#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 0.39 3.53 2.92 0.00 -1.26 -5.02 105.19 105.76 1yho n GLY 2 Ca 0.00 -0.66 -0.36 0.00 0.00 0.00 0.00 46.02 45.00 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 -2.79 5.48 -0.19 1.61 0.01 -1.26 -4.95 113.70 111.62 1yho s SER 3 Ca 0.00 -0.09 0.01 0.00 1.31 0.00 0.00 55.95 57.18 1yho s SER 3 Cb 0.00 -1.98 0.03 0.00 0.21 0.00 0.00 66.02 64.27 1yho s SER 3 CO 0.00 0.01 -0.19 -0.76 0.41 0.00 0.00 173.24 172.71 1yho s LEU 4 N 1.36 2.30 -0.21 2.44 1.02 -1.26 -1.58 118.68 122.75 1yho s LEU 4 Ca 0.06 -0.75 -0.02 0.00 0.02 0.00 0.00 54.13 53.43 1yho s LEU 4 Cb -0.15 -1.48 0.00 0.00 0.02 0.00 0.00 46.19 44.58 1yho s LEU 4 CO 0.05 -0.03 -0.09 0.20 0.02 0.00 0.00 176.35 176.49 1yho s ASN 5 N 1.27 3.91 -0.12 2.29 0.01 0.23 -2.20 114.94 120.33 1yho s ASN 5 Ca 0.03 -0.48 -0.04 0.00 -0.71 0.00 0.00 52.86 51.66 1yho s ASN 5 Cb -0.14 -1.65 -0.04 0.00 0.41 0.00 0.00 41.25 39.83 1yho s ASN 5 CO -0.12 -0.01 0.05 0.00 -1.51 0.00 0.00 177.10 175.50 1yho s ILE 7 N -0.59 -0.45 0.03 0.00 2.07 -0.86 0.10 121.20 121.51 1yho s ILE 7 Ca 0.11 0.25 -0.15 0.00 -1.41 0.00 0.00 60.65 59.46 1yho s ILE 7 Cb -0.12 -0.48 0.02 0.00 0.13 0.00 0.00 42.46 42.01 1yho s ILE 7 CO 0.02 0.10 0.32 0.68 -1.91 0.00 0.00 174.94 174.15 1yho s VAL 8 N 2.45 0.07 -0.03 4.00 -7.23 0.86 -4.48 120.40 116.04 1yho s VAL 8 Ca 0.01 -0.61 0.02 0.00 -1.81 0.00 0.00 61.98 59.58 1yho s VAL 8 Cb -0.12 -0.88 -0.03 0.00 0.56 0.00 0.00 36.38 35.90 1yho s VAL 8 CO -0.09 -0.34 -0.05 0.00 -0.31 0.00 0.00 175.10 174.31 1yho s ALA 9 N -2.32 3.07 0.01 1.32 0.00 -1.26 -1.61 121.76 120.97 1yho s ALA 9 Ca -0.07 -0.95 0.00 0.00 0.00 0.00 0.00 51.96 50.95 1yho s ALA 9 Cb -0.02 -1.23 -0.01 0.00 0.00 0.00 0.00 23.12 21.87 1yho s ALA 9 CO -0.02 0.60 -0.02 0.14 0.00 0.00 0.00 175.76 176.47 1yho s VAL 10 N -0.94 0.09 0.88 0.00 -7.23 0.22 -4.75 120.40 108.67 1yho s VAL 10 Ca 0.16 -0.43 -0.13 0.00 -1.81 0.00 0.00 61.98 59.76 1yho s VAL 10 Cb -0.11 -0.16 0.13 0.00 0.56 0.00 0.00 36.38 36.80 1yho s VAL 10 CO 0.05 -0.21 1.19 -0.94 -0.31 0.00 0.00 175.10 174.88 1yho s SER 11 N -0.67 3.83 0.61 4.85 1.04 0.01 -1.54 113.70 121.82 1yho s SER 11 Ca -0.07 0.75 0.33 0.00 0.48 0.00 0.00 55.95 57.44 1yho s SER 11 Cb -0.05 -1.19 1.94 0.00 0.10 0.00 0.00 66.02 66.83 1yho s SER 11 CO -0.00 -2.33 2.27 -0.61 0.98 0.00 0.00 173.24 173.54 1yho h GLN 12 N -1.35 0.00 -0.73 4.02 4.15 -1.27 0.12 115.11 120.05 1yho h GLN 12 Ca -0.47 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 58.88 1yho h GLN 12 Cb 1.31 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.96 1yho h GLN 12 CO 0.59 0.00 0.09 0.09 -1.93 0.00 0.00 178.83 177.67 1yho n ASN 13 N -3.67 4.52 -3.26 -0.69 3.02 -1.26 -4.89 115.26 109.03 1yho n ASN 13 Ca -0.03 -2.82 -0.24 0.00 -0.03 0.00 0.00 54.58 51.47 1yho n ASN 13 Cb 0.10 -0.67 0.04 0.00 -0.61 0.00 0.00 39.78 38.64 1yho n ASN 13 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 1yho n MET 14 N 0.27 -5.33 -4.14 3.52 2.81 0.03 -4.90 117.12 109.38 1yho n MET 14 Ca 0.26 0.81 -0.27 0.00 -1.81 0.00 0.00 57.70 56.69 1yho n MET 14 Cb 1.07 -5.69 -0.07 0.00 -0.71 0.00 0.00 33.22 27.82 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 -2.87 1.76 -0.07 3.03 0.00 -1.25 -0.37 107.32 107.56 1yho s GLY 15 Ca 0.40 -1.25 0.01 0.00 0.00 0.00 0.00 44.72 43.88 1yho s GLY 15 CO 0.50 -1.26 -0.05 0.29 0.00 0.00 0.00 173.10 172.58 1yho n ILE 16 N -0.09 0.40 0.00 0.90 -5.35 -1.05 -0.81 119.36 113.36 1yho n ILE 16 Ca -0.09 -0.17 0.00 0.00 -0.27 0.00 0.00 62.75 62.22 1yho n ILE 16 Cb 0.54 -0.77 0.00 0.00 -1.74 0.00 0.00 39.64 37.68 1yho n ILE 16 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1yho n GLY 17 N 3.08 1.62 3.43 3.28 0.00 -1.26 -4.23 105.19 111.12 1yho n GLY 17 Ca -0.12 -0.27 -0.33 0.00 0.00 0.00 0.00 46.02 45.30 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 -1.81 3.53 -1.62 1.61 -2.85 0.23 -2.84 119.74 116.00 1yho s LYS 18 Ca 0.00 -0.60 0.00 0.00 -1.00 0.00 0.00 55.97 54.37 1yho s LYS 18 Cb 0.00 -2.78 0.00 0.00 -2.06 0.00 0.00 37.83 32.99 1yho s LYS 18 CO 0.00 0.22 0.00 -1.71 0.10 0.00 0.00 175.35 173.96 1yho n ASN 19 N 3.56 -5.43 -0.09 0.03 4.05 -1.26 -1.58 115.26 114.54 1yho n ASN 19 Ca -0.18 -0.00 -0.01 0.00 0.45 0.00 0.00 54.58 54.84 1yho n ASN 19 Cb 0.53 -4.48 -0.00 0.00 1.23 0.00 0.00 39.78 37.05 1yho n ASN 19 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1yho n GLY 20 N -1.01 0.46 3.13 8.20 0.00 -1.26 -5.04 105.19 109.67 1yho n GLY 20 Ca -0.22 -1.03 -0.20 0.00 0.00 0.00 0.00 46.02 44.58 1yho n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1yho s ASP 21 N -2.98 1.58 0.41 1.61 -1.08 -0.61 -5.06 116.67 110.54 1yho s ASP 21 Ca 0.00 -0.45 -0.25 0.00 -0.52 0.00 0.00 52.55 51.33 1yho s ASP 21 Cb 0.00 -0.10 -0.08 0.00 -1.46 0.00 0.00 42.92 41.28 1yho s ASP 21 CO 0.00 0.02 1.23 -0.76 0.52 0.00 0.00 175.17 176.18 1yho s LEU 22 N -1.12 4.18 0.25 -1.34 1.43 -1.26 0.77 118.68 121.59 1yho s LEU 22 Ca 0.01 2.48 -0.05 0.00 -1.03 0.00 0.00 54.13 55.54 1yho s LEU 22 Cb -0.08 -4.00 0.34 0.00 0.03 0.00 0.00 46.19 42.48 1yho s LEU 22 CO 0.01 -0.79 1.87 -0.65 0.23 0.00 0.00 176.35 177.02 1yho h PRO 23 N 2.58 1.02 -6.18 1.29 0.11 -1.86 -3.43 132.00 125.53 1yho h PRO 23 Ca -0.49 -0.06 -0.54 0.00 0.11 0.00 0.00 66.00 65.02 1yho h PRO 23 Cb 1.24 -0.23 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 1yho h PRO 23 CO 0.62 0.67 -0.36 1.67 -0.21 0.00 0.00 178.00 180.39 1yho s TRP 24 N -6.06 3.48 1.26 0.65 -2.14 -1.26 -4.90 118.94 109.97 1yho s TRP 24 Ca -0.13 0.29 -0.18 0.00 2.66 0.00 0.00 56.10 58.74 1yho s TRP 24 Cb 0.19 -1.81 0.31 0.00 -3.10 0.00 0.00 33.47 29.05 1yho s TRP 24 CO 0.80 0.41 1.02 -1.25 -2.66 0.00 0.00 176.95 175.27 1yho s PRO 25 N -3.31 -1.65 -0.21 3.25 0.04 -1.26 -4.86 135.00 127.00 1yho s PRO 25 Ca 0.37 0.24 -0.38 0.00 0.04 0.00 0.00 61.00 61.28 1yho s PRO 25 Cb -0.11 -1.52 -0.14 0.00 0.04 0.00 0.00 34.50 32.77 1yho s PRO 25 CO 0.29 -4.06 1.79 -2.30 0.04 0.00 0.00 177.00 172.76 1yho n PRO 26 N -5.06 1.51 -3.89 0.56 -0.02 -1.26 -4.95 135.00 121.89 1yho n PRO 26 Ca 0.10 0.55 -0.35 0.00 -2.02 0.00 0.00 63.50 61.78 1yho n PRO 26 Cb 0.58 -2.29 -0.13 0.00 -0.02 0.00 0.00 33.50 31.64 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 3.72 4.14 0.25 2.45 2.96 -1.26 -4.97 118.68 125.97 1yho s LEU 27 Ca 0.96 -1.42 -0.02 0.00 -0.22 0.00 0.00 54.13 53.44 1yho s LEU 27 Cb -0.94 -1.73 0.31 0.00 0.50 0.00 0.00 46.19 44.33 1yho s LEU 27 CO 0.61 -0.31 1.71 -0.09 -1.32 0.00 0.00 176.35 176.95 1yho h ARG 28 N 7.99 0.71 -0.78 1.98 2.43 -1.98 -2.17 114.38 122.56 1yho h ARG 28 Ca -0.19 -0.24 0.01 0.00 -0.81 0.00 0.00 59.98 58.75 1yho h ARG 28 Cb 1.06 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 30.51 1yho h ARG 28 CO 0.56 0.81 0.50 -0.97 -1.51 0.00 0.00 179.97 179.36 1yho h ASN 29 N 0.64 0.90 -0.10 -3.80 -1.24 -1.98 0.50 115.58 110.51 1yho h ASN 29 Ca 0.11 -0.03 -0.21 0.00 0.71 0.00 0.00 56.30 56.88 1yho h ASN 29 Cb 0.60 -0.23 0.01 0.00 0.73 0.00 0.00 38.32 39.43 1yho h ASN 29 CO 0.04 0.66 -0.76 -0.08 -1.29 0.00 0.00 177.43 176.00 1yho h GLU 30 N 1.06 0.68 -0.36 6.67 4.81 -1.93 -1.54 114.58 123.97 1yho h GLU 30 Ca 0.28 -0.61 -0.15 0.00 -0.13 0.00 0.00 59.36 58.76 1yho h GLU 30 Cb -0.11 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.41 1yho h GLU 30 CO -0.06 1.21 -0.37 0.74 -0.73 0.00 0.00 179.01 179.80 1yho h PHE 31 N 0.36 1.06 -0.17 0.92 -1.00 -1.00 -0.30 116.94 116.80 1yho h PHE 31 Ca -0.07 -0.32 -0.13 0.00 2.81 0.00 0.00 57.97 60.26 1yho h PHE 31 Cb 1.40 -0.22 -0.01 0.00 3.61 0.00 0.00 35.95 40.73 1yho h PHE 31 CO 0.10 1.14 -0.45 0.00 -1.61 0.00 0.00 178.31 177.48 1yho h ARG 32 N 0.68 0.43 -0.07 1.51 3.08 -0.06 -2.02 114.38 117.93 1yho h ARG 32 Ca 0.05 -0.23 -0.19 0.00 0.07 0.00 0.00 59.98 59.68 1yho h ARG 32 Cb 0.96 0.01 0.01 0.00 0.08 0.00 0.00 29.97 31.04 1yho h ARG 32 CO 0.09 0.80 -0.72 -0.92 -1.07 0.00 0.00 179.97 178.16 1yho h TYR 33 N 0.35 0.86 -0.08 3.04 3.20 -1.21 -1.71 116.97 121.42 1yho h TYR 33 Ca 0.02 -0.42 -0.00 0.00 3.14 0.00 0.00 58.73 61.47 1yho h TYR 33 Cb 0.94 -0.12 -0.00 0.00 1.54 0.00 0.00 36.73 39.08 1yho h TYR 33 CO 0.03 1.23 0.03 0.35 -1.64 0.00 0.00 178.16 178.17 1yho h PHE 34 N 0.25 0.12 -0.62 -3.82 3.04 -1.02 -0.41 116.94 114.48 1yho h PHE 34 Ca -0.07 -0.01 -0.08 0.00 3.98 0.00 0.00 57.97 61.79 1yho h PHE 34 Cb 1.37 -0.04 -0.02 0.00 2.56 0.00 0.00 35.95 39.82 1yho h PHE 34 CO 0.11 0.22 0.08 1.96 -2.02 0.00 0.00 178.31 178.66 1yho h GLN 35 N -0.01 1.04 -0.77 1.11 4.20 -1.45 -2.08 115.11 117.14 1yho h GLN 35 Ca 0.03 -0.29 -0.03 0.00 0.06 0.00 0.00 58.65 58.41 1yho h GLN 35 Cb 0.15 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.78 1yho h GLN 35 CO -0.00 0.98 0.35 -0.09 -0.67 0.00 0.00 178.83 179.40 1yho h ARG 36 N 0.94 1.13 -0.44 1.46 1.12 -1.18 0.41 114.38 117.83 1yho h ARG 36 Ca 0.18 -0.18 -0.09 0.00 -1.11 0.00 0.00 59.98 58.78 1yho h ARG 36 Cb 0.46 -0.20 -0.02 0.00 -0.01 0.00 0.00 29.97 30.21 1yho h ARG 36 CO 0.02 0.89 -0.10 1.98 -3.11 0.00 0.00 179.97 179.64 1yho h MET 37 N 1.10 0.79 0.03 0.20 4.05 -0.88 -1.71 114.93 118.52 1yho h MET 37 Ca 0.26 -0.26 -0.15 0.00 -0.28 0.00 0.00 59.70 59.27 1yho h MET 37 Cb 0.15 -0.07 0.01 0.00 -0.80 0.00 0.00 31.60 30.90 1yho h MET 37 CO -0.03 0.86 -0.62 1.79 0.23 0.00 0.00 176.91 179.14 1yho h THR 38 N 0.72 1.45 -0.15 -0.77 1.35 -1.00 -3.25 112.91 111.26 1yho h THR 38 Ca 0.12 -2.17 -0.00 0.00 -0.55 0.00 0.00 66.41 63.81 1yho h THR 38 Cb 0.59 2.73 -0.01 0.00 -1.73 0.00 0.00 68.15 69.73 1yho h THR 38 CO 0.04 0.62 0.09 0.71 -0.25 0.00 0.00 175.52 176.73 1yho h THR 39 N -0.19 1.05 -2.18 6.82 1.35 -0.16 -3.39 112.91 116.20 1yho h THR 39 Ca -0.09 -0.11 -0.52 0.00 -0.55 0.00 0.00 66.41 65.14 1yho h THR 39 Cb 1.36 0.84 -0.03 0.00 -1.73 0.00 0.00 68.15 68.59 1yho h THR 39 CO 0.12 0.05 1.36 -0.89 -0.25 0.00 0.00 175.52 175.91 1yho s THR 40 N -5.19 3.36 0.31 6.82 2.01 -0.65 -4.97 115.64 117.33 1yho s THR 40 Ca -0.06 0.28 -0.09 0.00 0.31 0.00 0.00 61.69 62.13 1yho s THR 40 Cb 0.17 -3.72 -0.07 0.00 0.01 0.00 0.00 72.50 68.89 1yho s THR 40 CO 0.69 -0.62 0.64 -0.55 -0.69 0.00 0.00 174.62 174.09 1yho s SER 41 N 7.86 6.56 -0.21 3.53 0.15 -1.26 -4.98 113.70 125.35 1yho s SER 41 Ca 0.75 0.97 0.10 0.00 0.70 0.00 0.00 55.95 58.48 1yho s SER 41 Cb -0.17 -2.25 -0.22 0.00 -1.71 0.00 0.00 66.02 61.68 1yho s SER 41 CO 0.26 -0.22 -0.02 -1.20 1.20 0.00 0.00 173.24 173.26 1yho n SER 42 N -0.74 0.94 -4.35 5.45 7.64 -1.26 -4.93 113.62 116.38 1yho n SER 42 Ca 0.01 -0.03 -0.33 0.00 1.01 0.00 0.00 58.87 59.53 1yho n SER 42 Cb 0.53 0.30 -0.15 0.00 -1.01 0.00 0.00 64.21 63.88 1yho n SER 42 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1yho s VAL 43 N -2.51 2.77 0.18 0.44 -7.23 -1.26 -5.11 120.40 107.69 1yho s VAL 43 Ca -0.21 -0.77 -0.30 0.00 -1.81 0.00 0.00 61.98 58.89 1yho s VAL 43 Cb 0.07 -2.13 -0.08 0.00 0.56 0.00 0.00 36.38 34.81 1yho s VAL 43 CO 0.73 0.54 0.97 -0.70 -0.31 0.00 0.00 175.10 176.34 1yho s GLU 44 N 0.16 4.75 0.00 4.82 2.12 -1.26 -3.42 118.70 125.88 1yho s GLU 44 Ca -0.09 1.51 0.00 0.00 0.36 0.00 0.00 54.97 56.75 1yho s GLU 44 Cb -0.15 -3.32 0.00 0.00 0.26 0.00 0.00 34.13 30.92 1yho s GLU 44 CO 0.06 0.33 0.00 0.41 -0.54 0.00 0.00 175.26 175.51 1yho n GLY 45 N 1.85 0.81 3.70 -1.50 0.00 -1.26 -5.05 105.19 103.74 1yho n GLY 45 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.73 2.50 0.02 1.61 3.01 -1.22 -5.03 119.74 119.90 1yho s LYS 46 Ca 0.00 -1.29 0.06 0.00 -1.01 0.00 0.00 55.97 53.73 1yho s LYS 46 Cb 0.00 -2.30 -0.02 0.00 -1.01 0.00 0.00 37.83 34.50 1yho s LYS 46 CO 0.00 0.38 -0.19 -0.65 0.51 0.00 0.00 175.35 175.40 1yho s GLN 47 N -3.71 1.36 -0.09 1.68 -0.21 -0.93 -4.94 119.66 112.82 1yho s GLN 47 Ca 0.32 -0.81 -0.09 0.00 0.02 0.00 0.00 55.36 54.79 1yho s GLN 47 Cb -0.07 -1.40 -0.05 0.00 1.00 0.00 0.00 33.01 32.49 1yho s GLN 47 CO 0.21 0.37 0.22 -0.80 -2.12 0.00 0.00 175.29 173.17 1yho s ASN 48 N -0.90 6.50 -0.16 5.90 0.01 -1.26 -2.57 114.94 122.46 1yho s ASN 48 Ca 0.06 0.60 -0.03 0.00 -0.71 0.00 0.00 52.86 52.79 1yho s ASN 48 Cb -0.08 -2.12 -0.02 0.00 0.41 0.00 0.00 41.25 39.43 1yho s ASN 48 CO 0.01 0.37 -0.06 -0.22 -1.51 0.00 0.00 177.10 175.69 1yho s LEU 49 N -0.95 3.05 0.00 0.60 0.20 -0.92 -2.27 118.68 118.39 1yho s LEU 49 Ca 0.17 -0.23 0.02 0.00 0.69 0.00 0.00 54.13 54.78 1yho s LEU 49 Cb -0.13 -1.73 -0.04 0.00 -0.43 0.00 0.00 46.19 43.86 1yho s LEU 49 CO 0.06 0.13 0.00 0.68 -0.29 0.00 0.00 176.35 176.93 1yho s VAL 50 N 0.59 4.15 -0.10 1.68 -7.23 0.17 -0.92 120.40 118.74 1yho s VAL 50 Ca -0.04 -0.62 -0.01 0.00 -1.81 0.00 0.00 61.98 59.51 1yho s VAL 50 Cb -0.15 -2.85 -0.03 0.00 0.56 0.00 0.00 36.38 33.91 1yho s VAL 50 CO 0.03 0.37 -0.06 -0.63 -0.31 0.00 0.00 175.10 174.50 1yho s ILE 51 N -1.09 3.76 0.05 -0.62 1.01 -0.12 -0.37 121.20 123.82 1yho s ILE 51 Ca 0.20 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.43 1yho s ILE 51 Cb -0.12 -2.58 -0.03 0.00 0.01 0.00 0.00 42.46 39.74 1yho s ILE 51 CO 0.10 0.56 -0.06 -0.04 0.00 0.00 0.00 174.94 175.50 1yho s MET 52 N -0.33 0.53 0.80 2.79 -1.94 0.23 -1.59 119.30 119.79 1yho s MET 52 Ca 0.05 -0.85 -0.12 0.00 -1.71 0.00 0.00 55.69 53.06 1yho s MET 52 Cb -0.12 -0.14 0.07 0.00 2.01 0.00 0.00 34.83 36.65 1yho s MET 52 CO 0.02 0.00 1.15 0.20 -0.01 0.00 0.00 175.02 176.39 1yho s GLY 53 N -1.88 1.60 0.15 -0.03 0.00 0.26 -1.65 107.32 105.77 1yho s GLY 53 Ca -0.07 -0.53 -0.17 0.00 0.00 0.00 0.00 44.72 43.95 1yho s GLY 53 CO -0.02 -0.06 1.81 1.70 0.00 0.00 0.00 173.10 176.53 1yho h LYS 54 N -1.04 0.51 -0.61 2.90 3.64 -1.89 -1.29 116.57 118.78 1yho h LYS 54 Ca -0.47 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 58.87 1yho h LYS 54 Cb 1.31 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.99 1yho h LYS 54 CO 0.64 0.34 0.34 -0.22 -2.27 0.00 0.00 179.45 178.29 1yho h LYS 55 N 0.52 0.85 -0.46 1.90 1.63 -1.93 -2.21 116.57 116.86 1yho h LYS 55 Ca 0.14 -0.09 0.00 0.00 -0.85 0.00 0.00 60.65 59.85 1yho h LYS 55 Cb -0.05 -0.17 -0.02 0.00 -0.60 0.00 0.00 32.23 31.39 1yho h LYS 55 CO -0.03 0.64 0.29 1.15 -3.45 0.00 0.00 179.45 178.05 1yho h THR 56 N 0.83 1.13 -0.85 1.00 2.02 -1.86 -0.13 112.91 115.06 1yho h THR 56 Ca 0.22 -0.27 0.03 0.00 0.77 0.00 0.00 66.41 67.16 1yho h THR 56 Cb 0.03 0.48 -0.05 0.00 -1.74 0.00 0.00 68.15 66.87 1yho h THR 56 CO -0.04 0.13 0.55 -0.25 0.37 0.00 0.00 175.52 176.28 1yho h TRP 57 N 0.62 1.02 0.00 3.16 2.91 -0.97 -0.73 115.95 121.96 1yho h TRP 57 Ca 0.17 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.21 1yho h TRP 57 Cb -0.04 -0.34 0.00 0.00 -0.51 0.00 0.00 29.16 28.27 1yho h TRP 57 CO -0.04 0.59 0.00 0.74 -1.03 0.00 0.00 178.44 178.70 1yho h PHE 58 N 1.06 0.00 0.00 2.65 0.04 -1.00 -3.07 116.94 116.62 1yho h PHE 58 Ca 0.34 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.91 1yho h PHE 58 Cb 0.00 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 1yho h PHE 58 CO -0.02 0.00 -1.03 1.03 -0.60 0.00 0.00 178.31 177.69 1yho h SER 59 N 0.00 0.00 -2.85 2.17 0.87 0.34 -3.45 113.55 110.64 1yho h SER 59 Ca 0.00 0.00 -0.56 0.00 -1.23 0.00 0.00 61.79 60.00 1yho h SER 59 Cb 0.73 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.67 1yho h SER 59 CO 0.00 0.87 0.92 -0.63 -0.53 0.00 0.00 176.83 177.46 1yho s ILE 60 N -2.76 3.96 0.94 2.23 1.01 -0.47 -4.99 121.20 121.12 1yho s ILE 60 Ca 0.01 1.22 -0.12 0.00 0.00 0.00 0.00 60.65 61.76 1yho s ILE 60 Cb 0.09 -3.79 0.07 0.00 0.01 0.00 0.00 42.46 38.84 1yho s ILE 60 CO 0.81 -0.07 0.65 -2.65 0.00 0.00 0.00 174.94 173.68 1yho n PRO 61 N 6.33 -0.34 0.19 2.79 -0.02 -1.26 -4.73 135.00 137.97 1yho n PRO 61 Ca 0.14 -0.05 0.04 0.00 -2.02 0.00 0.00 63.50 61.61 1yho n PRO 61 Cb 0.44 -2.03 0.38 0.00 -0.02 0.00 0.00 33.50 32.27 1yho n PRO 61 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1yho h GLU 62 N -1.66 0.00 -0.19 -0.52 5.08 -1.94 -1.69 114.58 113.66 1yho h GLU 62 Ca -0.43 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 57.95 1yho h GLU 62 Cb 1.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 1yho h GLU 62 CO 0.37 0.37 0.13 0.87 -1.00 0.00 0.00 179.01 179.74 1yho h LYS 63 N 0.00 0.14 0.04 2.33 6.56 -1.99 -2.73 116.57 120.92 1yho h LYS 63 Ca -0.00 -0.01 -0.36 0.00 -1.06 0.00 0.00 60.65 59.22 1yho h LYS 63 Cb 0.71 -0.03 -0.05 0.00 -0.57 0.00 0.00 32.23 32.29 1yho h LYS 63 CO 0.05 0.10 -2.15 0.09 -2.06 0.00 0.00 179.45 175.47 1yho n ASN 64 N -4.50 1.36 -4.76 0.86 3.02 -1.04 -4.92 115.26 105.28 1yho n ASN 64 Ca 0.01 0.11 -0.40 0.00 -0.03 0.00 0.00 54.58 54.27 1yho n ASN 64 Cb 0.16 -0.17 -0.05 0.00 -0.61 0.00 0.00 39.78 39.10 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 -2.54 4.60 0.45 3.52 0.52 -0.66 -2.07 118.95 122.77 1yho s ARG 65 Ca -0.19 1.21 -0.24 0.00 -0.52 0.00 0.00 55.73 55.99 1yho s ARG 65 Cb 0.07 -3.31 -0.08 0.00 0.52 0.00 0.00 34.95 32.16 1yho s ARG 65 CO 0.75 0.43 1.19 -1.25 0.02 0.00 0.00 175.30 176.44 1yho s PRO 66 N -0.68 3.80 -0.86 3.54 0.04 -1.26 -4.72 135.00 134.86 1yho s PRO 66 Ca 0.39 1.85 -0.25 0.00 0.04 0.00 0.00 61.00 63.02 1yho s PRO 66 Cb -0.23 -2.48 0.01 0.00 0.04 0.00 0.00 34.50 31.83 1yho s PRO 66 CO 0.26 -0.54 1.63 -1.17 0.04 0.00 0.00 177.00 177.23 1yho s LEU 67 N -2.89 3.30 0.81 -3.56 1.98 -0.88 -4.98 118.68 112.46 1yho s LEU 67 Ca 0.62 -0.71 -0.11 0.00 -2.89 0.00 0.00 54.13 51.04 1yho s LEU 67 Cb -0.30 -2.56 0.08 0.00 0.66 0.00 0.00 46.19 44.07 1yho s LEU 67 CO 0.37 -2.09 1.13 -0.54 -1.89 0.00 0.00 176.35 173.33 1yho s LYS 68 N 6.09 1.81 0.00 1.98 -0.14 -1.26 -3.53 119.74 124.68 1yho s LYS 68 Ca 0.55 1.40 0.00 0.00 -1.36 0.00 0.00 55.97 56.56 1yho s LYS 68 Cb -0.06 -1.83 0.00 0.00 -1.68 0.00 0.00 37.83 34.26 1yho s LYS 68 CO 0.03 -2.02 0.00 0.41 -0.76 0.00 0.00 175.35 173.01 1yho n GLY 69 N -0.42 2.76 3.11 -3.33 0.00 -1.26 -4.98 105.19 101.07 1yho n GLY 69 Ca 0.11 -0.42 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 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 0.66 -0.29 1.61 1.81 -1.23 -4.80 118.95 116.72 1yho s ARG 70 Ca 0.00 -0.96 -0.29 0.00 -1.72 0.00 0.00 55.73 52.76 1yho s ARG 70 Cb 0.00 -0.34 0.01 0.00 -0.45 0.00 0.00 34.95 34.18 1yho s ARG 70 CO 0.00 0.05 1.05 0.42 -0.68 0.00 0.00 175.30 176.14 1yho s ILE 71 N -2.06 4.58 -0.23 1.52 -1.09 -0.96 -4.80 121.20 118.16 1yho s ILE 71 Ca -0.02 1.83 -0.17 0.00 -2.23 0.00 0.00 60.65 60.06 1yho s ILE 71 Cb -0.05 -4.37 -0.03 0.00 -1.58 0.00 0.00 42.46 36.42 1yho s ILE 71 CO -0.01 -0.36 0.45 0.20 -1.23 0.00 0.00 174.94 173.98 1yho s ASN 72 N 1.49 6.43 -0.09 3.58 0.01 -1.26 0.46 114.94 125.55 1yho s ASN 72 Ca 0.45 0.51 0.02 0.00 -0.71 0.00 0.00 52.86 53.13 1yho s ASN 72 Cb -0.13 -2.25 -0.02 0.00 0.41 0.00 0.00 41.25 39.26 1yho s ASN 72 CO 0.12 -0.16 -0.16 -0.22 -1.51 0.00 0.00 177.10 175.16 1yho s LEU 73 N 1.73 2.58 -0.11 0.60 0.20 0.50 -1.91 118.68 122.27 1yho s LEU 73 Ca 0.20 -0.34 -0.03 0.00 0.69 0.00 0.00 54.13 54.65 1yho s LEU 73 Cb -0.15 -1.54 -0.03 0.00 -0.43 0.00 0.00 46.19 44.03 1yho s LEU 73 CO 0.09 0.23 0.01 -0.69 -0.29 0.00 0.00 176.35 175.70 1yho s VAL 74 N -0.03 4.38 -0.28 1.68 1.01 -0.52 0.75 120.40 127.39 1yho s VAL 74 Ca -0.04 -0.21 -0.06 0.00 0.00 0.00 0.00 61.98 61.67 1yho s VAL 74 Cb -0.14 -2.87 0.01 0.00 0.00 0.00 0.00 36.38 33.37 1yho s VAL 74 CO 0.04 0.57 0.05 -0.76 0.00 0.00 0.00 175.10 175.00 1yho s LEU 75 N -0.54 3.62 -0.30 3.92 1.43 -0.66 -2.05 118.68 124.12 1yho s LEU 75 Ca 0.09 -0.64 -0.10 0.00 -1.03 0.00 0.00 54.13 52.46 1yho s LEU 75 Cb -0.12 -1.84 0.13 0.00 0.03 0.00 0.00 46.19 44.39 1yho s LEU 75 CO 0.02 -0.15 0.64 -0.55 0.23 0.00 0.00 176.35 176.54 1yho s SER 76 N 1.49 -1.13 0.04 2.29 0.15 -0.62 -3.32 113.70 112.61 1yho s SER 76 Ca 0.03 1.54 0.09 0.00 0.70 0.00 0.00 55.95 58.30 1yho s SER 76 Cb -0.17 2.27 -0.22 0.00 -1.71 0.00 0.00 66.02 66.19 1yho s SER 76 CO 0.01 -0.22 0.97 -0.09 1.20 0.00 0.00 173.24 175.11 1yho h ARG 77 N 8.01 0.02 -0.44 5.44 2.43 -1.76 -3.33 114.38 124.74 1yho h ARG 77 Ca -0.18 -0.03 -0.08 0.00 -0.81 0.00 0.00 59.98 58.87 1yho h ARG 77 Cb 1.10 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.65 1yho h ARG 77 CO 0.11 0.78 -0.06 1.49 -1.51 0.00 0.00 179.97 180.78 1yho h GLU 78 N 0.01 0.75 -6.99 0.20 4.81 -1.96 -3.43 114.58 107.97 1yho h GLU 78 Ca -0.15 -0.22 -0.48 0.00 -0.13 0.00 0.00 59.36 58.38 1yho h GLU 78 Cb 1.90 -0.08 0.02 0.00 0.63 0.00 0.00 28.75 31.22 1yho h GLU 78 CO 0.11 0.80 0.40 -1.17 -0.73 0.00 0.00 179.01 178.43 1yho s LEU 79 N -9.07 4.08 -0.19 1.64 2.96 -1.25 -4.97 118.68 111.88 1yho s LEU 79 Ca -0.09 2.00 0.17 0.00 -0.22 0.00 0.00 54.13 55.99 1yho s LEU 79 Cb 0.14 -4.27 -0.24 0.00 0.50 0.00 0.00 46.19 42.33 1yho s LEU 79 CO 0.81 -0.54 0.08 1.17 -1.32 0.00 0.00 176.35 176.55 1yho n LYS 80 N -0.25 0.86 -4.66 1.98 3.00 -1.26 -4.96 118.16 112.86 1yho n LYS 80 Ca 0.06 -0.01 -0.25 0.00 -0.00 0.00 0.00 58.31 58.11 1yho n LYS 80 Cb 0.50 -1.49 -0.14 0.00 0.00 0.00 0.00 35.03 33.90 1yho n LYS 80 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1yho s GLU 81 N -2.49 1.35 0.22 1.64 2.02 -1.26 -5.11 118.70 115.07 1yho s GLU 81 Ca -0.09 -0.85 -0.32 0.00 0.02 0.00 0.00 54.97 53.72 1yho s GLU 81 Cb 0.06 -1.42 -0.13 0.00 0.10 0.00 0.00 34.13 32.74 1yho s GLU 81 CO 0.79 0.37 1.50 -2.30 0.02 0.00 0.00 175.26 175.63 1yho n PRO 82 N 2.03 2.19 -1.26 0.39 -0.02 -1.26 -4.93 135.00 132.13 1yho n PRO 82 Ca -0.17 0.78 -0.35 0.00 -2.02 0.00 0.00 63.50 61.74 1yho n PRO 82 Cb 0.54 -2.50 0.09 0.00 -0.02 0.00 0.00 33.50 31.60 1yho n PRO 82 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1yho n PRO 83 N 2.56 0.35 -1.99 0.52 -0.02 -1.26 -4.89 135.00 130.28 1yho n PRO 83 Ca 0.13 0.17 -0.42 0.00 -2.02 0.00 0.00 63.50 61.36 1yho n PRO 83 Cb 0.31 -2.09 -0.03 0.00 -0.02 0.00 0.00 33.50 31.67 1yho n PRO 83 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1yho s GLN 84 N -3.24 4.23 0.00 -0.52 1.11 -1.26 -2.25 119.66 117.72 1yho s GLN 84 Ca 0.70 2.27 0.00 0.00 0.01 0.00 0.00 55.36 58.34 1yho s GLN 84 Cb -0.33 -3.41 0.00 0.00 -1.01 0.00 0.00 33.01 28.26 1yho s GLN 84 CO 0.54 -0.64 0.00 0.41 0.01 0.00 0.00 175.29 175.61 1yho n GLY 85 N 3.82 3.19 3.82 3.09 0.00 -1.26 -5.04 105.19 112.81 1yho n GLY 85 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 1yho n GLY 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yho s ALA 86 N -2.91 2.83 -0.05 4.61 0.00 -0.96 -4.67 121.76 120.62 1yho s ALA 86 Ca 0.00 0.24 -0.17 0.00 0.00 0.00 0.00 51.96 52.03 1yho s ALA 86 Cb 0.00 -3.18 -0.31 0.00 0.00 0.00 0.00 23.12 19.63 1yho s ALA 86 CO 0.00 -0.76 0.79 0.45 0.00 0.00 0.00 175.76 176.24 1yho h HIS 87 N 0.24 0.65 -2.65 0.00 3.86 -1.70 -3.47 115.15 112.07 1yho h HIS 87 Ca -0.46 -0.48 -0.05 0.00 -1.16 0.00 0.00 60.37 58.23 1yho h HIS 87 Cb 1.21 -0.03 -0.16 0.00 1.06 0.00 0.00 27.41 29.50 1yho h HIS 87 CO 0.61 1.50 0.13 -0.06 0.86 0.00 0.00 177.93 180.97 1yho s PHE 88 N -2.51 -0.52 -0.02 2.45 0.08 -1.24 -5.06 117.98 111.17 1yho s PHE 88 Ca -0.15 0.59 0.03 0.00 0.12 0.00 0.00 56.93 57.52 1yho s PHE 88 Cb 0.03 0.42 0.00 0.00 -0.57 0.00 0.00 43.02 42.91 1yho s PHE 88 CO 0.84 -0.70 -0.10 -1.17 -0.10 0.00 0.00 175.22 174.00 1yho s LEU 89 N -2.02 1.85 0.07 -0.37 2.96 -1.26 -1.43 118.68 118.47 1yho s LEU 89 Ca -0.05 -0.20 0.07 0.00 -0.22 0.00 0.00 54.13 53.74 1yho s LEU 89 Cb -0.01 -0.57 -0.03 0.00 0.50 0.00 0.00 46.19 46.09 1yho s LEU 89 CO -0.02 0.09 -0.20 -0.55 -1.32 0.00 0.00 176.35 174.35 1yho s SER 90 N 0.08 2.37 0.07 3.68 0.15 -0.87 -4.87 113.70 114.31 1yho s SER 90 Ca -0.01 -0.59 -0.12 0.00 0.70 0.00 0.00 55.95 55.93 1yho s SER 90 Cb -0.08 -0.16 -0.24 0.00 -1.71 0.00 0.00 66.02 63.84 1yho s SER 90 CO 0.00 0.09 1.16 0.03 1.20 0.00 0.00 173.24 175.73 1yho h ARG 91 N 4.52 0.58 -4.83 5.44 3.08 -1.90 -1.64 114.38 119.63 1yho h ARG 91 Ca -0.43 -0.72 -0.31 0.00 0.07 0.00 0.00 59.98 58.58 1yho h ARG 91 Cb 1.17 0.23 -0.15 0.00 0.08 0.00 0.00 29.97 31.30 1yho h ARG 91 CO 0.42 1.31 -0.64 -1.54 -1.07 0.00 0.00 179.97 178.45 1yho s SER 92 N -7.32 1.16 0.20 7.04 1.04 -1.26 -3.69 113.70 110.87 1yho s SER 92 Ca -0.08 -1.28 -0.09 0.00 0.48 0.00 0.00 55.95 54.98 1yho s SER 92 Cb 0.07 0.15 0.13 0.00 0.10 0.00 0.00 66.02 66.47 1yho s SER 92 CO 0.92 -0.66 1.75 0.25 0.98 0.00 0.00 173.24 176.48 1yho h LEU 93 N 2.55 1.05 -0.65 2.42 5.85 -1.99 -1.98 115.31 122.54 1yho h LEU 93 Ca -0.37 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.16 1yho h LEU 93 Cb 1.23 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.95 1yho h LEU 93 CO 0.61 0.95 0.42 -0.78 -0.34 0.00 0.00 178.44 179.30 1yho h ASP 94 N 1.08 0.76 -0.30 1.25 1.82 -1.99 -0.63 116.42 118.41 1yho h ASP 94 Ca 0.24 -0.04 -0.02 0.00 -0.39 0.00 0.00 57.03 56.82 1yho h ASP 94 Cb 0.25 -0.19 -0.01 0.00 0.68 0.00 0.00 39.33 40.06 1yho h ASP 94 CO -0.02 0.57 0.09 -0.78 -1.61 0.00 0.00 179.24 177.49 1yho h ASP 95 N 0.89 0.43 -0.69 2.28 1.82 -1.91 -1.90 116.42 117.33 1yho h ASP 95 Ca 0.24 -0.21 0.00 0.00 -0.39 0.00 0.00 57.03 56.67 1yho h ASP 95 Cb -0.07 -0.11 -0.03 0.00 0.68 0.00 0.00 39.33 39.79 1yho h ASP 95 CO -0.05 0.53 0.45 0.00 -1.61 0.00 0.00 179.24 178.55 1yho h ALA 96 N 0.92 0.88 -0.52 -0.78 0.00 -1.09 -2.13 119.26 116.54 1yho h ALA 96 Ca 0.10 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1yho h ALA 96 Cb 0.25 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1yho h ALA 96 CO -0.00 0.32 0.17 -0.07 0.00 0.00 0.00 179.25 179.67 1yho h LEU 97 N 0.94 0.70 -0.42 0.00 3.38 -0.97 -2.28 115.31 116.67 1yho h LEU 97 Ca 0.25 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1yho h LEU 97 Cb -0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.47 1yho h LEU 97 CO -0.05 0.66 0.11 0.50 0.09 0.00 0.00 178.44 179.75 1yho h LYS 98 N 0.75 0.66 -0.57 1.13 3.64 -0.74 0.36 116.57 121.81 1yho h LYS 98 Ca 0.18 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1yho h LYS 98 Cb 0.21 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 1yho h LYS 98 CO -0.01 0.67 0.33 1.25 -2.27 0.00 0.00 179.45 179.42 1yho h LEU 99 N 0.54 0.70 -0.52 5.20 5.85 -1.10 0.33 115.31 126.31 1yho h LEU 99 Ca 0.13 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 1yho h LEU 99 Cb 0.30 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 1yho h LEU 99 CO -0.00 0.57 -0.34 0.74 -0.34 0.00 0.00 178.44 179.07 1yho h THR 100 N 0.77 0.68 0.00 1.05 2.02 -1.27 -3.09 112.91 113.07 1yho h THR 100 Ca 0.20 -1.63 0.00 0.00 0.77 0.00 0.00 66.41 65.75 1yho h THR 100 Cb 0.02 2.09 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 1yho h THR 100 CO -0.04 0.34 -0.54 -0.33 0.37 0.00 0.00 175.52 175.32 1yho h GLU 101 N 0.00 0.00 -7.16 6.66 5.08 0.31 -3.29 114.58 116.17 1yho h GLU 101 Ca -0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.82 1yho h GLU 101 Cb 1.06 0.00 0.15 0.00 0.50 0.00 0.00 28.75 30.46 1yho h GLU 101 CO 0.04 0.00 0.41 -0.65 -1.00 0.00 0.00 179.01 177.81 1yho s GLN 102 N -3.29 2.34 0.51 2.33 -0.21 0.11 -4.68 119.66 116.76 1yho s GLN 102 Ca 0.03 1.75 0.26 0.00 0.02 0.00 0.00 55.36 57.42 1yho s GLN 102 Cb 0.08 -1.86 1.35 0.00 1.00 0.00 0.00 33.01 33.58 1yho s GLN 102 CO 0.73 -1.68 2.03 -1.00 -2.12 0.00 0.00 175.29 173.25 1yho h PRO 103 N -0.06 0.00 -0.40 2.91 0.13 -1.90 0.91 132.00 133.59 1yho h PRO 103 Ca -0.48 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.54 1yho h PRO 103 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1yho h PRO 103 CO 0.51 0.14 -0.20 0.93 -0.23 0.00 0.00 178.00 179.15 1yho h GLU 104 N 0.00 0.78 0.00 0.86 5.08 -1.91 -3.16 114.58 116.23 1yho h GLU 104 Ca -0.00 -0.31 -0.26 0.00 -1.00 0.00 0.00 59.36 57.79 1yho h GLU 104 Cb 0.40 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.56 1yho h GLU 104 CO 0.02 0.92 -2.17 1.28 -1.00 0.00 0.00 179.01 178.06 1yho n LEU 105 N -4.12 0.00 0.12 1.33 4.32 -1.04 -4.37 117.00 113.23 1yho n LEU 105 Ca 0.00 0.00 0.17 0.00 -0.02 0.00 0.00 56.01 56.16 1yho n LEU 105 Cb 0.42 0.35 0.73 0.00 -1.62 0.00 0.00 43.42 43.30 1yho n LEU 105 CO 0.44 0.35 1.15 0.00 -1.22 0.00 0.00 177.39 178.12 1yho h ALA 106 N 1.08 2.17 0.00 -1.18 0.00 0.79 0.84 119.26 122.95 1yho h ALA 106 Ca -0.39 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.38 1yho h ALA 106 Cb 1.86 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.66 1yho h ALA 106 CO 0.02 -0.42 -0.60 -0.91 0.00 0.00 0.00 179.25 177.34 1yho h ASN 107 N 0.00 0.00 0.18 0.00 -0.26 -1.75 -3.24 115.58 110.51 1yho h ASN 107 Ca 0.15 0.00 -0.34 0.00 -0.56 0.00 0.00 56.30 55.55 1yho h ASN 107 Cb 0.67 0.00 -0.06 0.00 -1.06 0.00 0.00 38.32 37.86 1yho h ASN 107 CO -0.00 0.60 -2.13 0.29 -1.06 0.00 0.00 177.43 175.13 1yho n LYS 108 N -3.81 0.67 -4.48 0.81 4.76 0.28 -4.91 118.16 111.49 1yho n LYS 108 Ca -0.01 0.12 -0.34 0.00 -2.87 0.00 0.00 58.31 55.20 1yho n LYS 108 Cb 0.60 -1.63 -0.10 0.00 -1.84 0.00 0.00 35.03 32.07 1yho n LYS 108 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1yho s VAL 109 N -2.53 4.04 -0.03 -0.18 1.01 0.27 -2.19 120.40 120.78 1yho s VAL 109 Ca -0.09 -0.37 -0.01 0.00 0.00 0.00 0.00 61.98 61.51 1yho s VAL 109 Cb 0.07 -2.68 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 1yho s VAL 109 CO 0.82 0.59 -0.03 -0.67 0.00 0.00 0.00 175.10 175.80 1yho n ASP 110 N 2.12 1.96 -4.20 3.32 2.03 -1.06 -4.40 116.55 116.33 1yho n ASP 110 Ca -0.18 0.01 -0.16 0.00 0.52 0.00 0.00 54.79 54.98 1yho n ASP 110 Cb 0.53 -0.07 -0.11 0.00 -0.72 0.00 0.00 41.12 40.76 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 -2.05 0.90 -0.04 -0.67 -1.94 -1.26 0.52 119.30 114.76 1yho s MET 111 Ca -0.04 -1.17 0.04 0.00 -1.71 0.00 0.00 55.69 52.82 1yho s MET 111 Cb 0.01 -0.69 -0.03 0.00 2.01 0.00 0.00 34.83 36.14 1yho s MET 111 CO 0.06 0.12 -0.15 0.08 -0.01 0.00 0.00 175.02 175.12 1yho s VAL 112 N -2.23 2.99 -0.16 -6.03 1.01 -0.61 -2.17 120.40 113.20 1yho s VAL 112 Ca 0.06 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.26 1yho s VAL 112 Cb -0.04 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.18 1yho s VAL 112 CO 0.01 0.56 -0.18 0.26 0.00 0.00 0.00 175.10 175.76 1yho s TRP 113 N -0.75 2.48 -0.18 5.22 0.52 -0.10 -0.60 118.94 125.52 1yho s TRP 113 Ca 0.12 -1.39 -0.23 0.00 0.02 0.00 0.00 56.10 54.62 1yho s TRP 113 Cb -0.11 -1.75 -0.02 0.00 -1.15 0.00 0.00 33.47 30.45 1yho s TRP 113 CO 0.01 -0.70 0.74 0.42 0.02 0.00 0.00 176.95 177.44 1yho s ILE 114 N 1.26 4.94 -0.04 2.03 1.09 0.22 -0.94 121.20 129.77 1yho s ILE 114 Ca 0.02 1.42 -0.04 0.00 -1.10 0.00 0.00 60.65 60.95 1yho s ILE 114 Cb -0.13 -4.05 -0.01 0.00 -1.06 0.00 0.00 42.46 37.20 1yho s ILE 114 CO -0.10 0.06 -0.09 0.52 -0.10 0.00 0.00 174.94 175.24 1yho n VAL 115 N 4.73 0.42 -3.83 2.92 0.31 -0.62 -2.04 118.33 120.22 1yho n VAL 115 Ca 0.02 0.36 -0.07 0.00 -0.01 0.00 0.00 64.34 64.63 1yho n VAL 115 Cb 0.49 -1.66 0.01 0.00 -0.91 0.00 0.00 33.84 31.77 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 -3.51 0.17 0.00 2.92 0.00 -1.22 -4.67 107.32 101.01 1yho s GLY 116 Ca -0.07 -0.51 0.00 0.00 0.00 0.00 0.00 44.72 44.14 1yho s GLY 116 CO 0.10 0.13 0.00 0.61 0.00 0.00 0.00 173.10 173.95 1yho n GLY 117 N -0.53 1.57 0.26 0.20 0.00 -1.26 0.90 105.19 106.32 1yho n GLY 117 Ca -0.06 -1.75 -0.01 0.00 0.00 0.00 0.00 46.02 44.20 1yho n GLY 117 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1yho h SER 118 N 0.00 0.46 -0.47 1.61 0.02 -1.99 -2.23 113.55 110.95 1yho h SER 118 Ca 0.00 -0.10 0.03 0.00 -0.84 0.00 0.00 61.79 60.88 1yho h SER 118 Cb 0.00 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.38 1yho h SER 118 CO 0.00 0.58 0.26 -1.28 -1.14 0.00 0.00 176.83 175.25 1yho h SER 119 N 0.46 0.41 -0.00 3.07 0.87 -1.99 0.13 113.55 116.49 1yho h SER 119 Ca 0.09 0.01 -0.13 0.00 -1.23 0.00 0.00 61.79 60.53 1yho h SER 119 Cb 0.41 -0.07 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 1yho h SER 119 CO 0.02 0.29 -0.41 0.58 -0.53 0.00 0.00 176.83 176.77 1yho h VAL 120 N 0.52 1.30 -0.57 2.23 2.07 -1.80 -2.50 116.25 117.51 1yho h VAL 120 Ca 0.20 -1.58 -0.10 0.00 0.82 0.00 0.00 66.70 66.03 1yho h VAL 120 Cb 0.06 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 1yho h VAL 120 CO -0.11 0.50 -0.05 0.22 0.02 0.00 0.00 177.57 178.15 1yho h TYR 121 N 0.43 1.14 -0.12 1.57 3.20 -0.79 -1.79 116.97 120.61 1yho h TYR 121 Ca 0.04 -0.21 -0.02 0.00 3.14 0.00 0.00 58.73 61.68 1yho h TYR 121 Cb 0.91 -0.29 -0.00 0.00 1.54 0.00 0.00 36.73 38.88 1yho h TYR 121 CO 0.03 1.03 0.01 -0.22 -1.64 0.00 0.00 178.16 177.38 1yho h LYS 122 N 0.94 0.21 -0.26 1.82 3.64 -0.66 0.21 116.57 122.46 1yho h LYS 122 Ca 0.16 -0.06 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 1yho h LYS 122 Cb 0.61 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.39 1yho h LYS 122 CO 0.04 0.42 0.14 1.49 -2.27 0.00 0.00 179.45 179.27 1yho h GLU 123 N -0.03 0.29 0.00 1.90 4.57 -1.40 -1.94 114.58 117.97 1yho h GLU 123 Ca 0.04 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 58.15 1yho h GLU 123 Cb 0.32 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 1yho h GLU 123 CO 0.00 0.19 -0.24 0.00 -1.18 0.00 0.00 179.01 177.78 1yho h ALA 124 N 1.12 1.22 0.00 2.92 0.00 -1.29 -2.41 119.26 120.83 1yho h ALA 124 Ca 0.10 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1yho h ALA 124 Cb 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1yho h ALA 124 CO -0.06 0.31 0.00 0.52 0.00 0.00 0.00 179.25 180.02 1yho h MET 125 N 0.00 0.00 -0.74 0.00 2.86 -0.13 -1.91 114.93 115.02 1yho h MET 125 Ca -0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 1yho h MET 125 Cb 0.58 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.23 1yho h MET 125 CO 0.03 0.00 0.02 0.09 1.06 0.00 0.00 176.91 178.11 1yho n ASN 126 N -2.36 4.12 -4.66 1.22 4.13 -0.91 -4.90 115.26 111.90 1yho n ASN 126 Ca 0.00 -2.64 -0.40 0.00 1.68 0.00 0.00 54.58 53.22 1yho n ASN 126 Cb 0.14 -0.63 -0.06 0.00 -1.54 0.00 0.00 39.78 37.70 1yho n ASN 126 CO 0.00 0.00 0.00 -1.00 0.28 0.00 0.00 177.26 176.54 1yho s HIS 127 N -2.17 3.39 0.11 3.10 3.76 -0.72 -4.96 115.29 117.80 1yho s HIS 127 Ca 0.36 0.97 -0.06 0.00 -0.15 0.00 0.00 55.06 56.18 1yho s HIS 127 Cb 0.28 -2.82 -0.14 0.00 1.11 0.00 0.00 32.58 31.02 1yho s HIS 127 CO 0.10 -0.16 1.27 -1.00 -0.85 0.00 0.00 174.74 174.10 1yho h PRO 128 N 7.42 0.45 -7.02 8.40 0.13 -1.90 -3.47 132.00 136.01 1yho h PRO 128 Ca -0.32 -0.51 -0.43 0.00 -0.87 0.00 0.00 66.00 63.88 1yho h PRO 128 Cb 1.14 0.15 0.22 0.00 0.13 0.00 0.00 31.00 32.64 1yho h PRO 128 CO 0.78 1.16 -0.21 0.41 -0.23 0.00 0.00 178.00 179.91 1yho n GLY 129 N 1.02 -2.35 3.68 1.56 0.00 -1.26 -4.16 105.19 103.69 1yho n GLY 129 Ca -0.08 -1.19 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 1yho n GLY 129 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1yho s HIS 130 N -2.34 1.96 -0.06 1.61 2.46 -1.26 -4.73 115.29 112.93 1yho s HIS 130 Ca 0.67 -0.09 -0.09 0.00 0.47 0.00 0.00 55.06 56.01 1yho s HIS 130 Cb -0.23 -4.17 0.02 0.00 -0.13 0.00 0.00 32.58 28.07 1yho s HIS 130 CO 0.65 -4.94 0.23 -1.17 -2.47 0.00 0.00 174.74 167.05 1yho s LEU 131 N 3.16 1.14 -0.08 8.88 0.20 -1.26 -4.51 118.68 126.21 1yho s LEU 131 Ca 0.82 0.31 -0.03 0.00 0.69 0.00 0.00 54.13 55.91 1yho s LEU 131 Cb -0.44 0.85 -0.04 0.00 -0.43 0.00 0.00 46.19 46.13 1yho s LEU 131 CO 0.37 -0.18 0.06 -0.54 -0.29 0.00 0.00 176.35 175.77 1yho s LYS 132 N -0.33 3.14 -0.09 1.98 1.02 -0.94 -1.78 119.74 122.75 1yho s LYS 132 Ca -0.04 -0.33 -0.00 0.00 0.02 0.00 0.00 55.97 55.61 1yho s LYS 132 Cb -0.03 -2.93 0.02 0.00 -0.52 0.00 0.00 37.83 34.37 1yho s LYS 132 CO 0.01 0.72 -0.06 -0.51 -0.92 0.00 0.00 175.35 174.59 1yho s LEU 133 N -1.07 1.10 -0.32 3.17 1.43 0.16 0.89 118.68 124.03 1yho s LEU 133 Ca 0.15 -0.23 -0.07 0.00 -1.03 0.00 0.00 54.13 52.96 1yho s LEU 133 Cb -0.12 -0.69 0.02 0.00 0.03 0.00 0.00 46.19 45.43 1yho s LEU 133 CO 0.05 -0.11 0.11 -0.36 0.23 0.00 0.00 176.35 176.26 1yho s PHE 134 N 1.57 3.21 -0.11 0.29 0.40 0.29 0.11 117.98 123.73 1yho s PHE 134 Ca 0.01 -1.18 -0.01 0.00 -0.60 0.00 0.00 56.93 55.15 1yho s PHE 134 Cb -0.13 -2.28 -0.03 0.00 0.51 0.00 0.00 43.02 41.09 1yho s PHE 134 CO -0.05 -0.65 -0.05 0.14 0.70 0.00 0.00 175.22 175.30 1yho s VAL 135 N 1.46 3.78 -0.24 -0.44 -7.23 -0.61 -0.10 120.40 117.02 1yho s VAL 135 Ca 0.01 -0.42 -0.05 0.00 -1.81 0.00 0.00 61.98 59.70 1yho s VAL 135 Cb -0.18 -2.60 -0.01 0.00 0.56 0.00 0.00 36.38 34.15 1yho s VAL 135 CO 0.03 0.55 0.00 -0.89 -0.31 0.00 0.00 175.10 174.48 1yho s THR 136 N -0.23 3.68 -0.26 5.32 2.01 -0.63 -1.25 115.64 124.28 1yho s THR 136 Ca 0.04 -0.47 -0.15 0.00 0.31 0.00 0.00 61.69 61.41 1yho s THR 136 Cb -0.13 -2.74 -0.04 0.00 0.01 0.00 0.00 72.50 69.61 1yho s THR 136 CO 0.02 0.34 0.39 -0.13 -0.69 0.00 0.00 174.62 174.55 1yho s ARG 137 N 1.51 4.03 -0.39 4.92 1.81 -0.68 0.69 118.95 130.84 1yho s ARG 137 Ca 0.05 0.08 -0.14 0.00 -1.72 0.00 0.00 55.73 54.00 1yho s ARG 137 Cb -0.15 -3.65 0.02 0.00 -0.45 0.00 0.00 34.95 30.72 1yho s ARG 137 CO -0.01 -0.27 0.27 0.42 -0.68 0.00 0.00 175.30 175.03 1yho s ILE 138 N 2.05 5.08 -1.10 1.52 -1.09 -0.59 -1.09 121.20 125.98 1yho s ILE 138 Ca 0.16 -0.65 -0.22 0.00 -2.23 0.00 0.00 60.65 57.71 1yho s ILE 138 Cb -0.16 -3.80 0.04 0.00 -1.58 0.00 0.00 42.46 36.96 1yho s ILE 138 CO 0.10 -0.25 1.60 -0.32 -1.23 0.00 0.00 174.94 174.84 1yho s MET 139 N 1.65 3.57 -0.29 2.79 1.75 -0.10 -0.97 119.30 127.70 1yho s MET 139 Ca 0.04 -1.31 -0.16 0.00 -1.25 0.00 0.00 55.69 53.01 1yho s MET 139 Cb -0.19 -5.38 0.15 0.00 2.84 0.00 0.00 34.83 32.25 1yho s MET 139 CO 0.09 -2.41 1.00 -1.14 -0.65 0.00 0.00 175.02 171.91 1yho s GLN 140 N 5.00 0.34 -0.02 4.11 -0.44 -1.26 -4.23 119.66 123.15 1yho s GLN 140 Ca 0.51 0.63 -0.30 0.00 -2.50 0.00 0.00 55.36 53.70 1yho s GLN 140 Cb 0.01 0.13 -0.07 0.00 -1.64 0.00 0.00 33.01 31.43 1yho s GLN 140 CO -0.03 -0.08 1.80 -0.51 0.50 0.00 0.00 175.29 176.97 1yho s ASP 141 N 1.49 6.54 0.11 6.67 1.11 -1.26 -4.48 116.67 126.86 1yho s ASP 141 Ca -0.08 2.40 -0.15 0.00 0.18 0.00 0.00 52.55 54.91 1yho s ASP 141 Cb -0.04 -2.53 0.03 0.00 1.07 0.00 0.00 42.92 41.45 1yho s ASP 141 CO -0.15 -1.01 0.36 -0.36 1.18 0.00 0.00 175.17 175.19 1yho s PHE 142 N 4.33 -0.14 -0.15 4.23 0.08 -1.26 -5.10 117.98 119.96 1yho s PHE 142 Ca 0.80 -0.19 -0.06 0.00 0.12 0.00 0.00 56.93 57.61 1yho s PHE 142 Cb -0.37 0.20 -0.04 0.00 -0.57 0.00 0.00 43.02 42.24 1yho s PHE 142 CO 0.35 -0.66 0.04 -1.21 -0.10 0.00 0.00 175.22 173.64 1yho s GLU 143 N -3.74 3.69 0.15 0.44 2.02 -1.26 -4.85 118.70 115.15 1yho s GLU 143 Ca 0.03 -0.36 0.06 0.00 0.02 0.00 0.00 54.97 54.72 1yho s GLU 143 Cb 0.02 -3.09 -0.04 0.00 0.10 0.00 0.00 34.13 31.12 1yho s GLU 143 CO -0.11 0.41 -0.12 -1.12 0.02 0.00 0.00 175.26 174.33 1yho s SER 144 N -0.02 2.02 -0.26 -0.19 0.01 -1.26 -4.54 113.70 109.46 1yho s SER 144 Ca 0.05 -0.97 -0.08 0.00 1.31 0.00 0.00 55.95 56.27 1yho s SER 144 Cb -0.12 -0.05 -0.15 0.00 0.21 0.00 0.00 66.02 65.90 1yho s SER 144 CO 0.01 -0.25 -0.24 -0.67 0.41 0.00 0.00 173.24 172.51 1yho n ASP 145 N -0.07 1.97 -4.60 2.44 2.03 -1.13 -4.89 116.55 112.30 1yho n ASP 145 Ca -0.11 0.14 -0.39 0.00 0.52 0.00 0.00 54.79 54.95 1yho n ASP 145 Cb 0.60 -0.66 -0.09 0.00 -0.72 0.00 0.00 41.12 40.24 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 -2.51 5.20 0.09 5.18 2.01 -1.18 -5.05 115.64 119.38 1yho s THR 146 Ca -0.36 0.45 -0.15 0.00 0.31 0.00 0.00 61.69 61.95 1yho s THR 146 Cb 0.12 -3.68 -0.06 0.00 0.01 0.00 0.00 72.50 68.88 1yho s THR 146 CO 0.56 0.15 0.50 -0.36 -0.69 0.00 0.00 174.62 174.78 1yho s PHE 147 N 2.01 3.67 -0.13 4.92 0.08 -1.26 -2.53 117.98 124.75 1yho s PHE 147 Ca 0.13 1.05 -0.20 0.00 0.12 0.00 0.00 56.93 58.03 1yho s PHE 147 Cb -0.16 -2.35 -0.04 0.00 -0.57 0.00 0.00 43.02 39.91 1yho s PHE 147 CO 0.10 0.53 0.58 0.12 -0.10 0.00 0.00 175.22 176.45 1yho s PHE 148 N -1.29 3.49 0.62 0.36 2.19 0.51 -4.97 117.98 118.88 1yho s PHE 148 Ca 0.32 0.99 -0.18 0.00 0.33 0.00 0.00 56.93 58.40 1yho s PHE 148 Cb -0.16 -2.69 -0.05 0.00 -1.31 0.00 0.00 43.02 38.81 1yho s PHE 148 CO 0.18 0.05 0.82 -2.30 1.83 0.00 0.00 175.22 175.79 1yho n PRO 149 N 4.09 0.69 -2.73 10.12 -0.02 -1.26 -4.95 135.00 140.94 1yho n PRO 149 Ca -0.04 0.27 -0.38 0.00 -2.02 0.00 0.00 63.50 61.34 1yho n PRO 149 Cb 0.51 -2.03 -0.06 0.00 -0.02 0.00 0.00 33.50 31.90 1yho n PRO 149 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1yho s GLU 150 N -2.69 4.58 -0.17 -0.52 2.02 -1.26 -5.04 118.70 115.63 1yho s GLU 150 Ca 0.74 1.41 -0.15 0.00 0.02 0.00 0.00 54.97 56.98 1yho s GLU 150 Cb -0.41 -2.87 -0.04 0.00 0.10 0.00 0.00 34.13 30.91 1yho s GLU 150 CO 0.50 0.26 0.36 0.42 0.02 0.00 0.00 175.26 176.82 1yho s ILE 151 N -1.52 5.25 0.21 -1.63 1.01 -1.26 -5.07 121.20 118.19 1yho s ILE 151 Ca 0.49 0.67 -0.30 0.00 0.00 0.00 0.00 60.65 61.51 1yho s ILE 151 Cb -0.21 -3.70 -0.08 0.00 0.01 0.00 0.00 42.46 38.48 1yho s ILE 151 CO 0.27 0.33 0.95 -1.81 0.00 0.00 0.00 174.94 174.67 1yho s ASP 152 N 0.71 7.60 0.12 3.58 1.11 -1.26 -4.96 116.67 123.57 1yho s ASP 152 Ca 0.19 1.92 0.06 0.00 0.18 0.00 0.00 52.55 54.90 1yho s ASP 152 Cb -0.14 -2.61 -0.21 0.00 1.07 0.00 0.00 42.92 41.03 1yho s ASP 152 CO 0.06 0.10 1.27 -0.07 1.18 0.00 0.00 175.17 177.71 1yho h LEU 153 N 4.49 0.03 -1.27 1.23 3.38 -1.98 0.16 115.31 121.33 1yho h LEU 153 Ca -0.45 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.42 1yho h LEU 153 Cb 1.20 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.93 1yho h LEU 153 CO 0.69 1.02 -0.32 -0.33 0.09 0.00 0.00 178.44 179.59 1yho h GLU 154 N 0.00 0.07 0.00 1.13 3.07 -2.02 -3.22 114.58 113.62 1yho h GLU 154 Ca -0.02 -0.02 -0.38 0.00 -0.50 0.00 0.00 59.36 58.44 1yho h GLU 154 Cb 1.78 -0.01 -0.07 0.00 -0.84 0.00 0.00 28.75 29.62 1yho h GLU 154 CO 0.13 0.39 -2.43 1.17 -1.40 0.00 0.00 179.01 176.87 1yho n LYS 155 N -4.14 0.67 -4.41 2.33 3.00 -1.23 -4.97 118.16 109.41 1yho n LYS 155 Ca -0.02 0.08 -0.31 0.00 -0.00 0.00 0.00 58.31 58.06 1yho n LYS 155 Cb 0.38 -1.52 -0.11 0.00 0.00 0.00 0.00 35.03 33.78 1yho n LYS 155 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.40 178.11 1yho s TYR 156 N -2.51 2.75 -0.13 5.64 1.51 0.55 -2.09 117.35 123.08 1yho s TYR 156 Ca -0.23 -0.14 -0.06 0.00 -1.01 0.00 0.00 57.07 55.63 1yho s TYR 156 Cb 0.08 -1.50 -0.04 0.00 -0.11 0.00 0.00 41.96 40.39 1yho s TYR 156 CO 0.71 0.37 0.09 0.15 -1.11 0.00 0.00 175.55 175.75 1yho s LYS 157 N -1.75 3.47 -0.38 -0.62 1.02 0.19 -4.02 119.74 117.65 1yho s LYS 157 Ca 0.18 -0.25 -0.25 0.00 0.02 0.00 0.00 55.97 55.67 1yho s LYS 157 Cb -0.11 -3.10 0.01 0.00 -0.52 0.00 0.00 37.83 34.12 1yho s LYS 157 CO 0.10 0.63 0.88 -1.17 -0.92 0.00 0.00 175.35 174.86 1yho s LEU 158 N -0.63 4.04 -0.65 3.17 0.20 -1.26 -1.67 118.68 121.88 1yho s LEU 158 Ca 0.12 0.46 -0.04 0.00 0.69 0.00 0.00 54.13 55.35 1yho s LEU 158 Cb -0.12 -3.18 0.17 0.00 -0.43 0.00 0.00 46.19 42.63 1yho s LEU 158 CO 0.02 -0.84 0.48 -0.76 -0.29 0.00 0.00 176.35 174.97 1yho s LEU 159 N 3.38 5.44 0.07 -0.68 2.01 0.16 -4.93 118.68 124.13 1yho s LEU 159 Ca 0.36 -2.81 -0.18 0.00 0.01 0.00 0.00 54.13 51.51 1yho s LEU 159 Cb -0.12 -1.90 -0.12 0.00 0.01 0.00 0.00 46.19 44.06 1yho s LEU 159 CO 0.19 -0.40 1.37 1.55 1.01 0.00 0.00 176.35 180.07 1yho h PRO 160 N 7.15 0.52 -4.52 1.29 0.13 -1.94 -1.77 132.00 132.87 1yho h PRO 160 Ca -0.00 -0.28 -0.71 0.00 -0.87 0.00 0.00 66.00 64.14 1yho h PRO 160 Cb 0.97 0.01 -0.29 0.00 0.13 0.00 0.00 31.00 31.82 1yho h PRO 160 CO 0.72 0.87 -0.52 -2.00 -0.23 0.00 0.00 178.00 176.84 1yho s GLU 161 N -4.29 2.52 0.05 0.86 2.56 -1.26 -4.75 118.70 114.38 1yho s GLU 161 Ca -0.13 -1.44 0.07 0.00 0.00 0.00 0.00 54.97 53.47 1yho s GLU 161 Cb 0.07 -3.66 -0.03 0.00 2.00 0.00 0.00 34.13 32.51 1yho s GLU 161 CO 0.79 -0.89 -0.16 -0.47 -0.56 0.00 0.00 175.26 173.97 1yho s TYR 162 N 1.37 2.62 -0.02 5.30 6.14 -1.26 -5.10 117.35 126.41 1yho s TYR 162 Ca 0.02 -0.22 -0.30 0.00 0.64 0.00 0.00 57.07 57.22 1yho s TYR 162 Cb -0.22 -1.47 -0.05 0.00 0.42 0.00 0.00 41.96 40.64 1yho s TYR 162 CO 0.01 0.30 1.47 -2.14 0.64 0.00 0.00 175.55 175.83 1yho s PRO 163 N -1.58 4.25 0.00 4.97 0.02 -1.26 -3.19 135.00 138.21 1yho s PRO 163 Ca 0.16 2.03 0.00 0.00 0.02 0.00 0.00 61.00 63.21 1yho s PRO 163 Cb -0.11 -3.68 0.00 0.00 0.02 0.00 0.00 34.50 30.73 1yho s PRO 163 CO 0.07 -0.67 0.00 0.41 -0.33 0.00 0.00 177.00 176.48 1yho n GLY 164 N 3.79 3.11 3.76 0.52 0.00 -1.26 -5.05 105.19 110.06 1yho n GLY 164 Ca 0.14 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.84 3.64 0.08 1.61 0.11 -1.19 -4.97 120.40 118.84 1yho s VAL 165 Ca 0.00 1.58 -0.31 0.00 -2.93 0.00 0.00 61.98 60.32 1yho s VAL 165 Cb 0.00 -3.98 -0.09 0.00 -1.53 0.00 0.00 36.38 30.78 1yho s VAL 165 CO 0.00 0.32 1.76 -0.76 -3.33 0.00 0.00 175.10 173.09 1yho s LEU 166 N -1.60 4.38 0.03 2.54 1.43 -1.26 -4.77 118.68 119.44 1yho s LEU 166 Ca 0.46 2.61 0.05 0.00 -1.03 0.00 0.00 54.13 56.22 1yho s LEU 166 Cb -0.29 -3.56 -0.24 0.00 0.03 0.00 0.00 46.19 42.13 1yho s LEU 166 CO 0.37 -0.95 0.95 0.28 0.23 0.00 0.00 176.35 177.23 1yho h SER 167 N 8.72 0.14 -4.15 2.29 0.02 -1.93 -3.43 113.55 115.21 1yho h SER 167 Ca -0.45 -0.19 -0.51 0.00 -0.84 0.00 0.00 61.79 59.81 1yho h SER 167 Cb 1.21 -0.04 0.09 0.00 0.14 0.00 0.00 62.40 63.80 1yho h SER 167 CO 0.94 1.16 0.40 -0.62 -1.14 0.00 0.00 176.83 177.57 1yho s ASP 168 N -6.62 5.35 0.17 3.07 2.15 -1.26 -4.94 116.67 114.58 1yho s ASP 168 Ca -0.04 2.10 -0.30 0.00 0.43 0.00 0.00 52.55 54.74 1yho s ASP 168 Cb 0.08 -2.57 -0.08 0.00 -0.30 0.00 0.00 42.92 40.06 1yho s ASP 168 CO 0.83 -1.47 1.24 -0.69 -0.17 0.00 0.00 175.17 174.92 1yho s VAL 169 N -2.05 3.51 0.16 1.11 1.01 -1.26 -4.86 120.40 118.01 1yho s VAL 169 Ca 0.70 1.22 -0.08 0.00 0.00 0.00 0.00 61.98 63.82 1yho s VAL 169 Cb -0.23 -3.78 -0.06 0.00 0.00 0.00 0.00 36.38 32.31 1yho s VAL 169 CO 0.35 0.17 0.46 -1.10 0.00 0.00 0.00 175.10 174.98 1yho s GLN 170 N 0.06 3.75 -0.09 2.72 1.11 -0.72 -4.96 119.66 121.52 1yho s GLN 170 Ca 0.55 0.15 -0.04 0.00 0.01 0.00 0.00 55.36 56.04 1yho s GLN 170 Cb -0.34 -2.81 0.05 0.00 -1.01 0.00 0.00 33.01 28.90 1yho s GLN 170 CO 0.36 0.43 0.19 -2.00 0.01 0.00 0.00 175.29 174.28 1yho s GLU 171 N -2.50 0.09 -0.05 2.91 2.12 -1.26 -1.38 118.70 118.63 1yho s GLU 171 Ca 0.41 0.56 -0.02 0.00 0.36 0.00 0.00 54.97 56.29 1yho s GLU 171 Cb -0.12 -0.18 0.04 0.00 0.26 0.00 0.00 34.13 34.12 1yho s GLU 171 CO 0.21 -0.26 0.11 -2.00 -0.54 0.00 0.00 175.26 172.79 1yho s GLU 172 N 1.99 0.06 -1.76 4.30 2.56 -0.62 -4.84 118.70 120.39 1yho s GLU 172 Ca -0.01 0.32 -0.01 0.00 0.00 0.00 0.00 54.97 55.27 1yho s GLU 172 Cb -0.12 -0.19 0.00 0.00 2.00 0.00 0.00 34.13 35.82 1yho s GLU 172 CO -0.07 -0.16 0.11 1.17 -0.56 0.00 0.00 175.26 175.75 1yho n LYS 173 N 4.17 -2.28 -1.09 4.30 3.00 -1.26 -1.13 118.16 123.87 1yho n LYS 173 Ca -0.27 1.00 -0.03 0.00 -0.00 0.00 0.00 58.31 59.02 1yho n LYS 173 Cb 0.51 -5.71 -0.01 0.00 0.00 0.00 0.00 35.03 29.82 1yho n LYS 173 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1yho n GLY 174 N -1.11 0.61 3.21 3.14 0.00 -1.26 -5.02 105.19 104.76 1yho n GLY 174 Ca -0.22 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 44.69 1yho n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yho s ILE 175 N -2.08 2.86 -0.05 -0.61 1.01 -0.29 -5.10 121.20 116.94 1yho s ILE 175 Ca 0.00 -0.93 -0.14 0.00 0.00 0.00 0.00 60.65 59.57 1yho s ILE 175 Cb 0.00 -2.41 -0.05 0.00 0.01 0.00 0.00 42.46 40.01 1yho s ILE 175 CO 0.00 0.27 0.38 -0.54 0.00 0.00 0.00 174.94 175.05 1yho s LYS 176 N 1.34 3.99 0.05 2.79 1.02 -1.26 -1.59 119.74 126.09 1yho s LYS 176 Ca 0.02 0.33 -0.19 0.00 0.02 0.00 0.00 55.97 56.15 1yho s LYS 176 Cb -0.16 -3.28 0.04 0.00 -0.52 0.00 0.00 37.83 33.91 1yho s LYS 176 CO -0.05 0.55 0.43 1.52 -0.92 0.00 0.00 175.35 176.88 1yho s TYR 177 N -0.59 -0.29 0.26 3.18 1.13 -0.48 -0.93 117.35 119.64 1yho s TYR 177 Ca 0.22 0.25 0.12 0.00 -1.41 0.00 0.00 57.07 56.24 1yho s TYR 177 Cb -0.16 0.24 -0.05 0.00 -1.10 0.00 0.00 41.96 40.90 1yho s TYR 177 CO 0.11 -0.59 -0.20 0.15 -2.51 0.00 0.00 175.55 172.50 1yho s LYS 178 N -2.55 1.64 -0.19 -3.49 3.01 -0.25 -1.76 119.74 116.14 1yho s LYS 178 Ca -0.05 -1.73 -0.05 0.00 -1.01 0.00 0.00 55.97 53.14 1yho s LYS 178 Cb -0.01 -1.74 -0.03 0.00 -1.01 0.00 0.00 37.83 35.05 1yho s LYS 178 CO -0.03 0.33 -0.01 -0.06 0.51 0.00 0.00 175.35 176.09 1yho s PHE 179 N -2.43 3.04 0.04 3.18 0.40 -1.26 -1.69 117.98 119.27 1yho s PHE 179 Ca 0.28 -0.41 0.09 0.00 -0.60 0.00 0.00 56.93 56.29 1yho s PHE 179 Cb -0.05 -2.06 -0.03 0.00 0.51 0.00 0.00 43.02 41.39 1yho s PHE 179 CO 0.14 -0.18 -0.25 -1.21 0.70 0.00 0.00 175.22 174.41 1yho s GLU 180 N 0.84 1.84 -0.09 0.44 2.02 -0.38 -4.97 118.70 118.40 1yho s GLU 180 Ca 0.00 -1.09 0.01 0.00 0.02 0.00 0.00 54.97 53.91 1yho s GLU 180 Cb -0.14 -2.01 -0.02 0.00 0.10 0.00 0.00 34.13 32.06 1yho s GLU 180 CO 0.02 0.52 -0.12 0.08 0.02 0.00 0.00 175.26 175.77 1yho s VAL 181 N -0.82 3.19 -0.07 2.63 1.01 -0.67 -1.57 120.40 124.10 1yho s VAL 181 Ca 0.12 -0.64 0.04 0.00 0.00 0.00 0.00 61.98 61.50 1yho s VAL 181 Cb -0.10 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.98 1yho s VAL 181 CO 0.02 0.56 -0.20 -0.31 0.00 0.00 0.00 175.10 175.17 1yho s TYR 182 N -0.19 2.09 0.06 5.22 2.02 0.29 0.39 117.35 127.23 1yho s TYR 182 Ca 0.01 -0.74 0.08 0.00 -0.37 0.00 0.00 57.07 56.04 1yho s TYR 182 Cb -0.13 -1.41 -0.03 0.00 -0.40 0.00 0.00 41.96 39.98 1yho s TYR 182 CO 0.03 -0.29 -0.18 -2.00 -1.57 0.00 0.00 175.55 171.54 1yho s GLU 183 N 0.24 2.00 -0.14 -0.62 2.12 -0.67 0.37 118.70 122.00 1yho s GLU 183 Ca -0.11 -1.03 -0.08 0.00 0.36 0.00 0.00 54.97 54.11 1yho s GLU 183 Cb -0.15 -2.16 -0.04 0.00 0.26 0.00 0.00 34.13 32.03 1yho s GLU 183 CO 0.05 0.53 0.14 0.15 -0.54 0.00 0.00 175.26 175.58 1yho s LYS 184 N -1.60 3.59 -0.19 4.30 1.02 -0.73 0.54 119.74 126.67 1yho s LYS 184 Ca 0.15 -0.15 -0.28 0.00 0.02 0.00 0.00 55.97 55.71 1yho s LYS 184 Cb -0.10 -3.23 -0.00 0.00 -0.52 0.00 0.00 37.83 33.97 1yho s LYS 184 CO 0.06 0.68 0.97 -0.80 -0.92 0.00 0.00 175.35 175.34 1yho s ASN 185 N -0.73 7.07 0.00 2.83 0.01 -0.89 -4.36 114.94 118.87 1yho s ASN 185 Ca 0.13 1.33 0.04 0.00 -0.71 0.00 0.00 52.86 53.65 1yho s ASN 185 Cb -0.12 -2.51 0.21 0.00 0.41 0.00 0.00 41.25 39.24 1yho s ASN 185 CO 0.03 -0.55 0.69 -0.67 -1.51 0.00 0.00 177.10 175.09