 N -3.78 1.89 -0.10 1.68 -0.21 -0.76 -5.03 119.66 113.34 1yho s GLN 47 Ca 0.13 -1.25 -0.05 0.00 0.02 0.00 0.00 55.36 54.22 1yho s GLN 47 Cb 0.04 -2.11 -0.04 0.00 1.00 0.00 0.00 33.01 31.90 1yho s GLN 47 CO -0.03 0.45 0.08 -0.80 -2.12 0.00 0.00 175.29 172.88 1yho s ASN 48 N -2.50 5.90 -0.09 5.90 -0.87 -1.26 -3.49 114.94 118.53 1yho s ASN 48 Ca 0.21 0.33 -0.01 0.00 -1.57 0.00 0.00 52.86 51.82 1yho s ASN 48 Cb -0.10 -1.82 -0.03 0.00 -0.02 0.00 0.00 41.25 39.29 1yho s ASN 48 CO 0.12 0.40 -0.03 -0.22 -2.57 0.00 0.00 177.10 174.80 1yho s LEU 49 N -0.98 3.40 -0.00 0.60 2.96 -0.97 -1.84 118.68 121.85 1yho s LEU 49 Ca 0.14 0.06 0.05 0.00 -0.22 0.00 0.00 54.13 54.16 1yho s LEU 49 Cb -0.12 -1.77 -0.01 0.00 0.50 0.00 0.00 46.19 44.79 1yho s LEU 49 CO 0.03 0.35 -0.16 0.68 -1.32 0.00 0.00 176.35 175.94 1yho s VAL 50 N -0.72 1.25 -0.14 1.68 -7.23 -0.72 -0.20 120.40 114.32 1yho s VAL 50 Ca 0.11 -0.74 -0.02 0.00 -1.81 0.00 0.00 61.98 59.53 1yho s VAL 50 Cb -0.11 -1.05 -0.02 0.00 0.56 0.00 0.00 36.38 35.75 1yho s VAL 50 CO 0.02 0.31 -0.09 -0.63 -0.31 0.00 0.00 175.10 174.40 1yho s ILE 51 N -0.44 3.46 0.07 -0.62 -1.09 -0.69 -0.35 121.20 121.55 1yho s ILE 51 Ca 0.06 -0.51 0.03 0.00 -2.23 0.00 0.00 60.65 58.00 1yho s ILE 51 Cb -0.06 -2.49 -0.03 0.00 -1.58 0.00 0.00 42.46 38.30 1yho s ILE 51 CO -0.00 0.51 -0.10 -0.04 -1.23 0.00 0.00 174.94 174.08 1yho s MET 52 N 0.35 0.73 0.79 2.79 -1.94 0.18 -1.25 119.30 120.95 1yho s MET 52 Ca -0.08 -0.99 -0.11 0.00 -1.71 0.00 0.00 55.69 52.80 1yho s MET 52 Cb -0.15 -0.48 0.09 0.00 2.01 0.00 0.00 34.83 36.30 1yho s MET 52 CO 0.04 0.08 1.14 0.20 -0.01 0.00 0.00 175.02 176.48 1yho s GLY 53 N -2.05 1.64 0.17 -0.03 0.00 0.42 -1.81 107.32 105.67 1yho s GLY 53 Ca -0.01 -0.79 -0.13 0.00 0.00 0.00 0.00 44.72 43.78 1yho s GLY 53 CO 0.00 -0.30 1.80 1.70 0.00 0.00 0.00 173.10 176.30 1yho h LYS 54 N -0.97 0.78 -0.57 2.90 3.64 -1.91 -1.46 116.57 118.98 1yho h LYS 54 Ca -0.45 -0.08 -0.07 0.00 -1.27 0.00 0.00 60.65 58.78 1yho h LYS 54 Cb 1.32 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 1yho h LYS 54 CO 0.62 0.58 0.08 0.87 -2.27 0.00 0.00 179.45 179.32 1yho h LYS 55 N 0.77 0.95 -0.33 1.90 1.57 -1.93 -1.97 116.57 117.53 1yho h LYS 55 Ca 0.20 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1yho h LYS 55 Cb 0.00 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 1yho h LYS 55 CO -0.04 0.92 0.21 1.15 -0.57 0.00 0.00 179.45 181.12 1yho h THR 56 N 0.85 1.10 -0.53 -0.16 2.02 -1.86 -0.34 112.91 113.99 1yho h THR 56 Ca 0.17 -0.20 -0.04 0.00 0.77 0.00 0.00 66.41 67.11 1yho h THR 56 Cb 0.43 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 1yho h THR 56 CO 0.01 0.09 0.15 -0.25 0.37 0.00 0.00 175.52 175.90 1yho h TRP 57 N 0.44 0.80 0.00 3.16 2.91 -1.16 -1.64 115.95 120.45 1yho h TRP 57 Ca 0.12 -0.06 -0.02 0.00 1.13 0.00 0.00 58.89 60.06 1yho h TRP 57 Cb -0.03 -0.24 -0.00 0.00 -0.51 0.00 0.00 29.16 28.38 1yho h TRP 57 CO -0.05 0.66 -0.10 0.74 -1.03 0.00 0.00 178.44 178.66 1yho h PHE 58 N 0.77 0.00 0.00 2.65 -1.00 -0.91 -3.10 116.94 115.35 1yho h PHE 58 Ca 0.18 0.00 -0.21 0.00 2.81 0.00 0.00 57.97 60.74 1yho h PHE 58 Cb 0.24 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.77 1yho h PHE 58 CO 0.01 0.10 -1.22 0.66 -1.61 0.00 0.00 178.31 176.25 1yho h SER 59 N 0.00 0.00 -3.60 2.17 4.64 -0.30 -3.46 113.55 112.99 1yho h SER 59 Ca -0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 1yho h SER 59 Cb 0.80 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.93 1yho h SER 59 CO 0.01 0.86 0.63 -0.63 -0.87 0.00 0.00 176.83 176.83 1yho s ILE 60 N -2.74 3.05 0.66 0.95 1.01 -0.69 -5.01 121.20 118.43 1yho s ILE 60 Ca -0.01 0.95 -0.12 0.00 0.00 0.00 0.00 60.65 61.47 1yho s ILE 60 Cb 0.09 -3.60 -0.01 0.00 0.01 0.00 0.00 42.46 38.94 1yho s ILE 60 CO 0.81 0.18 1.05 -2.16 0.00 0.00 0.00 174.94 174.82 1yho s PRO 61 N -0.86 3.13 0.44 2.79 0.04 -1.26 -4.93 135.00 134.35 1yho s PRO 61 Ca 0.53 0.97 0.23 0.00 0.04 0.00 0.00 61.00 62.77 1yho s PRO 61 Cb -0.37 -2.01 0.98 0.00 0.04 0.00 0.00 34.50 33.13 1yho s PRO 61 CO 0.44 -0.95 1.86 1.49 0.04 0.00 0.00 177.00 179.87 1yho h GLU 62 N -0.41 0.00 -0.41 4.56 4.81 -1.95 -2.44 114.58 118.73 1yho h GLU 62 Ca -0.44 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 58.90 1yho h GLU 62 Cb 1.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.57 1yho h GLU 62 CO 0.58 0.24 0.29 0.87 -0.73 0.00 0.00 179.01 180.26 1yho h LYS 63 N 0.00 0.03 0.00 1.92 1.57 -2.01 -2.59 116.57 115.49 1yho h LYS 63 Ca -0.00 -0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.42 1yho h LYS 63 Cb 0.69 -0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.93 1yho h LYS 63 CO 0.03 0.02 -2.33 0.09 -0.57 0.00 0.00 179.45 176.69 1yho n ASN 64 N -4.42 1.01 -4.77 0.86 3.02 -1.11 -4.96 115.26 104.88 1yho n ASN 64 Ca 0.07 -0.05 -0.39 0.00 -0.03 0.00 0.00 54.58 54.17 1yho n ASN 64 Cb 0.46 0.45 -0.06 0.00 -0.61 0.00 0.00 39.78 40.02 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 -2.47 4.60 0.16 3.52 0.52 -0.94 -2.18 118.95 122.17 1yho s ARG 65 Ca -0.18 1.20 -0.30 0.00 -0.52 0.00 0.00 55.73 55.93 1yho s ARG 65 Cb 0.07 -3.24 -0.08 0.00 0.52 0.00 0.00 34.95 32.22 1yho s ARG 65 CO 0.69 0.55 1.24 -1.25 0.02 0.00 0.00 175.30 176.56 1yho s PRO 66 N -1.21 4.44 -0.56 3.54 0.04 -1.26 -4.70 135.00 135.30 1yho s PRO 66 Ca 0.37 1.91 -0.26 0.00 0.04 0.00 0.00 61.00 63.06 1yho s PRO 66 Cb -0.23 -3.25 -0.06 0.00 0.04 0.00 0.00 34.50 30.99 1yho s PRO 66 CO 0.27 -0.19 2.27 -1.17 0.04 0.00 0.00 177.00 178.22 1yho s LEU 67 N 0.15 3.33 0.75 -3.56 2.96 -0.93 -4.94 118.68 116.44 1yho s LEU 67 Ca 0.56 0.77 -0.11 0.00 -0.22 0.00 0.00 54.13 55.13 1yho s LEU 67 Cb -0.33 -2.51 0.04 0.00 0.50 0.00 0.00 46.19 43.89 1yho s LEU 67 CO 0.35 -2.85 1.08 -0.75 -1.32 0.00 0.00 176.35 172.85 1yho s LYS 68 N 8.01 2.47 0.00 1.98 2.36 -1.26 -3.84 119.74 129.46 1yho s LYS 68 Ca 0.89 0.98 0.00 0.00 -2.55 0.00 0.00 55.97 55.29 1yho s LYS 68 Cb -0.15 -1.94 0.00 0.00 -1.05 0.00 0.00 37.83 34.69 1yho s LYS 68 CO 0.22 -1.44 0.00 0.41 1.55 0.00 0.00 175.35 176.10 1yho n GLY 69 N -1.67 2.87 3.07 5.54 0.00 -1.26 -4.99 105.19 108.75 1yho n GLY 69 Ca 0.08 -0.18 -0.08 0.00 0.00 0.00 0.00 46.02 45.84 1yho n GLY 69 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yho s ARG 70 N 0.00 0.54 -0.30 1.61 0.52 -1.25 -4.68 118.95 115.40 1yho s ARG 70 Ca 0.00 -0.96 -0.27 0.00 -0.52 0.00 0.00 55.73 53.98 1yho s ARG 70 Cb 0.00 0.20 0.01 0.00 0.52 0.00 0.00 34.95 35.68 1yho s ARG 70 CO 0.00 -0.11 0.97 0.42 0.02 0.00 0.00 175.30 176.60 1yho s ILE 71 N -3.04 4.64 -0.21 1.52 1.01 -0.77 -4.84 121.20 119.51 1yho s ILE 71 Ca -0.01 1.60 -0.17 0.00 0.00 0.00 0.00 60.65 62.06 1yho s ILE 71 Cb 0.02 -4.30 -0.03 0.00 0.01 0.00 0.00 42.46 38.15 1yho s ILE 71 CO -0.07 -0.34 0.48 0.20 0.00 0.00 0.00 174.94 175.21 1yho s ASN 72 N 1.56 6.50 -0.08 3.58 0.01 -1.26 -1.75 114.94 123.49 1yho s ASN 72 Ca 0.41 0.59 0.04 0.00 -0.71 0.00 0.00 52.86 53.19 1yho s ASN 72 Cb -0.13 -2.27 -0.01 0.00 0.41 0.00 0.00 41.25 39.24 1yho s ASN 72 CO 0.13 -0.16 -0.20 -0.22 -1.51 0.00 0.00 177.10 175.14 1yho s LEU 73 N 1.64 2.37 0.07 0.60 0.20 0.53 -0.15 118.68 123.94 1yho s LEU 73 Ca 0.22 -0.40 0.06 0.00 0.69 0.00 0.00 54.13 54.69 1yho s LEU 73 Cb -0.15 -1.47 -0.04 0.00 -0.43 0.00 0.00 46.19 44.10 1yho s LEU 73 CO 0.09 0.24 -0.09 -0.69 -0.29 0.00 0.00 176.35 175.61 1yho s VAL 74 N -0.10 3.44 -0.27 1.68 1.01 -0.47 -0.65 120.40 125.04 1yho s VAL 74 Ca -0.04 -1.10 -0.01 0.00 0.00 0.00 0.00 61.98 60.84 1yho s VAL 74 Cb -0.14 -2.56 0.04 0.00 0.00 0.00 0.00 36.38 33.72 1yho s VAL 74 CO 0.04 0.22 -0.05 -0.76 0.00 0.00 0.00 175.10 174.55 1yho s LEU 75 N -1.91 3.50 -0.03 3.92 2.01 -0.75 -2.02 118.68 123.40 1yho s LEU 75 Ca 0.20 -1.14 -0.01 0.00 0.01 0.00 0.00 54.13 53.19 1yho s LEU 75 Cb -0.11 -1.66 0.03 0.00 0.01 0.00 0.00 46.19 44.46 1yho s LEU 75 CO 0.11 -0.19 0.07 -0.55 1.01 0.00 0.00 176.35 176.80 1yho s SER 76 N 1.25 0.01 -0.08 2.29 0.15 -0.82 -3.72 113.70 112.78 1yho s SER 76 Ca -0.04 0.12 0.13 0.00 0.70 0.00 0.00 55.95 56.87 1yho s SER 76 Cb -0.18 0.02 -0.24 0.00 -1.71 0.00 0.00 66.02 63.91 1yho s SER 76 CO -0.03 -0.12 0.52 -1.14 1.20 0.00 0.00 173.24 173.66 1yho n ARG 77 N 4.09 0.65 0.07 5.44 0.00 -1.24 -3.90 116.66 121.76 1yho n ARG 77 Ca -0.26 0.23 -0.10 0.00 -0.00 0.00 0.00 57.85 57.72 1yho n ARG 77 Cb 0.51 -1.73 -0.13 0.00 0.00 0.00 0.00 32.46 31.12 1yho n ARG 77 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 1yho h GLU 78 N 0.00 0.09 -6.83 -0.14 5.08 -1.96 -3.46 114.58 107.36 1yho h GLU 78 Ca -0.35 -0.15 -0.48 0.00 -1.00 0.00 0.00 59.36 57.38 1yho h GLU 78 Cb 2.07 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 31.36 1yho h GLU 78 CO 0.07 1.03 0.37 -1.17 -1.00 0.00 0.00 179.01 178.31 1yho s LEU 79 N -6.80 4.46 -0.22 1.33 2.96 -1.26 -4.97 118.68 114.18 1yho s LEU 79 Ca -0.01 1.95 0.12 0.00 -0.22 0.00 0.00 54.13 55.96 1yho s LEU 79 Cb 0.09 -3.84 -0.22 0.00 0.50 0.00 0.00 46.19 42.72 1yho s LEU 79 CO 0.84 -0.03 -0.04 0.29 -1.32 0.00 0.00 176.35 176.09 1yho n LYS 80 N 0.92 0.69 -4.39 1.98 5.02 -1.26 -4.87 118.16 116.24 1yho n LYS 80 Ca 0.00 0.05 -0.28 0.00 -2.02 0.00 0.00 58.31 56.07 1yho n LYS 80 Cb 0.48 -1.52 -0.12 0.00 -0.02 0.00 0.00 35.03 33.86 1yho n LYS 80 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1yho s GLU 81 N -2.50 1.58 0.44 1.97 8.01 -1.26 -5.04 118.70 121.90 1yho s GLU 81 Ca -0.19 -1.42 -0.25 0.00 0.01 0.00 0.00 54.97 53.12 1yho s GLU 81 Cb 0.07 -1.92 -0.08 0.00 -4.31 0.00 0.00 34.13 27.89 1yho s GLU 81 CO 0.74 0.42 1.28 -1.25 0.01 0.00 0.00 175.26 176.46 1yho s PRO 82 N -2.50 3.80 0.62 0.39 0.04 -1.26 -5.01 135.00 131.08 1yho s PRO 82 Ca 0.19 2.08 -0.15 0.00 0.04 0.00 0.00 61.00 63.17 1yho s PRO 82 Cb -0.09 -2.60 -0.02 0.00 0.04 0.00 0.00 34.50 31.83 1yho s PRO 82 CO 0.10 -0.61 1.07 -1.25 0.04 0.00 0.00 177.00 176.35 1yho s PRO 83 N -2.44 3.12 0.12 0.56 0.04 -1.26 -4.94 135.00 130.20 1yho s PRO 83 Ca 0.61 1.24 -0.33 0.00 0.04 0.00 0.00 61.00 62.56 1yho s PRO 83 Cb -0.36 -2.00 -0.12 0.00 0.04 0.00 0.00 34.50 32.05 1yho s PRO 83 CO 0.46 -0.98 1.72 0.94 0.04 0.00 0.00 177.00 179.18 1yho n GLN 84 N -2.25 2.44 0.00 4.56 7.27 -1.26 -1.42 117.38 126.73 1yho n GLN 84 Ca 0.09 0.88 0.00 0.00 0.07 0.00 0.00 57.00 58.05 1yho n GLN 84 Cb 0.53 -2.71 0.00 0.00 2.41 0.00 0.00 30.24 30.46 1yho n GLN 84 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1yho n GLY 85 N 3.88 3.12 3.76 1.69 0.00 -1.26 -4.92 105.19 111.46 1yho n GLY 85 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1yho n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yho s ALA 86 N -2.87 3.34 0.10 4.61 0.00 -0.50 -4.51 121.76 121.93 1yho s ALA 86 Ca 0.00 0.72 -0.05 0.00 0.00 0.00 0.00 51.96 52.63 1yho s ALA 86 Cb 0.00 -3.26 -0.18 0.00 0.00 0.00 0.00 23.12 19.68 1yho s ALA 86 CO 0.00 0.04 1.22 0.45 0.00 0.00 0.00 175.76 177.47 1yho h HIS 87 N 3.84 0.59 -3.16 0.00 3.86 -0.86 -3.46 115.15 115.96 1yho h HIS 87 Ca -0.46 -0.37 -0.04 0.00 -1.16 0.00 0.00 60.37 58.34 1yho h HIS 87 Cb 1.20 -0.05 -0.13 0.00 1.06 0.00 0.00 27.41 29.50 1yho h HIS 87 CO 0.60 1.23 0.06 -0.06 0.86 0.00 0.00 177.93 180.61 1yho s PHE 88 N -2.99 -0.37 -0.01 2.45 0.08 -1.02 -4.99 117.98 111.13 1yho s PHE 88 Ca -0.05 0.13 -0.02 0.00 0.12 0.00 0.00 56.93 57.11 1yho s PHE 88 Cb 0.08 0.39 -0.00 0.00 -0.57 0.00 0.00 43.02 42.92 1yho s PHE 88 CO 0.88 -0.76 0.03 -1.17 -0.10 0.00 0.00 175.22 174.10 1yho s LEU 89 N -2.70 1.92 0.04 -0.37 2.96 -1.26 -1.37 118.68 117.91 1yho s LEU 89 Ca 0.01 -0.09 0.04 0.00 -0.22 0.00 0.00 54.13 53.88 1yho s LEU 89 Cb 0.00 0.17 -0.02 0.00 0.50 0.00 0.00 46.19 46.85 1yho s LEU 89 CO -0.11 -0.11 -0.13 -0.55 -1.32 0.00 0.00 176.35 174.12 1yho s SER 90 N -0.46 1.52 0.22 3.68 0.15 -0.86 -4.91 113.70 113.04 1yho s SER 90 Ca -0.05 -0.44 -0.01 0.00 0.70 0.00 0.00 55.95 56.15 1yho s SER 90 Cb -0.03 -0.09 0.20 0.00 -1.71 0.00 0.00 66.02 64.39 1yho s SER 90 CO -0.00 0.01 1.57 0.03 1.20 0.00 0.00 173.24 176.05 1yho h ARG 91 N 4.97 0.50 -4.12 5.44 -0.00 -1.90 -2.17 114.38 117.11 1yho h ARG 91 Ca -0.37 -0.28 -0.14 0.00 -0.50 0.00 0.00 59.98 58.69 1yho h ARG 91 Cb 1.18 0.02 -0.13 0.00 0.00 0.00 0.00 29.97 31.04 1yho h ARG 91 CO 0.44 0.87 -0.45 -1.54 0.00 0.00 0.00 179.97 179.29 1yho s SER 92 N -6.88 0.14 0.32 7.04 1.04 -1.26 -3.60 113.70 110.49 1yho s SER 92 Ca -0.07 -1.03 0.02 0.00 0.48 0.00 0.00 55.95 55.36 1yho s SER 92 Cb 0.12 0.39 0.53 0.00 0.10 0.00 0.00 66.02 67.16 1yho s SER 92 CO 0.82 -0.84 1.86 -0.07 0.98 0.00 0.00 173.24 175.99 1yho h LEU 93 N 2.65 0.60 -1.00 2.42 4.07 -1.99 -2.34 115.31 119.72 1yho h LEU 93 Ca -0.33 -0.11 0.01 0.00 0.08 0.00 0.00 57.88 57.54 1yho h LEU 93 Cb 1.22 -0.16 -0.05 0.00 1.08 0.00 0.00 40.66 42.75 1yho h LEU 93 CO 0.52 0.63 0.66 0.44 -1.08 0.00 0.00 178.44 179.61 1yho h ASP 94 N 0.62 1.14 -0.11 -0.43 3.32 -1.98 0.17 116.42 119.14 1yho h ASP 94 Ca 0.13 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.11 1yho h ASP 94 Cb 0.31 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 1yho h ASP 94 CO 0.00 0.82 -0.11 0.44 -1.72 0.00 0.00 179.24 178.67 1yho h ASP 95 N 1.34 0.29 -0.19 6.45 5.19 -1.88 -2.12 116.42 125.50 1yho h ASP 95 Ca 0.37 -0.49 -0.04 0.00 -0.62 0.00 0.00 57.03 56.25 1yho h ASP 95 Cb -0.13 -0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.28 1yho h ASP 95 CO -0.09 0.72 0.00 0.00 -3.12 0.00 0.00 179.24 176.75 1yho h ALA 96 N 0.58 1.46 -0.31 3.45 0.00 -1.17 -1.76 119.26 121.52 1yho h ALA 96 Ca 0.02 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 1yho h ALA 96 Cb 0.63 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1yho h ALA 96 CO 0.03 0.39 -0.26 -0.07 0.00 0.00 0.00 179.25 179.34 1yho h LEU 97 N 0.44 0.76 -0.67 0.00 3.38 -0.62 -0.95 115.31 117.65 1yho h LEU 97 Ca 0.10 -0.45 -0.07 0.00 0.09 0.00 0.00 57.88 57.54 1yho h LEU 97 Cb 0.28 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1yho h LEU 97 CO 0.01 1.06 0.13 0.11 0.09 0.00 0.00 178.44 179.84 1yho h LYS 98 N 0.48 1.10 -0.14 1.13 6.56 -1.07 0.18 116.57 124.81 1yho h LYS 98 Ca 0.06 -0.28 -0.04 0.00 -1.06 0.00 0.00 60.65 59.32 1yho h LYS 98 Cb 0.82 -0.13 -0.00 0.00 -0.57 0.00 0.00 32.23 32.34 1yho h LYS 98 CO 0.07 0.99 -0.08 1.25 -2.06 0.00 0.00 179.45 179.62 1yho h LEU 99 N 1.02 0.31 -1.32 2.94 5.85 -1.29 0.25 115.31 123.07 1yho h LEU 99 Ca 0.21 -0.42 -0.05 0.00 0.84 0.00 0.00 57.88 58.46 1yho h LEU 99 Cb 0.41 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1yho h LEU 99 CO 0.01 0.66 -0.23 0.74 -0.34 0.00 0.00 178.44 179.29 1yho h THR 100 N -0.04 0.63 0.00 1.05 2.02 -1.09 -2.75 112.91 112.73 1yho h THR 100 Ca 0.03 -1.02 -0.09 0.00 0.77 0.00 0.00 66.41 66.10 1yho h THR 100 Cb 0.55 1.67 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 1yho h THR 100 CO 0.02 0.22 -0.89 -0.08 0.37 0.00 0.00 175.52 175.17 1yho h GLU 101 N 0.00 0.00 -7.05 6.66 4.81 -0.50 -3.36 114.58 115.15 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 0.65 0.00 0.10 0.00 0.63 0.00 0.00 28.75 30.13 1yho h GLU 101 CO 0.03 0.23 0.52 -0.65 -0.73 0.00 0.00 179.01 178.41 1yho s GLN 102 N -3.08 3.33 0.57 1.92 -1.52 0.07 -4.71 119.66 116.23 1yho s GLN 102 Ca 0.01 1.94 0.29 0.00 -1.95 0.00 0.00 55.36 55.64 1yho s GLN 102 Cb 0.08 -2.22 1.48 0.00 -0.22 0.00 0.00 33.01 32.13 1yho s GLN 102 CO 0.77 -0.95 1.93 -1.35 -0.25 0.00 0.00 175.29 175.44 1yho h PRO 103 N 1.52 0.00 -1.01 2.91 0.11 -1.90 0.68 132.00 134.30 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 1.28 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.33 1yho h PRO 103 CO 0.58 0.00 0.66 0.93 -0.21 0.00 0.00 178.00 179.96 1yho h GLU 104 N 0.00 1.25 0.00 1.05 4.39 -1.90 -2.78 114.58 116.59 1yho h GLU 104 Ca 0.25 -0.08 -0.08 0.00 0.34 0.00 0.00 59.36 59.80 1yho h GLU 104 Cb 1.19 -0.28 -0.01 0.00 -0.10 0.00 0.00 28.75 29.54 1yho h GLU 104 CO -0.00 0.83 -1.86 1.28 -1.16 0.00 0.00 179.01 178.09 1yho n LEU 105 N -4.43 0.20 0.29 1.33 4.32 -0.23 -4.18 117.00 114.31 1yho n LEU 105 Ca 0.14 0.08 0.20 0.00 -0.02 0.00 0.00 56.01 56.41 1yho n LEU 105 Cb 0.09 0.08 1.01 0.00 -1.62 0.00 0.00 43.42 42.98 1yho n LEU 105 CO 0.35 0.07 1.09 0.00 -1.22 0.00 0.00 177.39 177.67 1yho h ALA 106 N 1.78 1.00 0.03 -1.18 0.00 -0.68 0.87 119.26 121.09 1yho h ALA 106 Ca -0.11 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.49 1yho h ALA 106 Cb 1.26 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.01 1yho h ALA 106 CO 0.01 0.00 -1.82 0.09 0.00 0.00 0.00 179.25 177.53 1yho n ASN 107 N -2.93 1.18 -0.02 0.00 4.13 -1.11 -4.29 115.26 112.22 1yho n ASN 107 Ca -0.02 0.34 -0.10 0.00 1.68 0.00 0.00 54.58 56.48 1yho n ASN 107 Cb 0.11 -0.24 -0.14 0.00 -1.54 0.00 0.00 39.78 37.98 1yho n ASN 107 CO 0.00 0.00 0.00 2.29 0.28 0.00 0.00 177.26 179.83 1yho n LYS 108 N -3.15 0.65 -4.46 3.52 -0.00 -0.78 -4.85 118.16 109.09 1yho n LYS 108 Ca -0.22 0.29 -0.20 0.00 -0.00 0.00 0.00 58.31 58.18 1yho n LYS 108 Cb 1.05 -1.78 -0.15 0.00 -0.00 0.00 0.00 35.03 34.15 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 -2.59 0.85 -0.02 0.58 -7.23 0.29 -1.83 120.40 110.45 1yho s VAL 109 Ca -0.07 -0.45 -0.01 0.00 -1.81 0.00 0.00 61.98 59.65 1yho s VAL 109 Cb 0.08 -0.72 -0.01 0.00 0.56 0.00 0.00 36.38 36.29 1yho s VAL 109 CO 0.82 0.24 -0.03 -0.67 -0.31 0.00 0.00 175.10 175.16 1yho n ASP 110 N 2.89 1.15 -4.76 4.85 2.03 -1.23 -3.91 116.55 117.58 1yho n ASP 110 Ca -0.14 0.02 -0.32 0.00 0.52 0.00 0.00 54.79 54.86 1yho n ASP 110 Cb 0.56 -0.06 -0.07 0.00 -0.72 0.00 0.00 41.12 40.83 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 -2.04 2.96 -0.13 -0.67 -1.94 -1.26 -2.21 119.30 114.01 1yho s MET 111 Ca -0.03 -0.56 0.02 0.00 -1.71 0.00 0.00 55.69 53.41 1yho s MET 111 Cb 0.01 -2.79 0.01 0.00 2.01 0.00 0.00 34.83 34.08 1yho s MET 111 CO 0.04 0.62 -0.19 0.08 -0.01 0.00 0.00 175.02 175.56 1yho s VAL 112 N -1.22 1.84 -0.23 -6.03 1.01 -0.83 -2.29 120.40 112.66 1yho s VAL 112 Ca 0.24 -0.85 -0.07 0.00 0.00 0.00 0.00 61.98 61.30 1yho s VAL 112 Cb -0.12 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 1yho s VAL 112 CO 0.15 0.51 0.05 0.26 0.00 0.00 0.00 175.10 176.07 1yho s TRP 113 N 0.90 3.08 -0.23 5.22 0.52 0.72 -0.03 118.94 129.12 1yho s TRP 113 Ca -0.06 -0.41 -0.22 0.00 0.02 0.00 0.00 56.10 55.43 1yho s TRP 113 Cb -0.15 -2.19 -0.02 0.00 -1.15 0.00 0.00 33.47 29.97 1yho s TRP 113 CO -0.02 -0.30 0.72 0.42 0.02 0.00 0.00 176.95 177.79 1yho s ILE 114 N 1.37 4.93 -0.06 2.03 -1.09 0.28 -1.70 121.20 126.96 1yho s ILE 114 Ca 0.05 1.34 -0.05 0.00 -2.23 0.00 0.00 60.65 59.76 1yho s ILE 114 Cb -0.15 -4.02 -0.02 0.00 -1.58 0.00 0.00 42.46 36.70 1yho s ILE 114 CO 0.03 0.01 -0.09 0.52 -1.23 0.00 0.00 174.94 174.18 1yho n VAL 115 N 5.06 0.56 -3.80 2.92 0.31 -0.38 -2.22 118.33 120.77 1yho n VAL 115 Ca 0.02 0.38 -0.05 0.00 -0.01 0.00 0.00 64.34 64.68 1yho n VAL 115 Cb 0.49 -1.84 -0.01 0.00 -0.91 0.00 0.00 33.84 31.57 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 -3.36 -0.08 0.00 2.92 0.00 -1.21 -4.70 107.32 100.90 1yho s GLY 116 Ca -0.07 -0.15 0.00 0.00 0.00 0.00 0.00 44.72 44.50 1yho s GLY 116 CO 0.11 0.31 0.00 0.61 0.00 0.00 0.00 173.10 174.13 1yho n GLY 117 N -0.51 3.18 0.28 0.20 0.00 -1.26 -0.43 105.19 106.65 1yho n GLY 117 Ca -0.05 -1.42 -0.02 0.00 0.00 0.00 0.00 46.02 44.52 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 0.64 -0.42 1.61 4.64 -1.99 -2.36 113.55 115.66 1yho h SER 118 Ca 0.00 -0.13 0.02 0.00 -0.47 0.00 0.00 61.79 61.21 1yho h SER 118 Cb 0.00 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 61.89 1yho h SER 118 CO 0.00 0.69 0.25 0.28 -0.87 0.00 0.00 176.83 177.18 1yho h SER 119 N 0.65 0.40 -0.61 4.97 0.02 -1.99 0.31 113.55 117.30 1yho h SER 119 Ca 0.14 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.00 1yho h SER 119 Cb 0.35 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.79 1yho h SER 119 CO 0.01 0.29 0.02 0.58 -1.14 0.00 0.00 176.83 176.59 1yho h VAL 120 N 0.50 1.27 -0.73 2.27 2.07 -1.79 -2.46 116.25 117.37 1yho h VAL 120 Ca 0.17 -1.13 -0.07 0.00 0.82 0.00 0.00 66.70 66.49 1yho h VAL 120 Cb 0.01 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 1yho h VAL 120 CO -0.08 0.41 0.20 1.88 0.02 0.00 0.00 177.57 180.00 1yho h TYR 121 N 0.97 1.20 -0.12 1.57 -1.99 -1.02 -0.25 116.97 117.33 1yho h TYR 121 Ca 0.18 -0.13 -0.00 0.00 2.00 0.00 0.00 58.73 60.77 1yho h TYR 121 Cb 0.54 -0.34 -0.01 0.00 2.00 0.00 0.00 36.73 38.92 1yho h TYR 121 CO 0.04 0.96 0.06 -0.22 -0.00 0.00 0.00 178.16 179.00 1yho h LYS 122 N 1.09 0.17 -0.12 4.88 3.64 -0.77 -0.92 116.57 124.55 1yho h LYS 122 Ca 0.23 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.57 1yho h LYS 122 Cb 0.35 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.13 1yho h LYS 122 CO -0.00 0.23 0.03 0.93 -2.27 0.00 0.00 179.45 178.36 1yho h GLU 123 N 0.08 0.20 -0.04 1.90 4.39 -1.32 -2.69 114.58 117.10 1yho h GLU 123 Ca 0.04 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.70 1yho h GLU 123 Cb 0.11 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1yho h GLU 123 CO -0.01 0.38 0.04 0.00 -1.16 0.00 0.00 179.01 178.26 1yho h ALA 124 N 0.82 1.72 0.00 3.43 0.00 -0.98 -0.64 119.26 123.61 1yho h ALA 124 Ca 0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1yho h ALA 124 Cb 0.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1yho h ALA 124 CO 0.00 -0.06 0.00 0.52 0.00 0.00 0.00 179.25 179.72 1yho h MET 125 N 0.00 0.00 -0.74 0.00 2.86 -0.81 -1.21 114.93 115.03 1yho h MET 125 Ca 0.02 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.64 1yho h MET 125 Cb 0.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1yho h MET 125 CO -0.00 0.00 0.02 -1.71 1.06 0.00 0.00 176.91 176.28 1yho n ASN 126 N -2.70 4.10 -4.71 1.22 4.05 -0.25 -4.93 115.26 112.04 1yho n ASN 126 Ca -0.01 -2.63 -0.42 0.00 0.45 0.00 0.00 54.58 51.96 1yho n ASN 126 Cb 0.10 -0.63 -0.03 0.00 1.23 0.00 0.00 39.78 40.45 1yho n ASN 126 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 1yho s HIS 127 N -2.16 3.66 0.08 1.20 3.76 -0.46 -4.96 115.29 116.41 1yho s HIS 127 Ca 0.36 1.67 -0.10 0.00 -0.15 0.00 0.00 55.06 56.83 1yho s HIS 127 Cb 0.28 -3.15 -0.23 0.00 1.11 0.00 0.00 32.58 30.59 1yho s HIS 127 CO 0.10 -0.15 1.18 -1.00 -0.85 0.00 0.00 174.74 174.02 1yho h PRO 128 N 6.51 0.53 -7.53 8.40 0.13 -1.91 -3.47 132.00 134.66 1yho h PRO 128 Ca -0.42 -0.67 -0.43 0.00 -0.87 0.00 0.00 66.00 63.61 1yho h PRO 128 Cb 1.22 0.21 0.17 0.00 0.13 0.00 0.00 31.00 32.73 1yho h PRO 128 CO 0.75 1.28 0.25 0.20 -0.23 0.00 0.00 178.00 180.25 1yho s GLY 129 N -4.44 1.63 0.37 1.56 0.00 -1.26 -4.44 107.32 100.74 1yho s GLY 129 Ca -0.08 -0.90 -0.28 0.00 0.00 0.00 0.00 44.72 43.47 1yho s GLY 129 CO 0.91 -0.13 1.48 -1.58 0.00 0.00 0.00 173.10 173.78 1yho s HIS 130 N -3.30 2.62 -0.06 1.90 2.46 -1.26 -4.75 115.29 112.90 1yho s HIS 130 Ca 0.70 1.18 -0.08 0.00 0.47 0.00 0.00 55.06 57.33 1yho s HIS 130 Cb -0.10 -4.00 0.02 0.00 -0.13 0.00 0.00 32.58 28.37 1yho s HIS 130 CO 0.55 -2.94 0.20 -1.17 -2.47 0.00 0.00 174.74 168.91 1yho s LEU 131 N -2.04 1.25 -0.04 8.88 2.96 -1.25 -4.37 118.68 124.06 1yho s LEU 131 Ca 0.53 0.27 0.02 0.00 -0.22 0.00 0.00 54.13 54.72 1yho s LEU 131 Cb -0.46 0.75 -0.03 0.00 0.50 0.00 0.00 46.19 46.95 1yho s LEU 131 CO 0.62 -0.16 -0.09 -0.54 -1.32 0.00 0.00 176.35 174.86 1yho s LYS 132 N -0.31 2.62 -0.09 1.98 3.01 -0.83 -1.96 119.74 124.16 1yho s LYS 132 Ca -0.04 -0.64 0.00 0.00 -1.01 0.00 0.00 55.97 54.28 1yho s LYS 132 Cb -0.03 -2.50 0.02 0.00 -1.01 0.00 0.00 37.83 34.31 1yho s LYS 132 CO 0.01 0.64 -0.07 -0.51 0.51 0.00 0.00 175.35 175.93 1yho s LEU 133 N -0.95 1.18 -0.33 3.17 1.43 0.49 -0.70 118.68 122.97 1yho s LEU 133 Ca 0.13 -0.25 -0.07 0.00 -1.03 0.00 0.00 54.13 52.91 1yho s LEU 133 Cb -0.11 -0.74 0.03 0.00 0.03 0.00 0.00 46.19 45.40 1yho s LEU 133 CO 0.03 -0.10 0.12 -0.36 0.23 0.00 0.00 176.35 176.26 1yho s PHE 134 N 1.50 3.22 -0.12 0.29 0.40 0.28 0.10 117.98 123.66 1yho s PHE 134 Ca 0.00 -1.20 -0.01 0.00 -0.60 0.00 0.00 56.93 55.12 1yho s PHE 134 Cb -0.13 -2.30 -0.03 0.00 0.51 0.00 0.00 43.02 41.07 1yho s PHE 134 CO -0.05 -0.67 -0.07 0.08 0.70 0.00 0.00 175.22 175.21 1yho s VAL 135 N 1.46 3.60 -0.26 -0.44 1.01 -0.01 0.27 120.40 126.04 1yho s VAL 135 Ca 0.00 -0.48 -0.03 0.00 0.00 0.00 0.00 61.98 61.47 1yho s VAL 135 Cb -0.19 -2.52 0.02 0.00 0.00 0.00 0.00 36.38 33.69 1yho s VAL 135 CO 0.03 0.54 -0.02 -0.89 0.00 0.00 0.00 175.10 174.77 1yho s THR 136 N -0.09 3.26 -0.16 3.92 2.01 -0.55 1.00 115.64 125.02 1yho s THR 136 Ca 0.00 -0.88 -0.23 0.00 0.31 0.00 0.00 61.69 60.89 1yho s THR 136 Cb -0.13 -2.65 -0.02 0.00 0.01 0.00 0.00 72.50 69.71 1yho s THR 136 CO 0.03 0.18 0.74 -0.13 -0.69 0.00 0.00 174.62 174.75 1yho s ARG 137 N 1.39 4.29 -0.39 4.92 0.52 0.01 0.66 118.95 130.36 1yho s ARG 137 Ca 0.01 0.86 -0.13 0.00 -0.52 0.00 0.00 55.73 55.95 1yho s ARG 137 Cb -0.17 -3.55 0.02 0.00 0.52 0.00 0.00 34.95 31.77 1yho s ARG 137 CO -0.02 -0.23 0.25 0.42 0.02 0.00 0.00 175.30 175.73 1yho s ILE 138 N 1.84 4.92 -1.34 1.52 -1.09 0.69 0.24 121.20 127.97 1yho s ILE 138 Ca 0.35 -0.72 -0.14 0.00 -2.23 0.00 0.00 60.65 57.91 1yho s ILE 138 Cb -0.16 -3.72 -0.02 0.00 -1.58 0.00 0.00 42.46 36.97 1yho s ILE 138 CO 0.13 -0.24 2.30 0.23 -1.23 0.00 0.00 174.94 176.12 1yho n MET 139 N 5.07 2.73 -3.66 2.79 2.81 0.54 -0.73 117.12 126.67 1yho n MET 139 Ca -0.12 -2.34 -0.07 0.00 -1.81 0.00 0.00 57.70 53.36 1yho n MET 139 Cb 0.47 -3.10 -0.08 0.00 -0.71 0.00 0.00 33.22 29.80 1yho n MET 139 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 1yho s GLN 140 N 3.34 0.55 -0.10 0.03 2.00 -1.26 -4.36 119.66 119.86 1yho s GLN 140 Ca 0.52 1.11 -0.30 0.00 -2.00 0.00 0.00 55.36 54.69 1yho s GLN 140 Cb 0.15 0.22 -0.04 0.00 0.80 0.00 0.00 33.01 34.14 1yho s GLN 140 CO -0.05 -0.17 1.41 -0.51 -0.50 0.00 0.00 175.29 175.47 1yho s ASP 141 N 1.86 6.85 -0.09 6.67 1.11 -1.26 -4.41 116.67 127.39 1yho s ASP 141 Ca -0.08 1.94 -0.08 0.00 0.18 0.00 0.00 52.55 54.51 1yho s ASP 141 Cb -0.08 -2.54 0.02 0.00 1.07 0.00 0.00 42.92 41.39 1yho s ASP 141 CO -0.17 -0.80 0.23 -0.36 1.18 0.00 0.00 175.17 175.26 1yho s PHE 142 N 3.42 -0.25 0.19 4.23 0.08 -1.26 -5.09 117.98 119.29 1yho s PHE 142 Ca 0.62 0.62 -0.31 0.00 0.12 0.00 0.00 56.93 57.98 1yho s PHE 142 Cb -0.27 0.09 -0.11 0.00 -0.57 0.00 0.00 43.02 42.16 1yho s PHE 142 CO 0.22 -0.12 1.61 -2.00 -0.10 0.00 0.00 175.22 174.82 1yho s GLU 143 N 0.12 4.18 0.11 0.44 2.12 -1.26 -5.00 118.70 119.42 1yho s GLU 143 Ca -0.00 2.45 0.06 0.00 0.36 0.00 0.00 54.97 57.84 1yho s GLU 143 Cb -0.02 -3.12 -0.04 0.00 0.26 0.00 0.00 34.13 31.22 1yho s GLU 143 CO 0.00 -0.64 -0.14 -1.12 -0.54 0.00 0.00 175.26 172.82 1yho s SER 144 N 1.05 1.96 -0.10 -1.70 0.01 -1.26 -4.68 113.70 108.96 1yho s SER 144 Ca 0.70 -0.77 0.09 0.00 1.31 0.00 0.00 55.95 57.28 1yho s SER 144 Cb -0.46 -0.07 -0.12 0.00 0.21 0.00 0.00 66.02 65.58 1yho s SER 144 CO 0.34 -0.13 0.02 -0.67 0.41 0.00 0.00 173.24 173.21 1yho n ASP 145 N 0.69 2.49 -4.26 2.44 2.03 -1.24 -4.96 116.55 113.74 1yho n ASP 145 Ca -0.17 -0.01 -0.32 0.00 0.52 0.00 0.00 54.79 54.82 1yho n ASP 145 Cb 0.56 0.67 -0.17 0.00 -0.72 0.00 0.00 41.12 41.47 1yho n ASP 145 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1yho s THR 146 N -2.25 2.06 0.10 5.18 2.01 -1.16 -5.03 115.64 116.55 1yho s THR 146 Ca -0.06 -1.05 0.05 0.00 0.31 0.00 0.00 61.69 60.93 1yho s THR 146 Cb 0.03 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.75 1yho s THR 146 CO 0.41 0.57 0.02 -0.36 -0.69 0.00 0.00 174.62 174.57 1yho s PHE 147 N -0.03 3.01 0.09 4.92 0.40 -1.26 -3.08 117.98 122.03 1yho s PHE 147 Ca -0.08 -0.02 -0.22 0.00 -0.60 0.00 0.00 56.93 56.01 1yho s PHE 147 Cb -0.15 -1.53 -0.07 0.00 0.51 0.00 0.00 43.02 41.78 1yho s PHE 147 CO 0.05 0.49 0.67 0.12 0.70 0.00 0.00 175.22 177.25 1yho s PHE 148 N -1.38 3.82 0.39 0.36 2.19 -0.65 -4.96 117.98 117.75 1yho s PHE 148 Ca 0.27 1.41 -0.26 0.00 0.33 0.00 0.00 56.93 58.68 1yho s PHE 148 Cb -0.11 -2.64 -0.09 0.00 -1.31 0.00 0.00 43.02 38.86 1yho s PHE 148 CO 0.19 0.49 1.21 -1.25 1.83 0.00 0.00 175.22 177.69 1yho s PRO 149 N -0.87 4.10 -0.46 10.12 0.04 -1.26 -4.95 135.00 141.72 1yho s PRO 149 Ca 0.33 1.94 -0.28 0.00 0.04 0.00 0.00 61.00 63.03 1yho s PRO 149 Cb -0.21 -2.76 -0.00 0.00 0.04 0.00 0.00 34.50 31.57 1yho s PRO 149 CO 0.22 -0.31 1.60 -1.21 0.04 0.00 0.00 177.00 177.33 1yho s GLU 150 N -2.18 3.28 0.37 4.56 2.02 -1.26 -4.98 118.70 120.51 1yho s GLU 150 Ca 0.55 0.90 -0.26 0.00 0.02 0.00 0.00 54.97 56.18 1yho s GLU 150 Cb -0.33 -4.16 -0.09 0.00 0.10 0.00 0.00 34.13 29.65 1yho s GLU 150 CO 0.42 -1.94 1.16 0.42 0.02 0.00 0.00 175.26 175.35 1yho s ILE 151 N 6.61 3.21 0.27 -1.63 -1.09 -1.26 -4.98 121.20 122.33 1yho s ILE 151 Ca 0.65 1.06 -0.30 0.00 -2.23 0.00 0.00 60.65 59.83 1yho s ILE 151 Cb -0.15 -3.61 -0.10 0.00 -1.58 0.00 0.00 42.46 37.02 1yho s ILE 151 CO 0.29 0.13 1.39 -1.81 -1.23 0.00 0.00 174.94 173.72 1yho s ASP 152 N -1.07 6.70 0.14 3.58 1.01 -1.26 -4.93 116.67 120.85 1yho s ASP 152 Ca 0.54 2.65 0.15 0.00 0.71 0.00 0.00 52.55 56.61 1yho s ASP 152 Cb -0.31 -2.63 -0.07 0.00 1.01 0.00 0.00 42.92 40.92 1yho s ASP 152 CO 0.39 -0.65 1.07 -0.07 0.21 0.00 0.00 175.17 176.13 1yho h LEU 153 N 4.62 0.00 -1.48 1.23 3.38 -1.94 -2.38 115.31 118.75 1yho h LEU 153 Ca -0.47 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.45 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 0.74 0.59 -0.19 -0.33 0.09 0.00 0.00 178.44 179.35 1yho h GLU 154 N 0.00 0.10 0.00 1.13 5.08 -2.02 -3.07 114.58 115.81 1yho h GLU 154 Ca -0.10 -0.02 -0.36 0.00 -1.00 0.00 0.00 59.36 57.88 1yho h GLU 154 Cb 1.54 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.71 1yho h GLU 154 CO 0.06 0.29 -2.28 1.63 -1.00 0.00 0.00 179.01 177.71 1yho n LYS 155 N -4.27 0.68 -4.51 2.33 4.01 -1.25 -4.91 118.16 110.23 1yho n LYS 155 Ca -0.02 0.07 -0.33 0.00 -0.51 0.00 0.00 58.31 57.52 1yho n LYS 155 Cb 0.28 -1.57 -0.13 0.00 -0.51 0.00 0.00 35.03 33.10 1yho n LYS 155 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 1yho s TYR 156 N -2.51 2.97 -0.08 2.13 1.51 -0.89 -2.17 117.35 118.30 1yho s TYR 156 Ca -0.13 -0.35 -0.12 0.00 -1.01 0.00 0.00 57.07 55.46 1yho s TYR 156 Cb 0.07 -1.91 -0.05 0.00 -0.11 0.00 0.00 41.96 39.96 1yho s TYR 156 CO 0.79 -0.04 0.28 0.21 -1.11 0.00 0.00 175.55 175.69 1yho s LYS 157 N 0.25 3.83 -0.19 -0.62 2.20 0.14 -4.28 119.74 121.07 1yho s LYS 157 Ca -0.04 0.14 -0.24 0.00 -0.36 0.00 0.00 55.97 55.46 1yho s LYS 157 Cb -0.14 -3.26 -0.01 0.00 -1.51 0.00 0.00 37.83 32.90 1yho s LYS 157 CO 0.04 0.61 0.80 -1.17 -0.36 0.00 0.00 175.35 175.27 1yho s LEU 158 N -0.69 4.15 -0.56 5.43 0.20 -1.26 -1.09 118.68 124.86 1yho s LEU 158 Ca 0.19 1.09 -0.03 0.00 0.69 0.00 0.00 54.13 56.07 1yho s LEU 158 Cb -0.14 -3.17 0.14 0.00 -0.43 0.00 0.00 46.19 42.59 1yho s LEU 158 CO 0.08 -0.41 0.37 -0.76 -0.29 0.00 0.00 176.35 175.34 1yho s LEU 159 N 2.27 5.28 0.16 -0.68 2.01 0.25 -4.94 118.68 123.03 1yho s LEU 159 Ca 0.36 -2.57 -0.10 0.00 0.01 0.00 0.00 54.13 51.83 1yho s LEU 159 Cb -0.16 -1.86 0.00 0.00 0.01 0.00 0.00 46.19 44.19 1yho s LEU 159 CO 0.11 -0.44 1.54 1.55 1.01 0.00 0.00 176.35 180.12 1yho h PRO 160 N 7.40 0.99 -4.38 1.29 0.13 -1.95 -1.46 132.00 134.03 1yho h PRO 160 Ca -0.06 -0.44 -0.62 0.00 -0.87 0.00 0.00 66.00 64.01 1yho h PRO 160 Cb 0.99 -0.03 -0.38 0.00 0.13 0.00 0.00 31.00 31.71 1yho h PRO 160 CO 0.72 1.11 -0.78 -2.00 -0.23 0.00 0.00 178.00 176.82 1yho s GLU 161 N -4.63 1.59 -0.11 0.86 2.12 -1.26 -4.73 118.70 112.54 1yho s GLU 161 Ca -0.11 -1.14 0.02 0.00 0.36 0.00 0.00 54.97 54.10 1yho s GLU 161 Cb 0.12 -2.64 0.01 0.00 0.26 0.00 0.00 34.13 31.88 1yho s GLU 161 CO 0.87 -0.67 -0.18 -0.47 -0.54 0.00 0.00 175.26 174.28 1yho s TYR 162 N 1.32 2.17 0.44 5.30 5.04 -1.26 -5.11 117.35 125.25 1yho s TYR 162 Ca -0.03 -1.01 -0.24 0.00 -2.44 0.00 0.00 57.07 53.34 1yho s TYR 162 Cb -0.19 -1.52 -0.09 0.00 0.35 0.00 0.00 41.96 40.50 1yho s TYR 162 CO -0.08 -0.49 1.16 -2.30 -1.34 0.00 0.00 175.55 172.50 1yho n PRO 163 N 4.07 1.62 0.00 4.97 -0.02 -1.26 -2.53 135.00 141.86 1yho n PRO 163 Ca -0.19 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1yho n PRO 163 Cb 0.51 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 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 0.98 2.75 3.71 -1.23 0.00 -1.26 -5.01 105.19 105.13 1yho n GLY 164 Ca 0.08 -0.47 -0.35 0.00 0.00 0.00 0.00 46.02 45.28 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 -1.31 4.63 0.22 1.61 0.11 -1.05 -5.07 120.40 119.54 1yho s VAL 165 Ca 0.00 -0.12 -0.31 0.00 -2.93 0.00 0.00 61.98 58.63 1yho s VAL 165 Cb 0.00 -2.99 -0.10 0.00 -1.53 0.00 0.00 36.38 31.76 1yho s VAL 165 CO 0.00 0.58 1.50 -0.22 -3.33 0.00 0.00 175.10 173.63 1yho s LEU 166 N -0.62 4.38 -0.14 2.54 0.20 -1.26 -4.63 118.68 119.15 1yho s LEU 166 Ca 0.11 2.68 0.16 0.00 0.69 0.00 0.00 54.13 57.77 1yho s LEU 166 Cb -0.12 -3.61 -0.23 0.00 -0.43 0.00 0.00 46.19 41.80 1yho s LEU 166 CO 0.02 -0.77 0.14 -0.24 -0.29 0.00 0.00 176.35 175.22 1yho n SER 167 N 2.91 0.74 -4.76 3.68 2.88 -1.26 -4.56 113.62 113.25 1yho n SER 167 Ca 0.09 0.00 -0.39 0.00 -1.33 0.00 0.00 58.87 57.24 1yho n SER 167 Cb 0.39 1.15 0.01 0.00 -0.75 0.00 0.00 64.21 65.01 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 -4.89 5.88 0.26 -3.46 -1.08 -1.26 -4.53 116.67 107.59 1yho s ASP 168 Ca -0.08 2.72 -0.30 0.00 -0.52 0.00 0.00 52.55 54.38 1yho s ASP 168 Cb 0.07 -2.64 -0.10 0.00 -1.46 0.00 0.00 42.92 38.79 1yho s ASP 168 CO 0.72 -1.15 1.31 -0.69 0.52 0.00 0.00 175.17 175.89 1yho s VAL 169 N -1.29 2.99 0.44 1.11 1.01 -1.26 -4.68 120.40 118.72 1yho s VAL 169 Ca 0.63 0.89 0.08 0.00 0.00 0.00 0.00 61.98 63.57 1yho s VAL 169 Cb -0.39 -3.56 0.00 0.00 0.00 0.00 0.00 36.38 32.43 1yho s VAL 169 CO 0.49 0.17 0.48 -1.10 0.00 0.00 0.00 175.10 175.14 1yho s GLN 170 N -0.80 2.58 -0.15 2.72 -1.52 0.06 -4.95 119.66 117.60 1yho s GLN 170 Ca 0.54 -1.50 -0.06 0.00 -1.95 0.00 0.00 55.36 52.39 1yho s GLN 170 Cb -0.38 -2.50 0.07 0.00 -0.22 0.00 0.00 33.01 29.98 1yho s GLN 170 CO 0.44 -0.32 0.33 -2.00 -0.25 0.00 0.00 175.29 173.49 1yho s GLU 171 N -4.26 0.25 -0.04 2.91 -6.30 -1.26 -1.94 118.70 108.06 1yho s GLU 171 Ca 0.50 0.80 -0.02 0.00 -2.50 0.00 0.00 54.97 53.76 1yho s GLU 171 Cb -0.05 0.06 0.03 0.00 0.00 0.00 0.00 34.13 34.17 1yho s GLU 171 CO 0.30 -0.23 0.09 -2.00 0.02 0.00 0.00 175.26 173.44 1yho s GLU 172 N 2.08 0.02 -1.68 4.30 2.56 -0.49 -4.84 118.70 120.65 1yho s GLU 172 Ca -0.03 0.30 -0.01 0.00 0.00 0.00 0.00 54.97 55.23 1yho s GLU 172 Cb -0.11 -0.24 0.00 0.00 2.00 0.00 0.00 34.13 35.78 1yho s GLU 172 CO -0.11 -0.19 0.13 1.63 -0.56 0.00 0.00 175.26 176.17 1yho n LYS 173 N 4.35 -2.29 -1.08 4.30 4.01 -1.26 -1.27 118.16 124.91 1yho n LYS 173 Ca -0.24 0.96 -0.03 0.00 -0.51 0.00 0.00 58.31 58.49 1yho n LYS 173 Cb 0.51 -5.61 -0.01 0.00 -0.51 0.00 0.00 35.03 29.40 1yho n LYS 173 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1yho n GLY 174 N -1.12 0.61 3.23 0.72 0.00 -1.26 -5.02 105.19 102.34 1yho n GLY 174 Ca -0.21 -0.72 -0.34 0.00 0.00 0.00 0.00 46.02 44.75 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 -2.07 2.74 -0.07 -0.61 1.01 -0.40 -5.11 121.20 116.69 1yho s ILE 175 Ca 0.00 -0.71 -0.14 0.00 0.00 0.00 0.00 60.65 59.80 1yho s ILE 175 Cb 0.00 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.22 1yho s ILE 175 CO 0.00 0.48 0.36 -0.54 0.00 0.00 0.00 174.94 175.24 1yho s LYS 176 N 1.31 3.99 0.10 2.79 1.02 -1.26 -1.40 119.74 126.30 1yho s LYS 176 Ca 0.04 0.28 -0.16 0.00 0.02 0.00 0.00 55.97 56.14 1yho s LYS 176 Cb -0.14 -3.29 0.03 0.00 -0.52 0.00 0.00 37.83 33.91 1yho s LYS 176 CO -0.07 0.53 0.40 1.52 -0.92 0.00 0.00 175.35 176.81 1yho s TYR 177 N -0.49 -0.21 0.26 3.18 1.13 -0.82 -0.34 117.35 120.07 1yho s TYR 177 Ca 0.21 -0.03 0.09 0.00 -1.41 0.00 0.00 57.07 55.94 1yho s TYR 177 Cb -0.15 0.24 -0.05 0.00 -1.10 0.00 0.00 41.96 40.90 1yho s TYR 177 CO 0.10 -0.66 -0.14 0.21 -2.51 0.00 0.00 175.55 172.54 1yho s LYS 178 N -3.43 1.56 -0.24 -3.49 2.20 0.14 -0.76 119.74 115.72 1yho s LYS 178 Ca 0.01 -1.74 -0.06 0.00 -0.36 0.00 0.00 55.97 53.82 1yho s LYS 178 Cb 0.01 -1.44 -0.02 0.00 -1.51 0.00 0.00 37.83 34.88 1yho s LYS 178 CO -0.09 0.20 0.03 -0.06 -0.36 0.00 0.00 175.35 175.07 1yho s PHE 179 N -2.77 3.03 -0.01 4.03 0.40 -1.26 -0.81 117.98 120.60 1yho s PHE 179 Ca 0.28 -0.62 0.03 0.00 -0.60 0.00 0.00 56.93 56.01 1yho s PHE 179 Cb -0.01 -2.19 -0.03 0.00 0.51 0.00 0.00 43.02 41.30 1yho s PHE 179 CO 0.12 -0.43 -0.06 -2.00 0.70 0.00 0.00 175.22 173.55 1yho s GLU 180 N 1.56 2.62 -0.10 0.44 2.56 0.28 -4.80 118.70 121.26 1yho s GLU 180 Ca 0.06 -0.68 0.00 0.00 0.00 0.00 0.00 54.97 54.36 1yho s GLU 180 Cb -0.15 -2.54 -0.02 0.00 2.00 0.00 0.00 34.13 33.42 1yho s GLU 180 CO 0.01 0.62 -0.10 0.08 -0.56 0.00 0.00 175.26 175.31 1yho s VAL 181 N -0.98 3.42 -0.08 3.70 1.01 -0.55 -0.83 120.40 126.10 1yho s VAL 181 Ca 0.17 -0.56 0.04 0.00 0.00 0.00 0.00 61.98 61.63 1yho s VAL 181 Cb -0.11 -2.42 0.00 0.00 0.00 0.00 0.00 36.38 33.85 1yho s VAL 181 CO 0.07 0.56 -0.19 -0.31 0.00 0.00 0.00 175.10 175.22 1yho s TYR 182 N -0.24 2.09 -0.12 5.22 2.02 0.29 0.88 117.35 127.50 1yho s TYR 182 Ca 0.02 -0.79 0.01 0.00 -0.37 0.00 0.00 57.07 55.94 1yho s TYR 182 Cb -0.13 -1.43 -0.01 0.00 -0.40 0.00 0.00 41.96 39.99 1yho s TYR 182 CO 0.03 -0.33 -0.15 -2.00 -1.57 0.00 0.00 175.55 171.53 1yho s GLU 183 N 0.37 3.24 -0.21 -0.62 2.56 -0.25 -0.38 118.70 123.41 1yho s GLU 183 Ca -0.15 -0.72 -0.09 0.00 0.00 0.00 0.00 54.97 54.01 1yho s GLU 183 Cb -0.16 -2.55 -0.05 0.00 2.00 0.00 0.00 34.13 33.37 1yho s GLU 183 CO 0.06 0.25 0.12 0.21 -0.56 0.00 0.00 175.26 175.34 1yho s LYS 184 N 0.24 4.06 -0.15 4.30 2.20 -0.83 0.25 119.74 129.82 1yho s LYS 184 Ca -0.10 -0.28 -0.06 0.00 -0.36 0.00 0.00 55.97 55.16 1yho s LYS 184 Cb -0.16 -3.40 -0.04 0.00 -1.51 0.00 0.00 37.83 32.72 1yho s LYS 184 CO 0.06 0.18 0.08 -0.80 -0.36 0.00 0.00 175.35 174.51 1yho s ASN 185 N 0.67 5.79 0.00 1.43 -0.87 -0.92 -3.91 114.94 117.14 1yho s ASN 185 Ca 0.06 0.20 0.05 0.00 -1.57 0.00 0.00 52.86 51.61 1yho s ASN 185 Cb -0.12 -1.91 0.31 0.00 -0.02 0.00 0.00 41.25 39.51 1yho s ASN 185 CO 0.01 0.27 0.78 -0.90 -2.57 0.00 0.00 177.10 174.70