#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 0.37 3.44 7.63 0.00 -1.20 -5.01 105.19 110.42 1yho n GLY 2 Ca 0.00 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.86 6.08 -0.32 1.61 0.01 -1.26 -4.99 113.70 111.97 1yho s SER 3 Ca 0.00 -0.97 -0.12 0.00 1.31 0.00 0.00 55.95 56.17 1yho s SER 3 Cb 0.00 -2.15 -0.02 0.00 0.21 0.00 0.00 66.02 64.06 1yho s SER 3 CO 0.00 -0.47 0.21 -0.76 0.41 0.00 0.00 173.24 172.63 1yho s LEU 4 N 1.66 4.33 -0.11 2.44 1.43 -1.26 -1.78 118.68 125.40 1yho s LEU 4 Ca 0.05 -0.35 -0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1yho s LEU 4 Cb -0.20 -2.11 0.02 0.00 0.03 0.00 0.00 46.19 43.94 1yho s LEU 4 CO 0.09 -0.19 -0.09 0.20 0.23 0.00 0.00 176.35 176.60 1yho s ASN 5 N 1.71 2.18 0.12 2.29 0.01 -0.91 -0.58 114.94 119.77 1yho s ASN 5 Ca 0.06 -0.32 0.04 0.00 -0.71 0.00 0.00 52.86 51.94 1yho s ASN 5 Cb -0.17 -0.87 -0.04 0.00 0.41 0.00 0.00 41.25 40.58 1yho s ASN 5 CO 0.10 -0.10 0.08 0.00 -1.51 0.00 0.00 177.10 175.67 1yho s ILE 7 N -1.54 -0.42 0.06 0.00 2.07 -0.94 0.83 121.20 121.25 1yho s ILE 7 Ca 0.29 -0.01 0.02 0.00 -1.41 0.00 0.00 60.65 59.55 1yho s ILE 7 Cb -0.11 -0.66 -0.03 0.00 0.13 0.00 0.00 42.46 41.79 1yho s ILE 7 CO 0.22 -0.10 -0.07 0.68 -1.91 0.00 0.00 174.94 173.75 1yho s VAL 8 N 2.41 0.59 0.11 4.00 -7.23 0.88 -4.69 120.40 116.46 1yho s VAL 8 Ca 0.07 -1.34 0.04 0.00 -1.81 0.00 0.00 61.98 58.94 1yho s VAL 8 Cb -0.15 -0.93 -0.04 0.00 0.56 0.00 0.00 36.38 35.82 1yho s VAL 8 CO -0.12 -0.53 0.11 0.00 -0.31 0.00 0.00 175.10 174.25 1yho s ALA 9 N -2.05 3.59 0.01 1.32 0.00 -1.26 -1.46 121.76 121.91 1yho s ALA 9 Ca -0.03 -1.07 -0.06 0.00 0.00 0.00 0.00 51.96 50.79 1yho s ALA 9 Cb -0.05 -1.43 -0.00 0.00 0.00 0.00 0.00 23.12 21.63 1yho s ALA 9 CO -0.01 0.67 0.12 0.14 0.00 0.00 0.00 175.76 176.67 1yho s VAL 10 N -1.52 0.09 0.69 0.00 -7.23 0.27 -4.73 120.40 107.98 1yho s VAL 10 Ca 0.30 -0.78 -0.08 0.00 -1.81 0.00 0.00 61.98 59.62 1yho s VAL 10 Cb -0.11 -0.50 0.05 0.00 0.56 0.00 0.00 36.38 36.37 1yho s VAL 10 CO 0.23 -0.43 1.02 -0.55 -0.31 0.00 0.00 175.10 175.06 1yho s SER 11 N -1.53 4.99 0.62 4.85 0.15 0.10 -0.36 113.70 122.53 1yho s SER 11 Ca -0.13 0.61 0.36 0.00 0.70 0.00 0.00 55.95 57.49 1yho s SER 11 Cb -0.07 -1.33 2.09 0.00 -1.71 0.00 0.00 66.02 65.00 1yho s SER 11 CO 0.00 -1.51 2.31 -0.61 1.20 0.00 0.00 173.24 174.64 1yho h GLN 12 N -0.58 0.00 -0.79 5.44 4.15 -1.02 -0.22 115.11 122.10 1yho h GLN 12 Ca -0.45 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 58.82 1yho h GLN 12 Cb 1.30 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.90 1yho h GLN 12 CO 0.61 0.00 0.20 -1.71 -1.93 0.00 0.00 178.83 176.00 1yho n ASN 13 N -3.53 4.33 -2.33 -0.69 5.15 -1.26 -4.87 115.26 112.06 1yho n ASN 13 Ca -0.03 -2.94 -0.20 0.00 -0.60 0.00 0.00 54.58 50.81 1yho n ASN 13 Cb 0.08 -0.69 -0.00 0.00 -0.53 0.00 0.00 39.78 38.63 1yho n ASN 13 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 1yho n MET 14 N 0.01 -2.00 -3.70 1.20 2.81 -0.09 -4.92 117.12 110.42 1yho n MET 14 Ca 0.32 0.94 -0.27 0.00 -1.81 0.00 0.00 57.70 56.88 1yho n MET 14 Cb 1.17 -5.56 -0.03 0.00 -0.71 0.00 0.00 33.22 28.08 1yho n MET 14 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1yho s GLY 15 N -2.19 1.74 0.00 3.03 0.00 -1.24 -0.71 107.32 107.95 1yho s GLY 15 Ca 0.04 -0.86 0.00 0.00 0.00 0.00 0.00 44.72 43.90 1yho s GLY 15 CO 0.05 -0.82 0.00 0.29 0.00 0.00 0.00 173.10 172.62 1yho n ILE 16 N -0.74 0.00 0.00 0.90 -5.35 -1.16 0.02 119.36 113.03 1yho n ILE 16 Ca -0.05 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 1yho n ILE 16 Cb 0.54 -0.71 0.00 0.00 -1.74 0.00 0.00 39.64 37.73 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 3.21 1.40 3.57 3.28 0.00 -1.26 -4.35 105.19 111.05 1yho n GLY 17 Ca 0.00 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 1yho n GLY 17 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1yho s LYS 18 N -1.35 3.76 -1.60 1.61 2.20 0.29 -4.07 119.74 120.57 1yho s LYS 18 Ca 0.00 -0.43 0.00 0.00 -0.36 0.00 0.00 55.97 55.18 1yho s LYS 18 Cb 0.00 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.28 1yho s LYS 18 CO 0.00 0.30 0.00 -1.71 -0.36 0.00 0.00 175.35 173.58 1yho n ASN 19 N 3.41 -5.14 0.00 1.43 5.15 -1.26 -1.80 115.26 117.05 1yho n ASN 19 Ca -0.17 0.10 0.00 0.00 -0.60 0.00 0.00 54.58 53.91 1yho n ASN 19 Cb 0.52 -4.21 0.00 0.00 -0.53 0.00 0.00 39.78 35.56 1yho n ASN 19 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1yho n GLY 20 N -0.96 0.41 3.03 8.20 0.00 -1.26 -5.05 105.19 109.56 1yho n GLY 20 Ca -0.20 -1.02 -0.11 0.00 0.00 0.00 0.00 46.02 44.68 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 -2.96 0.61 0.48 1.61 1.11 -0.75 -4.96 116.67 111.81 1yho s ASP 21 Ca 0.00 -0.55 -0.23 0.00 0.18 0.00 0.00 52.55 51.95 1yho s ASP 21 Cb 0.00 0.07 -0.07 0.00 1.07 0.00 0.00 42.92 43.99 1yho s ASP 21 CO 0.00 -0.26 1.25 -0.76 1.18 0.00 0.00 175.17 176.58 1yho s LEU 22 N -1.59 3.99 0.12 1.23 1.43 -1.26 0.11 118.68 122.70 1yho s LEU 22 Ca -0.12 2.50 -0.13 0.00 -1.03 0.00 0.00 54.13 55.36 1yho s LEU 22 Cb -0.09 -4.20 -0.08 0.00 0.03 0.00 0.00 46.19 41.84 1yho s LEU 22 CO -0.00 -1.12 1.42 1.55 0.23 0.00 0.00 176.35 178.43 1yho h PRO 23 N 1.95 0.82 -6.47 1.29 0.13 -1.89 -3.44 132.00 124.38 1yho h PRO 23 Ca -0.50 -0.48 -0.53 0.00 -0.87 0.00 0.00 66.00 63.63 1yho h PRO 23 Cb 1.26 0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.40 1yho h PRO 23 CO 0.60 1.11 0.21 1.67 -0.23 0.00 0.00 178.00 181.35 1yho s TRP 24 N -4.25 3.85 1.14 1.56 -2.14 -1.26 -4.96 118.94 112.89 1yho s TRP 24 Ca -0.11 1.62 -0.18 0.00 2.66 0.00 0.00 56.10 60.09 1yho s TRP 24 Cb 0.10 -2.83 0.18 0.00 -3.10 0.00 0.00 33.47 27.81 1yho s TRP 24 CO 0.87 0.40 0.29 -2.30 -2.66 0.00 0.00 176.95 173.54 1yho n PRO 25 N 2.11 -2.33 -1.70 3.25 -0.02 -1.26 -4.77 135.00 130.28 1yho n PRO 25 Ca -0.03 -0.67 -0.53 0.00 -2.02 0.00 0.00 63.50 60.24 1yho n PRO 25 Cb 0.49 -1.70 -0.06 0.00 -0.02 0.00 0.00 33.50 32.21 1yho n PRO 25 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1yho n PRO 26 N -2.73 1.61 -3.58 0.52 -0.02 -1.26 -4.93 135.00 124.61 1yho n PRO 26 Ca 0.04 0.59 -0.41 0.00 -2.02 0.00 0.00 63.50 61.70 1yho n PRO 26 Cb 0.54 -2.35 -0.09 0.00 -0.02 0.00 0.00 33.50 31.58 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 3.80 5.29 0.47 2.45 2.96 -1.26 -4.94 118.68 127.45 1yho s LEU 27 Ca 0.96 -1.56 0.12 0.00 -0.22 0.00 0.00 54.13 53.42 1yho s LEU 27 Cb -0.90 -2.01 1.07 0.00 0.50 0.00 0.00 46.19 44.84 1yho s LEU 27 CO 0.60 -0.58 2.10 0.03 -1.32 0.00 0.00 176.35 177.18 1yho h ARG 28 N 8.45 0.24 -0.11 1.98 3.08 -1.98 0.25 114.38 126.29 1yho h ARG 28 Ca -0.23 -0.02 -0.16 0.00 0.07 0.00 0.00 59.98 59.64 1yho h ARG 28 Cb 1.08 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 31.09 1yho h ARG 28 CO 0.79 0.17 -0.55 -0.91 -1.07 0.00 0.00 179.97 178.40 1yho h ASN 29 N 0.25 0.67 -0.19 7.04 4.21 -1.97 -2.06 115.58 123.53 1yho h ASN 29 Ca 0.07 -0.64 -0.12 0.00 1.21 0.00 0.00 56.30 56.81 1yho h ASN 29 Cb -0.00 -0.20 0.00 0.00 -1.12 0.00 0.00 38.32 37.00 1yho h ASN 29 CO -0.01 1.21 -0.35 -0.08 -1.29 0.00 0.00 177.43 176.90 1yho h GLU 30 N 0.18 0.58 -0.32 0.81 4.81 -1.85 0.17 114.58 118.97 1yho h GLU 30 Ca -0.04 -0.37 -0.01 0.00 -0.13 0.00 0.00 59.36 58.82 1yho h GLU 30 Cb 1.20 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.61 1yho h GLU 30 CO 0.11 0.98 0.17 0.74 -0.73 0.00 0.00 179.01 180.28 1yho h PHE 31 N 0.25 0.44 -0.27 0.92 -1.00 -0.60 -0.34 116.94 116.34 1yho h PHE 31 Ca 0.01 -0.01 -0.11 0.00 2.81 0.00 0.00 57.97 60.67 1yho h PHE 31 Cb 0.95 -0.14 -0.00 0.00 3.61 0.00 0.00 35.95 40.36 1yho h PHE 31 CO 0.09 0.36 -0.26 0.00 -1.61 0.00 0.00 178.31 176.90 1yho h ARG 32 N 0.39 0.65 -0.29 1.51 3.08 -1.41 -2.38 114.38 115.92 1yho h ARG 32 Ca 0.11 -0.34 -0.01 0.00 0.07 0.00 0.00 59.98 59.82 1yho h ARG 32 Cb 0.08 0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 1yho h ARG 32 CO -0.02 0.94 0.15 -0.92 -1.07 0.00 0.00 179.97 179.06 1yho h TYR 33 N 0.37 0.39 -0.05 3.04 3.20 -0.83 -0.23 116.97 122.86 1yho h TYR 33 Ca 0.04 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.87 1yho h TYR 33 Cb 0.82 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.96 1yho h TYR 33 CO 0.07 0.28 -0.12 0.35 -1.64 0.00 0.00 178.16 177.10 1yho h PHE 34 N 0.40 0.21 0.06 -3.82 3.04 -0.94 -1.71 116.94 114.19 1yho h PHE 34 Ca 0.11 -0.08 -0.00 0.00 3.98 0.00 0.00 57.97 61.97 1yho h PHE 34 Cb 0.03 -0.04 0.00 0.00 2.56 0.00 0.00 35.95 38.50 1yho h PHE 34 CO 0.00 0.73 -0.03 0.37 -2.02 0.00 0.00 178.31 177.36 1yho h GLN 35 N -0.37 -0.08 -0.75 1.11 4.15 -1.12 -1.71 115.11 116.34 1yho h GLN 35 Ca -0.00 0.01 -0.00 0.00 0.77 0.00 0.00 58.65 59.42 1yho h GLN 35 Cb 0.73 0.02 -0.04 0.00 0.21 0.00 0.00 27.48 28.40 1yho h GLN 35 CO 0.03 0.05 0.46 0.07 -1.93 0.00 0.00 178.83 177.50 1yho h ARG 36 N -0.19 1.01 0.39 1.69 -0.00 -1.14 -1.48 114.38 114.66 1yho h ARG 36 Ca -0.01 -0.08 -0.02 0.00 -0.00 0.00 0.00 59.98 59.87 1yho h ARG 36 Cb 0.17 -0.22 0.00 0.00 -0.00 0.00 0.00 29.97 29.92 1yho h ARG 36 CO 0.01 0.70 -0.19 0.52 -0.00 0.00 0.00 179.97 181.01 1yho h MET 37 N 1.03 -0.51 -0.40 0.08 2.86 -1.07 -1.32 114.93 115.60 1yho h MET 37 Ca 0.27 0.03 0.03 0.00 -2.06 0.00 0.00 59.70 57.97 1yho h MET 37 Cb -0.05 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.69 1yho h MET 37 CO -0.05 -0.28 0.20 1.79 1.06 0.00 0.00 176.91 179.63 1yho h THR 38 N -0.64 0.98 -0.08 2.22 1.35 -1.14 -1.63 112.91 113.97 1yho h THR 38 Ca -0.05 -0.14 0.00 0.00 -0.55 0.00 0.00 66.41 65.67 1yho h THR 38 Cb 0.47 0.54 -0.00 0.00 -1.73 0.00 0.00 68.15 67.42 1yho h THR 38 CO 0.09 0.07 0.06 0.71 -0.25 0.00 0.00 175.52 176.20 1yho h THR 39 N 0.41 1.02 -1.07 6.82 1.35 -1.22 -3.38 112.91 116.84 1yho h THR 39 Ca 0.17 -0.04 -0.32 0.00 -0.55 0.00 0.00 66.41 65.67 1yho h THR 39 Cb 0.07 0.90 -0.04 0.00 -1.73 0.00 0.00 68.15 67.36 1yho h THR 39 CO -0.11 0.02 0.87 -0.89 -0.25 0.00 0.00 175.52 175.16 1yho s THR 40 N -5.15 3.34 0.19 6.82 2.01 -0.51 -4.95 115.64 117.39 1yho s THR 40 Ca -0.06 -0.15 -0.03 0.00 0.31 0.00 0.00 61.69 61.77 1yho s THR 40 Cb 0.17 -3.80 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 1yho s THR 40 CO 0.68 -0.76 0.41 -0.55 -0.69 0.00 0.00 174.62 173.71 1yho s SER 41 N 8.67 6.45 -0.06 3.53 0.15 -1.26 -4.98 113.70 126.19 1yho s SER 41 Ca 0.74 0.54 0.02 0.00 0.70 0.00 0.00 55.95 57.95 1yho s SER 41 Cb -0.10 -2.07 -0.25 0.00 -1.71 0.00 0.00 66.02 61.89 1yho s SER 41 CO 0.08 -0.02 0.59 -1.28 1.20 0.00 0.00 173.24 173.81 1yho h SER 42 N 2.35 0.23 -3.52 5.45 0.87 -1.96 -3.45 113.55 113.52 1yho h SER 42 Ca -0.47 -0.47 -0.61 0.00 -1.23 0.00 0.00 61.79 59.01 1yho h SER 42 Cb 1.18 -0.08 -0.12 0.00 -0.44 0.00 0.00 62.40 62.94 1yho h SER 42 CO 0.70 1.42 -0.10 -0.69 -0.53 0.00 0.00 176.83 177.63 1yho s VAL 43 N -2.59 5.13 0.14 2.23 1.01 -1.26 -5.05 120.40 120.02 1yho s VAL 43 Ca -0.12 0.82 -0.30 0.00 0.00 0.00 0.00 61.98 62.38 1yho s VAL 43 Cb 0.07 -3.79 -0.07 0.00 0.00 0.00 0.00 36.38 32.59 1yho s VAL 43 CO 0.81 0.18 1.06 -0.70 0.00 0.00 0.00 175.10 176.44 1yho s GLU 44 N 1.74 4.62 0.00 2.72 2.12 -1.26 -3.13 118.70 125.50 1yho s GLU 44 Ca 0.21 1.63 0.00 0.00 0.36 0.00 0.00 54.97 57.17 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 0.09 0.09 0.00 0.41 -0.54 0.00 0.00 175.26 175.31 1yho n GLY 45 N 2.22 1.71 3.95 -1.50 0.00 -1.26 -5.03 105.19 105.28 1yho n GLY 45 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.42 3.46 -0.03 1.61 3.01 -1.18 -5.11 119.74 121.09 1yho s LYS 46 Ca 0.00 -0.49 0.05 0.00 -1.01 0.00 0.00 55.97 54.52 1yho s LYS 46 Cb 0.00 -2.74 -0.03 0.00 -1.01 0.00 0.00 37.83 34.05 1yho s LYS 46 CO 0.00 0.24 -0.17 -0.65 0.51 0.00 0.00 175.35 175.28 1yho s GLN 47 N -4.20 2.36 -0.12 1.68 -0.21 -1.20 -4.98 119.66 112.99 1yho s GLN 47 Ca 0.38 -0.79 -0.10 0.00 0.02 0.00 0.00 55.36 54.87 1yho s GLN 47 Cb -0.09 -2.29 -0.05 0.00 1.00 0.00 0.00 33.01 31.58 1yho s GLN 47 CO 0.34 0.60 0.21 -0.80 -2.12 0.00 0.00 175.29 173.51 1yho s ASN 48 N -0.86 6.45 -0.20 5.90 0.01 -1.26 -2.51 114.94 122.46 1yho s ASN 48 Ca 0.12 0.53 -0.05 0.00 -0.71 0.00 0.00 52.86 52.75 1yho s ASN 48 Cb -0.10 -2.12 -0.02 0.00 0.41 0.00 0.00 41.25 39.41 1yho s ASN 48 CO 0.01 0.31 -0.01 -0.22 -1.51 0.00 0.00 177.10 175.68 1yho s LEU 49 N -0.60 3.21 -0.11 0.60 0.20 -0.90 -2.07 118.68 119.01 1yho s LEU 49 Ca 0.16 -0.22 -0.03 0.00 0.69 0.00 0.00 54.13 54.73 1yho s LEU 49 Cb -0.13 -1.81 -0.03 0.00 -0.43 0.00 0.00 46.19 43.79 1yho s LEU 49 CO 0.05 0.07 -0.01 0.68 -0.29 0.00 0.00 176.35 176.85 1yho s VAL 50 N 0.97 4.23 -0.13 1.68 -7.23 0.23 -0.67 120.40 119.48 1yho s VAL 50 Ca 0.01 -0.27 -0.02 0.00 -1.81 0.00 0.00 61.98 59.89 1yho s VAL 50 Cb -0.14 -2.80 -0.03 0.00 0.56 0.00 0.00 36.38 33.97 1yho s VAL 50 CO 0.01 0.57 -0.05 -0.63 -0.31 0.00 0.00 175.10 174.69 1yho s ILE 51 N -0.51 3.77 0.12 -0.62 1.01 -0.25 0.10 121.20 124.80 1yho s ILE 51 Ca 0.09 -0.41 0.04 0.00 0.00 0.00 0.00 60.65 60.36 1yho s ILE 51 Cb -0.12 -2.62 -0.04 0.00 0.01 0.00 0.00 42.46 39.69 1yho s ILE 51 CO 0.02 0.52 -0.11 -0.04 0.00 0.00 0.00 174.94 175.34 1yho s MET 52 N 0.09 0.94 0.72 2.79 -1.94 0.70 -1.55 119.30 121.06 1yho s MET 52 Ca -0.01 -1.27 -0.07 0.00 -1.71 0.00 0.00 55.69 52.63 1yho s MET 52 Cb -0.14 -0.61 0.07 0.00 2.01 0.00 0.00 34.83 36.16 1yho s MET 52 CO 0.03 0.09 1.04 0.20 -0.01 0.00 0.00 175.02 176.37 1yho s GLY 53 N -2.69 1.68 0.15 -0.03 0.00 0.94 -2.06 107.32 105.31 1yho s GLY 53 Ca 0.10 -0.92 -0.16 0.00 0.00 0.00 0.00 44.72 43.74 1yho s GLY 53 CO 0.00 -0.49 1.79 1.70 0.00 0.00 0.00 173.10 176.11 1yho h LYS 54 N -0.67 0.54 -0.21 2.90 3.64 -1.91 -0.48 116.57 120.38 1yho h LYS 54 Ca -0.44 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.89 1yho h LYS 54 Cb 1.31 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 1yho h LYS 54 CO 0.60 0.38 0.11 0.87 -2.27 0.00 0.00 179.45 179.14 1yho h LYS 55 N 0.54 0.30 -0.55 1.90 1.57 -1.94 -2.08 116.57 116.32 1yho h LYS 55 Ca 0.15 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1yho h LYS 55 Cb -0.03 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 1yho h LYS 55 CO -0.03 0.30 0.35 1.15 -0.57 0.00 0.00 179.45 180.66 1yho h THR 56 N 0.23 1.12 -0.28 -0.16 2.02 -1.89 0.03 112.91 113.97 1yho h THR 56 Ca 0.07 -0.25 0.03 0.00 0.77 0.00 0.00 66.41 67.04 1yho h THR 56 Cb 0.09 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 66.81 1yho h THR 56 CO -0.01 0.13 0.09 -0.25 0.37 0.00 0.00 175.52 175.85 1yho h TRP 57 N 0.71 0.15 0.00 3.16 2.91 -0.91 -0.81 115.95 121.17 1yho h TRP 57 Ca 0.21 0.01 0.00 0.00 1.13 0.00 0.00 58.89 60.24 1yho h TRP 57 Cb -0.06 -0.03 0.00 0.00 -0.51 0.00 0.00 29.16 28.57 1yho h TRP 57 CO -0.04 0.06 0.00 0.74 -1.03 0.00 0.00 178.44 178.17 1yho h PHE 58 N 0.20 0.00 0.00 2.65 -1.00 -1.10 -2.89 116.94 114.81 1yho h PHE 58 Ca 0.12 0.00 -0.21 0.00 2.81 0.00 0.00 57.97 60.69 1yho h PHE 58 Cb 0.10 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.63 1yho h PHE 58 CO -0.14 0.00 -1.07 1.03 -1.61 0.00 0.00 178.31 176.52 1yho h SER 59 N 0.00 0.00 -3.04 2.17 0.87 0.25 -3.45 113.55 110.35 1yho h SER 59 Ca 0.00 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 60.02 1yho h SER 59 Cb 0.53 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.49 1yho h SER 59 CO 0.00 0.96 0.71 -0.63 -0.53 0.00 0.00 176.83 177.33 1yho s ILE 60 N -2.71 3.83 0.91 2.23 1.01 -0.43 -4.99 121.20 121.03 1yho s ILE 60 Ca 0.00 1.26 -0.13 0.00 0.00 0.00 0.00 60.65 61.79 1yho s ILE 60 Cb 0.10 -3.81 0.04 0.00 0.01 0.00 0.00 42.46 38.80 1yho s ILE 60 CO 0.82 0.05 0.58 -2.65 0.00 0.00 0.00 174.94 173.73 1yho n PRO 61 N 4.63 -0.20 0.11 2.79 -0.02 -1.26 -4.91 135.00 136.14 1yho n PRO 61 Ca 0.11 -0.01 -0.03 0.00 -2.02 0.00 0.00 63.50 61.56 1yho n PRO 61 Cb 0.45 -1.97 0.08 0.00 -0.02 0.00 0.00 33.50 32.04 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 -1.40 0.00 -0.52 -0.52 5.08 -1.94 -3.14 114.58 112.13 1yho h GLU 62 Ca -0.44 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 57.96 1yho h GLU 62 Cb 1.29 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.51 1yho h GLU 62 CO 0.37 0.72 0.35 0.87 -1.00 0.00 0.00 179.01 180.32 1yho h LYS 63 N 0.00 0.57 -0.67 2.33 1.57 -2.01 -1.49 116.57 116.87 1yho h LYS 63 Ca -0.01 -0.03 -0.36 0.00 -1.87 0.00 0.00 60.65 58.38 1yho h LYS 63 Cb 1.30 -0.13 -0.21 0.00 0.08 0.00 0.00 32.23 33.27 1yho h LYS 63 CO 0.09 0.38 0.25 0.09 -0.57 0.00 0.00 179.45 179.69 1yho n ASN 64 N -4.47 3.33 -3.90 0.86 3.02 -1.19 -4.95 115.26 107.96 1yho n ASN 64 Ca 0.06 -3.72 -0.14 0.00 -0.03 0.00 0.00 54.58 50.75 1yho n ASN 64 Cb 0.15 -0.73 -0.14 0.00 -0.61 0.00 0.00 39.78 38.45 1yho n ASN 64 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 1yho s ARG 65 N -3.32 0.22 0.52 3.52 3.52 -0.56 -3.46 118.95 119.39 1yho s ARG 65 Ca 0.51 -0.08 -0.20 0.00 -0.13 0.00 0.00 55.73 55.83 1yho s ARG 65 Cb 0.44 -0.23 -0.06 0.00 -1.56 0.00 0.00 34.95 33.54 1yho s ARG 65 CO 0.04 0.04 1.13 -1.25 -0.81 0.00 0.00 175.30 174.45 1yho s PRO 66 N 0.05 3.47 -0.73 5.12 0.04 -1.26 -4.88 135.00 136.80 1yho s PRO 66 Ca -0.00 1.62 -0.26 0.00 0.04 0.00 0.00 61.00 62.40 1yho s PRO 66 Cb -0.02 -2.09 -0.07 0.00 0.04 0.00 0.00 34.50 32.36 1yho s PRO 66 CO -0.00 -0.76 2.13 -1.17 0.04 0.00 0.00 177.00 177.24 1yho s LEU 67 N -3.63 3.16 0.82 -3.56 1.98 -1.22 -4.94 118.68 111.29 1yho s LEU 67 Ca 0.71 0.06 -0.11 0.00 -2.89 0.00 0.00 54.13 51.89 1yho s LEU 67 Cb -0.24 -2.54 0.09 0.00 0.66 0.00 0.00 46.19 44.16 1yho s LEU 67 CO 0.28 -2.97 1.14 -0.75 -1.89 0.00 0.00 176.35 172.15 1yho s LYS 68 N 7.72 1.75 0.00 1.98 2.20 -1.26 -3.48 119.74 128.64 1yho s LYS 68 Ca 0.80 1.45 0.00 0.00 -0.36 0.00 0.00 55.97 57.86 1yho s LYS 68 Cb -0.11 -1.82 0.00 0.00 -1.51 0.00 0.00 37.83 34.39 1yho s LYS 68 CO 0.11 -2.07 0.00 0.41 -0.36 0.00 0.00 175.35 173.44 1yho n GLY 69 N -0.28 2.80 3.18 5.54 0.00 -1.26 -4.99 105.19 110.18 1yho n GLY 69 Ca 0.11 -0.34 -0.16 0.00 0.00 0.00 0.00 46.02 45.63 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 0.84 -0.35 1.61 1.81 -1.23 -4.82 118.95 116.82 1yho s ARG 70 Ca 0.00 -1.07 -0.29 0.00 -1.72 0.00 0.00 55.73 52.66 1yho s ARG 70 Cb 0.00 -0.68 0.02 0.00 -0.45 0.00 0.00 34.95 33.84 1yho s ARG 70 CO 0.00 0.13 1.08 0.42 -0.68 0.00 0.00 175.30 176.25 1yho s ILE 71 N -1.88 4.46 -0.16 1.52 1.01 -0.88 -4.82 121.20 120.45 1yho s ILE 71 Ca 0.02 1.63 -0.17 0.00 0.00 0.00 0.00 60.65 62.13 1yho s ILE 71 Cb -0.06 -4.44 -0.04 0.00 0.01 0.00 0.00 42.46 37.92 1yho s ILE 71 CO 0.01 -0.57 0.44 0.20 0.00 0.00 0.00 174.94 175.02 1yho s ASN 72 N 1.80 6.57 -0.06 3.58 -0.87 -1.26 0.74 114.94 125.43 1yho s ASN 72 Ca 0.45 0.67 0.06 0.00 -1.57 0.00 0.00 52.86 52.47 1yho s ASN 72 Cb -0.11 -2.26 -0.01 0.00 -0.02 0.00 0.00 41.25 38.84 1yho s ASN 72 CO 0.18 -0.03 -0.23 -0.22 -2.57 0.00 0.00 177.10 174.23 1yho s LEU 73 N 0.93 2.20 -0.17 0.60 0.20 0.11 -1.85 118.68 120.70 1yho s LEU 73 Ca 0.23 -0.45 -0.06 0.00 0.69 0.00 0.00 54.13 54.54 1yho s LEU 73 Cb -0.15 -1.41 -0.03 0.00 -0.43 0.00 0.00 46.19 44.17 1yho s LEU 73 CO 0.09 0.26 0.01 -0.69 -0.29 0.00 0.00 176.35 175.73 1yho s VAL 74 N -0.25 4.31 -0.48 1.68 1.01 -0.90 -0.21 120.40 125.56 1yho s VAL 74 Ca -0.01 -0.20 -0.16 0.00 0.00 0.00 0.00 61.98 61.61 1yho s VAL 74 Cb -0.13 -2.92 0.08 0.00 0.00 0.00 0.00 36.38 33.40 1yho s VAL 74 CO 0.03 0.47 0.42 -0.76 0.00 0.00 0.00 175.10 175.26 1yho s LEU 75 N 0.44 5.65 -0.07 3.92 1.43 -0.88 -2.13 118.68 127.06 1yho s LEU 75 Ca -0.00 -1.36 -0.05 0.00 -1.03 0.00 0.00 54.13 51.69 1yho s LEU 75 Cb -0.13 -2.20 0.03 0.00 0.03 0.00 0.00 46.19 43.91 1yho s LEU 75 CO 0.02 -0.69 0.17 -0.55 0.23 0.00 0.00 176.35 175.53 1yho s SER 76 N 2.72 -0.16 -0.20 2.29 0.15 -0.68 -4.05 113.70 113.77 1yho s SER 76 Ca 0.05 0.34 0.15 0.00 0.70 0.00 0.00 55.95 57.19 1yho s SER 76 Cb -0.25 0.29 -0.23 0.00 -1.71 0.00 0.00 66.02 64.12 1yho s SER 76 CO 0.07 -0.10 0.03 -1.14 1.20 0.00 0.00 173.24 173.29 1yho n ARG 77 N 3.54 0.74 0.03 5.44 0.63 -1.26 -3.94 116.66 121.85 1yho n ARG 77 Ca -0.19 0.01 -0.10 0.00 -0.92 0.00 0.00 57.85 56.66 1yho n ARG 77 Cb 0.56 -1.51 0.03 0.00 0.45 0.00 0.00 32.46 31.99 1yho n ARG 77 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1yho h GLU 78 N 0.00 0.47 -6.56 -0.14 3.07 -1.96 -3.44 114.58 106.02 1yho h GLU 78 Ca -0.54 -0.35 -0.52 0.00 -0.50 0.00 0.00 59.36 57.44 1yho h GLU 78 Cb 2.18 0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 30.12 1yho h GLU 78 CO 0.01 0.98 0.14 -0.51 -1.40 0.00 0.00 179.01 178.23 1yho s LEU 79 N -8.10 4.43 -0.23 1.33 1.43 -1.26 -4.99 118.68 111.28 1yho s LEU 79 Ca -0.06 1.51 -0.06 0.00 -1.03 0.00 0.00 54.13 54.48 1yho s LEU 79 Cb 0.11 -3.49 -0.18 0.00 0.03 0.00 0.00 46.19 42.66 1yho s LEU 79 CO 0.84 0.09 -0.10 0.29 0.23 0.00 0.00 176.35 177.70 1yho n LYS 80 N 1.02 0.65 -3.80 1.70 4.76 -1.26 -4.89 118.16 116.34 1yho n LYS 80 Ca -0.03 0.24 -0.30 0.00 -2.87 0.00 0.00 58.31 55.34 1yho n LYS 80 Cb 0.50 -1.57 -0.04 0.00 -1.84 0.00 0.00 35.03 32.08 1yho n LYS 80 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 1yho s GLU 81 N -2.51 3.52 0.20 1.97 2.56 -1.26 -5.02 118.70 118.16 1yho s GLU 81 Ca -0.33 -0.30 -0.30 0.00 0.00 0.00 0.00 54.97 54.04 1yho s GLU 81 Cb 0.10 -2.94 -0.09 0.00 2.00 0.00 0.00 34.13 33.20 1yho s GLU 81 CO 0.61 0.53 1.30 -1.25 -0.56 0.00 0.00 175.26 175.88 1yho s PRO 82 N -2.71 4.40 0.80 4.30 0.04 -1.26 -4.99 135.00 135.58 1yho s PRO 82 Ca 0.38 2.04 -0.15 0.00 0.04 0.00 0.00 61.00 63.31 1yho s PRO 82 Cb -0.12 -3.19 0.01 0.00 0.04 0.00 0.00 34.50 31.23 1yho s PRO 82 CO 0.27 -0.23 0.68 -2.30 0.04 0.00 0.00 177.00 175.46 1yho n PRO 83 N 2.54 0.15 -1.68 0.56 -0.02 -1.26 -4.82 135.00 130.47 1yho n PRO 83 Ca 0.06 0.10 -0.44 0.00 -2.02 0.00 0.00 63.50 61.20 1yho n PRO 83 Cb 0.43 -2.00 -0.04 0.00 -0.02 0.00 0.00 33.50 31.87 1yho n PRO 83 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1yho n GLN 84 N -1.62 2.61 0.00 -0.52 7.27 -1.26 -1.27 117.38 122.59 1yho n GLN 84 Ca 0.10 0.95 0.00 0.00 0.07 0.00 0.00 57.00 58.12 1yho n GLN 84 Cb 0.51 -2.83 0.00 0.00 2.41 0.00 0.00 30.24 30.33 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 4.23 3.22 3.78 1.69 0.00 -1.26 -4.93 105.19 111.91 1yho n GLY 85 Ca 0.19 0.00 -0.37 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 -2.92 3.09 -0.02 4.61 0.00 -0.39 -4.63 121.76 121.50 1yho s ALA 86 Ca 0.00 0.82 -0.17 0.00 0.00 0.00 0.00 51.96 52.61 1yho s ALA 86 Cb 0.00 -3.32 -0.33 0.00 0.00 0.00 0.00 23.12 19.46 1yho s ALA 86 CO 0.00 -0.39 0.89 0.45 0.00 0.00 0.00 175.76 176.71 1yho h HIS 87 N 2.48 0.77 -3.47 0.00 3.86 -1.68 -3.46 115.15 113.64 1yho h HIS 87 Ca -0.49 -0.56 -0.06 0.00 -1.16 0.00 0.00 60.37 58.10 1yho h HIS 87 Cb 1.23 -0.03 -0.13 0.00 1.06 0.00 0.00 27.41 29.53 1yho h HIS 87 CO 0.56 1.50 -0.15 -0.06 0.86 0.00 0.00 177.93 180.64 1yho s PHE 88 N -2.53 -0.12 0.02 2.45 0.08 -1.23 -5.07 117.98 111.57 1yho s PHE 88 Ca -0.12 -0.21 0.06 0.00 0.12 0.00 0.00 56.93 56.77 1yho s PHE 88 Cb 0.03 0.18 -0.02 0.00 -0.57 0.00 0.00 43.02 42.64 1yho s PHE 88 CO 0.88 -0.65 -0.16 -1.17 -0.10 0.00 0.00 175.22 174.02 1yho s LEU 89 N -2.76 2.12 0.03 -0.37 2.96 -1.26 -2.12 118.68 117.28 1yho s LEU 89 Ca 0.03 -0.42 0.04 0.00 -0.22 0.00 0.00 54.13 53.56 1yho s LEU 89 Cb 0.02 -0.78 -0.02 0.00 0.50 0.00 0.00 46.19 45.92 1yho s LEU 89 CO -0.11 0.12 -0.12 -0.44 -1.32 0.00 0.00 176.35 174.48 1yho s SER 90 N -0.89 1.40 0.06 3.68 0.01 -0.90 -4.99 113.70 112.07 1yho s SER 90 Ca 0.05 -0.39 -0.15 0.00 1.31 0.00 0.00 55.95 56.77 1yho s SER 90 Cb -0.07 -0.09 -0.28 0.00 0.21 0.00 0.00 66.02 65.79 1yho s SER 90 CO 0.01 0.02 1.13 0.03 0.41 0.00 0.00 173.24 174.84 1yho h ARG 91 N 5.14 0.65 -4.34 12.44 3.08 -1.89 -1.80 114.38 127.66 1yho h ARG 91 Ca -0.36 -0.82 -0.17 0.00 0.07 0.00 0.00 59.98 58.70 1yho h ARG 91 Cb 1.18 0.26 -0.15 0.00 0.08 0.00 0.00 29.97 31.35 1yho h ARG 91 CO 0.45 1.37 -0.59 -1.12 -1.07 0.00 0.00 179.97 179.01 1yho s SER 92 N -7.40 0.25 0.25 7.04 0.01 -1.26 -4.10 113.70 108.49 1yho s SER 92 Ca -0.10 -1.16 -0.06 0.00 1.31 0.00 0.00 55.95 55.95 1yho s SER 92 Cb 0.06 0.33 0.27 0.00 0.21 0.00 0.00 66.02 66.89 1yho s SER 92 CO 0.93 -0.76 1.89 -0.07 0.41 0.00 0.00 173.24 175.64 1yho h LEU 93 N 2.80 1.10 -1.17 2.44 3.38 -1.99 -2.05 115.31 119.81 1yho h LEU 93 Ca -0.35 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 1yho h LEU 93 Cb 1.21 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.64 1yho h LEU 93 CO 0.57 0.85 0.41 0.44 0.09 0.00 0.00 178.44 180.80 1yho h ASP 94 N 1.26 0.87 -0.08 -0.43 3.32 -1.99 -0.73 116.42 118.65 1yho h ASP 94 Ca 0.33 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 1yho h ASP 94 Cb -0.04 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.28 1yho h ASP 94 CO -0.06 0.69 -0.02 -0.78 -1.72 0.00 0.00 179.24 177.34 1yho h ASP 95 N 1.00 0.15 -0.45 6.45 3.58 -1.81 -1.53 116.42 123.80 1yho h ASP 95 Ca 0.26 -0.38 -0.01 0.00 0.42 0.00 0.00 57.03 57.32 1yho h ASP 95 Cb -0.01 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 1yho h ASP 95 CO -0.05 0.50 0.26 0.00 -2.88 0.00 0.00 179.24 177.07 1yho h ALA 96 N 0.66 1.55 -0.20 -0.78 0.00 -1.14 -2.06 119.26 117.30 1yho h ALA 96 Ca 0.02 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.69 1yho h ALA 96 Cb 0.43 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1yho h ALA 96 CO 0.01 0.37 -0.55 -0.07 0.00 0.00 0.00 179.25 179.01 1yho h LEU 97 N 0.66 0.66 -0.71 0.00 3.38 -1.04 -2.14 115.31 116.12 1yho h LEU 97 Ca 0.17 -0.35 -0.07 0.00 0.09 0.00 0.00 57.88 57.72 1yho h LEU 97 Cb 0.03 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1yho h LEU 97 CO -0.03 1.07 0.17 0.50 0.09 0.00 0.00 178.44 180.24 1yho h LYS 98 N 0.45 1.14 -0.15 1.13 3.11 -0.62 0.40 116.57 122.05 1yho h LYS 98 Ca 0.01 -0.28 -0.06 0.00 -2.81 0.00 0.00 60.65 57.51 1yho h LYS 98 Cb 1.10 -0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 32.18 1yho h LYS 98 CO 0.11 1.01 -0.13 1.25 -2.81 0.00 0.00 179.45 178.87 1yho h LEU 99 N 1.08 0.37 -1.08 5.20 5.85 -1.35 0.34 115.31 125.72 1yho h LEU 99 Ca 0.22 -0.47 -0.06 0.00 0.84 0.00 0.00 57.88 58.41 1yho h LEU 99 Cb 0.38 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1yho h LEU 99 CO 0.00 0.76 -0.31 0.71 -0.34 0.00 0.00 178.44 179.27 1yho h THR 100 N -0.02 0.78 0.00 1.05 1.35 -1.29 -2.85 112.91 111.92 1yho h THR 100 Ca 0.03 -1.31 -0.04 0.00 -0.55 0.00 0.00 66.41 64.53 1yho h THR 100 Cb 0.65 1.82 -0.01 0.00 -1.73 0.00 0.00 68.15 68.89 1yho h THR 100 CO 0.03 0.30 -0.71 -0.08 -0.25 0.00 0.00 175.52 174.82 1yho h GLU 101 N 0.00 0.00 -7.14 4.72 4.22 -0.10 -3.33 114.58 112.95 1yho h GLU 101 Ca -0.00 0.00 -0.53 0.00 0.08 0.00 0.00 59.36 58.90 1yho h GLU 101 Cb 0.80 0.00 0.13 0.00 0.50 0.00 0.00 28.75 30.18 1yho h GLU 101 CO 0.04 0.12 0.44 -1.14 -2.18 0.00 0.00 179.01 176.29 1yho s GLN 102 N -3.19 2.62 0.43 1.92 0.74 0.10 -4.73 119.66 117.56 1yho s GLN 102 Ca 0.02 1.79 0.19 0.00 0.05 0.00 0.00 55.36 57.41 1yho s GLN 102 Cb 0.08 -1.89 0.99 0.00 1.10 0.00 0.00 33.01 33.29 1yho s GLN 102 CO 0.75 -1.47 1.91 -1.00 -0.55 0.00 0.00 175.29 174.93 1yho h PRO 103 N 0.36 0.00 -0.27 1.67 0.13 -1.90 0.87 132.00 132.86 1yho h PRO 103 Ca -0.49 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.55 1yho h PRO 103 Cb 1.30 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 1yho h PRO 103 CO 0.53 0.26 -0.21 1.49 -0.23 0.00 0.00 178.00 179.85 1yho h GLU 104 N 0.00 0.50 0.00 0.86 4.81 -1.91 -3.14 114.58 115.69 1yho h GLU 104 Ca -0.00 -0.17 -0.25 0.00 -0.13 0.00 0.00 59.36 58.81 1yho h GLU 104 Cb 0.57 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.86 1yho h GLU 104 CO 0.03 0.68 -2.15 -0.11 -0.73 0.00 0.00 179.01 176.74 1yho n LEU 105 N -4.15 0.00 0.15 1.64 7.94 -1.06 -4.36 117.00 117.16 1yho n LEU 105 Ca -0.00 0.00 0.17 0.00 -1.11 0.00 0.00 56.01 55.07 1yho n LEU 105 Cb 0.38 0.34 0.77 0.00 0.53 0.00 0.00 43.42 45.43 1yho n LEU 105 CO 0.42 0.34 1.15 0.00 -1.11 0.00 0.00 177.39 178.18 1yho h ALA 106 N 1.10 2.03 -0.01 1.96 0.00 0.75 0.50 119.26 125.59 1yho h ALA 106 Ca -0.37 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.40 1yho h ALA 106 Cb 1.81 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.61 1yho h ALA 106 CO 0.02 -0.39 -0.60 -0.97 0.00 0.00 0.00 179.25 177.31 1yho h ASN 107 N 0.00 0.05 0.13 0.00 -0.00 -1.74 -3.28 115.58 110.74 1yho h ASN 107 Ca 0.13 -0.03 -0.36 0.00 -0.00 0.00 0.00 56.30 56.04 1yho h ASN 107 Cb 0.63 -0.01 -0.04 0.00 -0.00 0.00 0.00 38.32 38.90 1yho h ASN 107 CO -0.00 0.64 -2.10 0.29 -0.00 0.00 0.00 177.43 176.25 1yho n LYS 108 N -3.84 0.72 -4.36 6.67 5.02 0.31 -4.93 118.16 117.75 1yho n LYS 108 Ca -0.01 0.23 -0.32 0.00 -2.02 0.00 0.00 58.31 56.18 1yho n LYS 108 Cb 0.60 -1.66 -0.10 0.00 -0.02 0.00 0.00 35.03 33.85 1yho n LYS 108 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1yho s VAL 109 N -2.55 3.94 0.03 -0.18 1.01 0.15 -3.22 120.40 119.58 1yho s VAL 109 Ca -0.23 -0.67 -0.00 0.00 0.00 0.00 0.00 61.98 61.08 1yho s VAL 109 Cb 0.07 -2.74 -0.00 0.00 0.00 0.00 0.00 36.38 33.72 1yho s VAL 109 CO 0.74 0.39 -0.00 -0.67 0.00 0.00 0.00 175.10 175.55 1yho n ASP 110 N 1.48 0.41 -4.72 3.32 2.03 -1.05 -4.28 116.55 113.75 1yho n ASP 110 Ca -0.15 0.05 -0.29 0.00 0.52 0.00 0.00 54.79 54.92 1yho n ASP 110 Cb 0.53 -0.13 -0.07 0.00 -0.72 0.00 0.00 41.12 40.72 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 -1.37 2.63 -0.00 -0.67 -1.94 -1.26 -3.23 119.30 113.46 1yho s MET 111 Ca -0.00 -0.87 0.07 0.00 -1.71 0.00 0.00 55.69 53.18 1yho s MET 111 Cb 0.00 -2.55 -0.03 0.00 2.01 0.00 0.00 34.83 34.26 1yho s MET 111 CO 0.00 0.52 -0.21 0.54 -0.01 0.00 0.00 175.02 175.86 1yho s VAL 112 N -1.47 2.51 -0.16 -6.03 0.11 -0.73 -2.12 120.40 112.51 1yho s VAL 112 Ca 0.27 -1.08 0.01 0.00 -2.93 0.00 0.00 61.98 58.26 1yho s VAL 112 Cb -0.11 -1.97 0.02 0.00 -1.53 0.00 0.00 36.38 32.79 1yho s VAL 112 CO 0.20 0.49 -0.19 0.26 -3.33 0.00 0.00 175.10 172.53 1yho s TRP 113 N -0.75 2.61 -0.25 1.54 0.52 0.16 -2.14 118.94 120.62 1yho s TRP 113 Ca 0.12 -1.49 -0.19 0.00 0.02 0.00 0.00 56.10 54.56 1yho s TRP 113 Cb -0.10 -1.82 -0.02 0.00 -1.15 0.00 0.00 33.47 30.38 1yho s TRP 113 CO 0.01 -0.74 0.58 0.42 0.02 0.00 0.00 176.95 177.24 1yho s ILE 114 N 1.25 5.03 -0.05 2.03 1.09 -0.65 -1.09 121.20 128.81 1yho s ILE 114 Ca 0.03 1.03 -0.04 0.00 -1.10 0.00 0.00 60.65 60.56 1yho s ILE 114 Cb -0.13 -3.89 -0.01 0.00 -1.06 0.00 0.00 42.46 37.37 1yho s ILE 114 CO -0.11 0.07 -0.08 0.52 -0.10 0.00 0.00 174.94 175.24 1yho n VAL 115 N 5.10 0.41 -3.87 2.92 0.31 -0.59 -2.22 118.33 120.38 1yho n VAL 115 Ca -0.02 0.41 -0.08 0.00 -0.01 0.00 0.00 64.34 64.63 1yho n VAL 115 Cb 0.49 -1.74 -0.01 0.00 -0.91 0.00 0.00 33.84 31.67 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 -3.32 0.18 0.00 2.92 0.00 -1.24 -4.72 107.32 101.15 1yho s GLY 116 Ca -0.07 -0.56 0.00 0.00 0.00 0.00 0.00 44.72 44.10 1yho s GLY 116 CO 0.10 -0.25 0.00 0.61 0.00 0.00 0.00 173.10 173.56 1yho n GLY 117 N -0.48 2.62 0.26 0.20 0.00 -1.26 -0.04 105.19 106.49 1yho n GLY 117 Ca -0.05 -1.82 -0.00 0.00 0.00 0.00 0.00 46.02 44.15 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 0.44 -0.56 1.61 0.02 -1.99 -2.29 113.55 110.78 1yho h SER 118 Ca 0.00 -0.10 0.04 0.00 -0.84 0.00 0.00 61.79 60.89 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 0.56 0.32 0.28 -1.14 0.00 0.00 176.83 176.85 1yho h SER 119 N 0.43 0.50 -0.07 3.07 0.02 -1.99 0.20 113.55 115.70 1yho h SER 119 Ca 0.09 0.01 -0.15 0.00 -0.84 0.00 0.00 61.79 60.90 1yho h SER 119 Cb 0.40 -0.09 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1yho h SER 119 CO 0.02 0.34 -0.46 0.58 -1.14 0.00 0.00 176.83 176.17 1yho h VAL 120 N 0.62 1.30 -0.49 2.27 2.07 -1.80 -2.48 116.25 117.75 1yho h VAL 120 Ca 0.24 -1.66 -0.08 0.00 0.82 0.00 0.00 66.70 66.01 1yho h VAL 120 Cb 0.08 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.45 1yho h VAL 120 CO -0.13 0.53 -0.02 0.22 0.02 0.00 0.00 177.57 178.19 1yho h TYR 121 N 0.50 0.96 0.05 1.57 5.03 -0.84 -1.25 116.97 122.98 1yho h TYR 121 Ca 0.03 -0.17 -0.00 0.00 2.58 0.00 0.00 58.73 61.16 1yho h TYR 121 Cb 1.00 -0.25 0.00 0.00 1.55 0.00 0.00 36.73 39.03 1yho h TYR 121 CO 0.04 0.91 -0.02 -0.22 -1.32 0.00 0.00 178.16 177.55 1yho h LYS 122 N 0.73 -0.06 -0.82 1.82 3.64 -0.59 0.74 116.57 122.04 1yho h LYS 122 Ca 0.13 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1yho h LYS 122 Cb 0.54 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 32.34 1yho h LYS 122 CO 0.03 0.13 0.54 0.93 -2.27 0.00 0.00 179.45 178.81 1yho h GLU 123 N -0.24 1.08 -0.01 1.90 5.08 -1.43 -2.04 114.58 118.93 1yho h GLU 123 Ca -0.01 -0.07 -0.10 0.00 -1.00 0.00 0.00 59.36 58.18 1yho h GLU 123 Cb 0.22 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 1yho h GLU 123 CO 0.01 0.72 -0.47 0.00 -1.00 0.00 0.00 179.01 178.27 1yho h ALA 124 N 1.30 1.19 -0.00 3.43 0.00 -1.11 -2.75 119.26 121.33 1yho h ALA 124 Ca 0.30 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1yho h ALA 124 Cb -0.12 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1yho h ALA 124 CO -0.06 0.60 0.01 0.52 0.00 0.00 0.00 179.25 180.31 1yho h MET 125 N 0.02 0.00 -0.73 0.00 2.86 -0.08 -0.12 114.93 116.88 1yho h MET 125 Ca -0.00 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 1yho h MET 125 Cb 0.85 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.48 1yho h MET 125 CO 0.06 0.00 0.06 -1.71 1.06 0.00 0.00 176.91 176.38 1yho n ASN 126 N -3.34 4.40 -4.74 1.22 2.85 -1.03 -4.94 115.26 109.67 1yho n ASN 126 Ca -0.03 -2.75 -0.41 0.00 -0.11 0.00 0.00 54.58 51.28 1yho n ASN 126 Cb 0.08 -0.65 -0.05 0.00 1.24 0.00 0.00 39.78 40.40 1yho n ASN 126 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 1yho s HIS 127 N -2.32 3.85 0.08 1.20 3.76 -0.06 -4.97 115.29 116.82 1yho s HIS 127 Ca 0.41 1.82 -0.11 0.00 -0.15 0.00 0.00 55.06 57.03 1yho s HIS 127 Cb 0.31 -3.06 -0.24 0.00 1.11 0.00 0.00 32.58 30.70 1yho s HIS 127 CO 0.11 0.18 1.16 -1.00 -0.85 0.00 0.00 174.74 174.34 1yho h PRO 128 N 4.83 0.53 -7.39 8.40 0.13 -1.92 -3.46 132.00 133.12 1yho h PRO 128 Ca -0.44 -0.68 -0.47 0.00 -0.87 0.00 0.00 66.00 63.53 1yho h PRO 128 Cb 1.21 0.22 0.14 0.00 0.13 0.00 0.00 31.00 32.70 1yho h PRO 128 CO 0.70 1.29 0.26 0.20 -0.23 0.00 0.00 178.00 180.22 1yho s GLY 129 N -4.46 1.60 0.35 1.56 0.00 -1.26 -4.80 107.32 100.32 1yho s GLY 129 Ca -0.08 -0.26 -0.29 0.00 0.00 0.00 0.00 44.72 44.09 1yho s GLY 129 CO 0.91 0.26 1.50 0.30 0.00 0.00 0.00 173.10 176.06 1yho s HIS 130 N -3.06 2.66 -0.09 1.90 3.76 -1.26 -4.96 115.29 114.24 1yho s HIS 130 Ca 0.63 1.10 -0.09 0.00 -0.15 0.00 0.00 55.06 56.55 1yho s HIS 130 Cb -0.17 -4.01 0.02 0.00 1.11 0.00 0.00 32.58 29.54 1yho s HIS 130 CO 0.56 -3.04 0.25 -1.17 -0.85 0.00 0.00 174.74 170.48 1yho s LEU 131 N -1.69 1.07 -0.17 0.89 2.96 -1.26 -4.54 118.68 115.94 1yho s LEU 131 Ca 0.55 0.46 -0.08 0.00 -0.22 0.00 0.00 54.13 54.83 1yho s LEU 131 Cb -0.46 0.85 -0.05 0.00 0.50 0.00 0.00 46.19 47.04 1yho s LEU 131 CO 0.59 -0.11 0.11 -0.54 -1.32 0.00 0.00 176.35 175.08 1yho s LYS 132 N 0.03 3.94 -0.15 1.98 1.02 0.25 -1.64 119.74 125.16 1yho s LYS 132 Ca -0.01 -0.24 0.01 0.00 0.02 0.00 0.00 55.97 55.75 1yho s LYS 132 Cb -0.02 -3.30 0.02 0.00 -0.52 0.00 0.00 37.83 34.01 1yho s LYS 132 CO 0.01 0.41 -0.16 -0.51 -0.92 0.00 0.00 175.35 174.17 1yho s LEU 133 N 0.03 1.81 -0.33 3.17 1.43 0.20 0.48 118.68 125.47 1yho s LEU 133 Ca 0.08 -0.53 -0.07 0.00 -1.03 0.00 0.00 54.13 52.58 1yho s LEU 133 Cb -0.12 -1.26 0.03 0.00 0.03 0.00 0.00 46.19 44.87 1yho s LEU 133 CO -0.00 -0.04 0.11 -0.36 0.23 0.00 0.00 176.35 176.30 1yho s PHE 134 N 1.40 3.21 -0.08 0.29 0.40 0.24 0.82 117.98 124.27 1yho s PHE 134 Ca 0.04 -1.17 0.01 0.00 -0.60 0.00 0.00 56.93 55.21 1yho s PHE 134 Cb -0.13 -2.30 -0.03 0.00 0.51 0.00 0.00 43.02 41.08 1yho s PHE 134 CO -0.11 -0.66 -0.08 0.14 0.70 0.00 0.00 175.22 175.21 1yho s VAL 135 N 1.47 3.55 -0.18 -0.44 -7.23 -0.54 -0.09 120.40 116.94 1yho s VAL 135 Ca 0.01 -0.53 -0.01 0.00 -1.81 0.00 0.00 61.98 59.64 1yho s VAL 135 Cb -0.19 -2.45 -0.00 0.00 0.56 0.00 0.00 36.38 34.30 1yho s VAL 135 CO 0.03 0.58 -0.12 -0.89 -0.31 0.00 0.00 175.10 174.39 1yho s THR 136 N -0.62 2.83 -0.25 5.32 2.01 -0.54 -1.34 115.64 123.06 1yho s THR 136 Ca 0.09 -0.70 -0.14 0.00 0.31 0.00 0.00 61.69 61.25 1yho s THR 136 Cb -0.11 -2.23 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 1yho s THR 136 CO 0.02 0.49 0.35 -0.13 -0.69 0.00 0.00 174.62 174.66 1yho s ARG 137 N 1.05 4.05 -0.38 4.92 3.00 -0.65 0.93 118.95 131.87 1yho s ARG 137 Ca -0.01 0.03 -0.13 0.00 0.00 0.00 0.00 55.73 55.62 1yho s ARG 137 Cb -0.15 -3.62 0.01 0.00 0.00 0.00 0.00 34.95 31.20 1yho s ARG 137 CO -0.03 -0.19 0.26 0.42 0.00 0.00 0.00 175.30 175.77 1yho s ILE 138 N 1.78 5.06 -1.16 1.52 -1.09 0.51 -0.66 121.20 127.16 1yho s ILE 138 Ca 0.15 -0.62 -0.21 0.00 -2.23 0.00 0.00 60.65 57.74 1yho s ILE 138 Cb -0.15 -3.77 0.03 0.00 -1.58 0.00 0.00 42.46 36.99 1yho s ILE 138 CO 0.09 -0.22 1.70 -0.32 -1.23 0.00 0.00 174.94 174.95 1yho s MET 139 N 1.65 3.54 -0.29 2.79 1.75 0.22 -0.57 119.30 128.39 1yho s MET 139 Ca 0.04 -1.47 -0.17 0.00 -1.25 0.00 0.00 55.69 52.84 1yho s MET 139 Cb -0.19 -5.40 0.16 0.00 2.84 0.00 0.00 34.83 32.24 1yho s MET 139 CO 0.09 -2.58 1.05 -0.65 -0.65 0.00 0.00 175.02 172.28 1yho s GLN 140 N 5.01 0.31 0.17 4.11 -1.52 -1.26 -3.96 119.66 122.51 1yho s GLN 140 Ca 0.55 0.52 -0.32 0.00 -1.95 0.00 0.00 55.36 54.16 1yho s GLN 140 Cb 0.01 0.08 -0.10 0.00 -0.22 0.00 0.00 33.01 32.78 1yho s GLN 140 CO 0.02 -0.06 1.59 0.34 -0.25 0.00 0.00 175.29 176.93 1yho s ASP 141 N 1.13 6.57 0.04 5.90 2.15 -1.26 -4.27 116.67 126.92 1yho s ASP 141 Ca -0.07 2.64 -0.17 0.00 0.43 0.00 0.00 52.55 55.38 1yho s ASP 141 Cb -0.04 -2.59 0.03 0.00 -0.30 0.00 0.00 42.92 40.02 1yho s ASP 141 CO -0.13 -0.84 0.37 -0.36 -0.17 0.00 0.00 175.17 174.04 1yho s PHE 142 N 1.21 -0.21 -0.27 -5.34 0.08 -1.26 -5.08 117.98 107.11 1yho s PHE 142 Ca 0.71 0.16 -0.13 0.00 0.12 0.00 0.00 56.93 57.78 1yho s PHE 142 Cb -0.44 0.17 -0.04 0.00 -0.57 0.00 0.00 43.02 42.14 1yho s PHE 142 CO 0.31 -0.53 0.31 -2.00 -0.10 0.00 0.00 175.22 173.20 1yho s GLU 143 N -2.39 3.99 0.15 0.44 2.12 -1.26 -4.90 118.70 116.86 1yho s GLU 143 Ca -0.06 -0.09 0.05 0.00 0.36 0.00 0.00 54.97 55.23 1yho s GLU 143 Cb -0.01 -3.66 -0.04 0.00 0.26 0.00 0.00 34.13 30.68 1yho s GLU 143 CO -0.02 -0.24 -0.12 -1.12 -0.54 0.00 0.00 175.26 173.22 1yho s SER 144 N 1.68 1.99 -0.13 -1.70 0.01 -1.26 -4.65 113.70 109.64 1yho s SER 144 Ca 0.12 -0.96 0.08 0.00 1.31 0.00 0.00 55.95 56.50 1yho s SER 144 Cb -0.16 -0.05 -0.14 0.00 0.21 0.00 0.00 66.02 65.88 1yho s SER 144 CO 0.10 -0.25 -0.01 -0.67 0.41 0.00 0.00 173.24 172.82 1yho n ASP 145 N -0.06 2.13 -4.47 2.44 2.03 -1.26 -4.94 116.55 112.42 1yho n ASP 145 Ca -0.11 -0.02 -0.36 0.00 0.52 0.00 0.00 54.79 54.82 1yho n ASP 145 Cb 0.60 0.51 -0.12 0.00 -0.72 0.00 0.00 41.12 41.39 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 -2.31 4.34 0.07 5.18 2.01 -1.26 -5.10 115.64 118.58 1yho s THR 146 Ca -0.11 -0.17 -0.02 0.00 0.31 0.00 0.00 61.69 61.70 1yho s THR 146 Cb 0.04 -3.01 -0.05 0.00 0.01 0.00 0.00 72.50 69.50 1yho s THR 146 CO 0.48 0.37 0.26 -0.36 -0.69 0.00 0.00 174.62 174.67 1yho s PHE 147 N 1.36 3.52 -0.25 4.92 0.08 -1.26 -2.97 117.98 123.38 1yho s PHE 147 Ca 0.05 0.38 -0.21 0.00 0.12 0.00 0.00 56.93 57.27 1yho s PHE 147 Cb -0.15 -1.86 -0.02 0.00 -0.57 0.00 0.00 43.02 40.42 1yho s PHE 147 CO 0.03 0.55 0.66 0.12 -0.10 0.00 0.00 175.22 176.48 1yho s PHE 148 N -1.51 3.30 0.60 0.36 5.36 0.11 -4.97 117.98 121.23 1yho s PHE 148 Ca 0.35 0.87 -0.18 0.00 -0.96 0.00 0.00 56.93 57.01 1yho s PHE 148 Cb -0.13 -2.86 -0.06 0.00 -0.34 0.00 0.00 43.02 39.63 1yho s PHE 148 CO 0.25 -0.32 0.82 -2.30 -1.46 0.00 0.00 175.22 172.21 1yho n PRO 149 N 5.68 0.73 -2.43 10.12 -0.02 -1.26 -4.91 135.00 142.91 1yho n PRO 149 Ca 0.00 0.29 -0.42 0.00 -2.02 0.00 0.00 63.50 61.35 1yho n PRO 149 Cb 0.49 -2.02 -0.03 0.00 -0.02 0.00 0.00 33.50 31.92 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 -2.59 4.35 0.06 -0.52 2.02 -1.26 -5.00 118.70 115.76 1yho s GLU 150 Ca 0.74 1.71 -0.30 0.00 0.02 0.00 0.00 54.97 57.13 1yho s GLU 150 Cb -0.42 -3.55 -0.05 0.00 0.10 0.00 0.00 34.13 30.22 1yho s GLU 150 CO 0.49 -0.45 1.06 0.42 0.02 0.00 0.00 175.26 176.80 1yho s ILE 151 N 2.17 4.42 -0.14 -1.63 1.01 -1.26 -4.97 121.20 120.80 1yho s ILE 151 Ca 0.57 1.81 -0.29 0.00 0.00 0.00 0.00 60.65 62.74 1yho s ILE 151 Cb -0.26 -4.16 -0.05 0.00 0.01 0.00 0.00 42.46 38.00 1yho s ILE 151 CO 0.23 0.18 1.89 -1.81 0.00 0.00 0.00 174.94 175.44 1yho s ASP 152 N 0.73 6.13 0.42 3.58 1.11 -1.26 -4.85 116.67 122.53 1yho s ASP 152 Ca 0.53 2.02 0.23 0.00 0.18 0.00 0.00 52.55 55.50 1yho s ASP 152 Cb -0.25 -2.53 0.72 0.00 1.07 0.00 0.00 42.92 41.93 1yho s ASP 152 CO 0.30 -1.40 1.74 0.25 1.18 0.00 0.00 175.17 177.23 1yho h LEU 153 N 12.34 0.00 -1.37 1.23 7.12 -1.94 0.19 115.31 132.89 1yho h LEU 153 Ca -0.41 0.00 -0.06 0.00 0.13 0.00 0.00 57.88 57.54 1yho h LEU 153 Cb 1.20 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 41.32 1yho h LEU 153 CO 0.97 0.24 -0.26 -0.33 -0.13 0.00 0.00 178.44 178.93 1yho h GLU 154 N 0.00 0.08 0.00 1.25 5.08 -2.02 -3.19 114.58 115.78 1yho h GLU 154 Ca -0.00 -0.02 -0.32 0.00 -1.00 0.00 0.00 59.36 58.02 1yho h GLU 154 Cb 0.89 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.07 1yho h GLU 154 CO 0.03 0.34 -2.19 1.63 -1.00 0.00 0.00 179.01 177.82 1yho n LYS 155 N -4.20 1.13 -4.03 2.33 5.02 -1.15 -4.96 118.16 112.29 1yho n LYS 155 Ca -0.02 0.00 -0.35 0.00 -2.02 0.00 0.00 58.31 55.93 1yho n LYS 155 Cb 0.33 -1.44 -0.07 0.00 -0.02 0.00 0.00 35.03 33.83 1yho n LYS 155 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1yho s TYR 156 N -2.42 3.44 -0.21 2.13 1.51 0.05 -2.21 117.35 119.64 1yho s TYR 156 Ca -0.11 0.37 -0.09 0.00 -1.01 0.00 0.00 57.07 56.24 1yho s TYR 156 Cb 0.05 -1.85 -0.05 0.00 -0.11 0.00 0.00 41.96 40.00 1yho s TYR 156 CO 0.69 0.63 0.11 0.21 -1.11 0.00 0.00 175.55 176.08 1yho s LYS 157 N -1.27 4.04 -0.28 -0.62 2.47 0.14 -4.38 119.74 119.83 1yho s LYS 157 Ca 0.18 -0.30 -0.28 0.00 -1.56 0.00 0.00 55.97 54.01 1yho s LYS 157 Cb -0.12 -3.38 0.01 0.00 -1.46 0.00 0.00 37.83 32.88 1yho s LYS 157 CO 0.08 0.18 1.01 -1.17 0.16 0.00 0.00 175.35 175.61 1yho s LEU 158 N 0.67 4.03 -0.53 5.43 0.20 -1.26 -1.87 118.68 125.35 1yho s LEU 158 Ca 0.06 1.14 0.01 0.00 0.69 0.00 0.00 54.13 56.04 1yho s LEU 158 Cb -0.13 -3.47 0.14 0.00 -0.43 0.00 0.00 46.19 42.30 1yho s LEU 158 CO 0.01 -0.74 0.29 -0.76 -0.29 0.00 0.00 176.35 174.87 1yho s LEU 159 N 3.33 4.73 0.23 -0.68 1.02 0.15 -4.95 118.68 122.52 1yho s LEU 159 Ca 0.43 -2.81 -0.02 0.00 0.02 0.00 0.00 54.13 51.75 1yho s LEU 159 Cb -0.14 -1.72 0.24 0.00 0.02 0.00 0.00 46.19 44.59 1yho s LEU 159 CO 0.11 -0.31 1.63 1.55 0.02 0.00 0.00 176.35 179.35 1yho h PRO 160 N 6.89 0.64 -4.64 1.29 0.13 -1.91 -1.71 132.00 132.69 1yho h PRO 160 Ca -0.06 -0.28 -0.68 0.00 -0.87 0.00 0.00 66.00 64.11 1yho h PRO 160 Cb 0.93 -0.02 -0.35 0.00 0.13 0.00 0.00 31.00 31.70 1yho h PRO 160 CO 0.68 0.86 -0.64 -1.21 -0.23 0.00 0.00 178.00 177.46 1yho s GLU 161 N -4.46 2.12 -0.02 0.86 0.41 -1.26 -4.74 118.70 111.61 1yho s GLU 161 Ca -0.08 -1.58 0.06 0.00 -0.41 0.00 0.00 54.97 52.96 1yho s GLU 161 Cb 0.13 -3.35 -0.01 0.00 -1.78 0.00 0.00 34.13 29.11 1yho s GLU 161 CO 0.82 -0.85 -0.21 -0.47 -0.49 0.00 0.00 175.26 174.06 1yho s TYR 162 N 1.16 1.91 0.34 1.61 5.04 -1.26 -5.09 117.35 121.06 1yho s TYR 162 Ca 0.03 -0.40 -0.28 0.00 -2.44 0.00 0.00 57.07 53.97 1yho s TYR 162 Cb -0.21 -1.24 -0.10 0.00 0.35 0.00 0.00 41.96 40.76 1yho s TYR 162 CO -0.03 -0.07 1.30 -1.25 -1.34 0.00 0.00 175.55 174.16 1yho s PRO 163 N -0.40 4.30 0.00 4.97 0.04 -1.26 -3.05 135.00 139.60 1yho s PRO 163 Ca 0.06 2.19 0.00 0.00 0.04 0.00 0.00 61.00 63.28 1yho s PRO 163 Cb -0.09 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.43 1yho s PRO 163 CO -0.00 -0.22 0.00 0.41 0.04 0.00 0.00 177.00 177.22 1yho n GLY 164 N 0.78 2.79 3.59 0.56 0.00 -1.26 -5.00 105.19 106.65 1yho n GLY 164 Ca 0.01 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.60 4.24 0.37 1.61 0.11 -1.17 -5.08 120.40 118.88 1yho s VAL 165 Ca 0.00 -0.25 -0.28 0.00 -2.93 0.00 0.00 61.98 58.52 1yho s VAL 165 Cb 0.00 -2.85 -0.11 0.00 -1.53 0.00 0.00 36.38 31.89 1yho s VAL 165 CO 0.00 0.52 1.50 0.18 -3.33 0.00 0.00 175.10 173.97 1yho n LEU 166 N 3.05 4.74 -0.05 2.54 4.77 -1.26 -4.55 117.00 126.23 1yho n LEU 166 Ca -0.18 1.22 -0.04 0.00 -0.03 0.00 0.00 56.01 56.98 1yho n LEU 166 Cb 0.53 -1.62 -0.10 0.00 -2.33 0.00 0.00 43.42 39.90 1yho n LEU 166 CO 0.32 0.16 -0.88 -1.54 -1.33 0.00 0.00 177.39 174.11 1yho n SER 167 N 0.63 1.78 -4.75 -1.43 3.41 -1.26 -4.52 113.62 107.48 1yho n SER 167 Ca 0.02 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.26 1yho n SER 167 Cb 0.39 0.96 0.04 0.00 -0.26 0.00 0.00 64.21 65.33 1yho n SER 167 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1yho s ASP 168 N -4.44 5.08 0.11 4.04 -1.08 -1.26 -4.60 116.67 114.52 1yho s ASP 168 Ca -0.06 2.49 -0.31 0.00 -0.52 0.00 0.00 52.55 54.15 1yho s ASP 168 Cb 0.05 -2.61 -0.08 0.00 -1.46 0.00 0.00 42.92 38.81 1yho s ASP 168 CO 0.54 -1.68 1.49 -0.69 0.52 0.00 0.00 175.17 175.35 1yho s VAL 169 N -1.50 3.08 0.43 1.11 1.01 -1.26 -4.72 120.40 118.54 1yho s VAL 169 Ca 0.78 0.72 0.04 0.00 0.00 0.00 0.00 61.98 63.52 1yho s VAL 169 Cb -0.33 -3.46 0.01 0.00 0.00 0.00 0.00 36.38 32.59 1yho s VAL 169 CO 0.36 0.04 0.61 -1.10 0.00 0.00 0.00 175.10 175.01 1yho s GLN 170 N 1.47 2.92 -0.14 2.72 -1.52 -0.01 -4.93 119.66 120.16 1yho s GLN 170 Ca 0.68 -0.88 -0.06 0.00 -1.95 0.00 0.00 55.36 53.14 1yho s GLN 170 Cb -0.39 -2.67 0.06 0.00 -0.22 0.00 0.00 33.01 29.79 1yho s GLN 170 CO 0.30 -0.26 0.32 -2.00 -0.25 0.00 0.00 175.29 173.40 1yho s GLU 171 N -4.43 0.24 -0.05 2.91 2.12 -1.26 -1.91 118.70 116.32 1yho s GLU 171 Ca 0.51 0.76 -0.02 0.00 0.36 0.00 0.00 54.97 56.58 1yho s GLU 171 Cb -0.10 0.02 0.04 0.00 0.26 0.00 0.00 34.13 34.35 1yho s GLU 171 CO 0.35 -0.22 0.10 -2.00 -0.54 0.00 0.00 175.26 172.94 1yho s GLU 172 N 1.97 0.01 -1.72 4.30 -6.30 -0.49 -4.84 118.70 111.64 1yho s GLU 172 Ca -0.04 0.35 -0.01 0.00 -2.50 0.00 0.00 54.97 52.77 1yho s GLU 172 Cb -0.11 -0.28 0.00 0.00 0.00 0.00 0.00 34.13 33.74 1yho s GLU 172 CO -0.10 -0.22 0.07 1.63 0.02 0.00 0.00 175.26 176.65 1yho n LYS 173 N 4.61 -2.06 -1.03 4.30 4.76 -1.26 -1.03 118.16 126.44 1yho n LYS 173 Ca -0.19 0.97 -0.01 0.00 -2.87 0.00 0.00 58.31 56.22 1yho n LYS 173 Cb 0.50 -5.66 -0.01 0.00 -1.84 0.00 0.00 35.03 28.03 1yho n LYS 173 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1yho n GLY 174 N -1.06 0.48 3.22 0.72 0.00 -1.26 -5.03 105.19 102.27 1yho n GLY 174 Ca -0.23 -0.88 -0.34 0.00 0.00 0.00 0.00 46.02 44.58 1yho n GLY 174 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yho s ILE 175 N -2.03 2.80 -0.01 -0.61 1.01 -0.20 -5.10 121.20 117.06 1yho s ILE 175 Ca 0.00 -0.77 -0.16 0.00 0.00 0.00 0.00 60.65 59.71 1yho s ILE 175 Cb 0.00 -2.29 -0.06 0.00 0.01 0.00 0.00 42.46 40.13 1yho s ILE 175 CO 0.00 0.41 0.45 -0.54 0.00 0.00 0.00 174.94 175.26 1yho s LYS 176 N 1.38 4.06 0.11 2.79 3.01 -1.25 -1.40 119.74 128.44 1yho s LYS 176 Ca 0.04 0.48 -0.17 0.00 -1.01 0.00 0.00 55.97 55.31 1yho s LYS 176 Cb -0.14 -3.27 0.04 0.00 -1.01 0.00 0.00 37.83 33.44 1yho s LYS 176 CO -0.07 0.57 0.41 1.52 0.51 0.00 0.00 175.35 178.28 1yho s TYR 177 N -0.72 -0.22 0.17 3.18 1.13 -0.80 0.70 117.35 120.79 1yho s TYR 177 Ca 0.25 -0.03 0.08 0.00 -1.41 0.00 0.00 57.07 55.96 1yho s TYR 177 Cb -0.17 0.25 -0.04 0.00 -1.10 0.00 0.00 41.96 40.90 1yho s TYR 177 CO 0.14 -0.67 -0.16 0.15 -2.51 0.00 0.00 175.55 172.50 1yho s LYS 178 N -3.50 1.25 -0.20 -3.49 -0.14 0.16 -0.83 119.74 112.99 1yho s LYS 178 Ca 0.01 -1.46 -0.06 0.00 -1.36 0.00 0.00 55.97 53.10 1yho s LYS 178 Cb 0.01 -1.15 -0.03 0.00 -1.68 0.00 0.00 37.83 34.98 1yho s LYS 178 CO -0.10 0.21 0.03 -0.06 -0.76 0.00 0.00 175.35 174.68 1yho s PHE 179 N -2.48 3.10 -0.06 3.18 0.40 -1.26 -1.64 117.98 119.22 1yho s PHE 179 Ca 0.17 -0.28 0.05 0.00 -0.60 0.00 0.00 56.93 56.27 1yho s PHE 179 Cb -0.03 -2.11 -0.01 0.00 0.51 0.00 0.00 43.02 41.38 1yho s PHE 179 CO 0.06 -0.14 -0.22 -1.21 0.70 0.00 0.00 175.22 174.41 1yho s GLU 180 N 0.93 2.34 -0.14 0.44 0.41 -0.45 -4.82 118.70 117.41 1yho s GLU 180 Ca 0.02 -0.78 -0.05 0.00 -0.41 0.00 0.00 54.97 53.76 1yho s GLU 180 Cb -0.14 -1.95 -0.04 0.00 -1.78 0.00 0.00 34.13 30.23 1yho s GLU 180 CO 0.02 0.28 0.03 0.08 -0.49 0.00 0.00 175.26 175.19 1yho s VAL 181 N 0.03 4.55 -0.07 2.63 1.01 -0.64 -1.47 120.40 126.44 1yho s VAL 181 Ca -0.07 -0.14 0.04 0.00 0.00 0.00 0.00 61.98 61.81 1yho s VAL 181 Cb -0.14 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.25 1yho s VAL 181 CO 0.04 0.53 -0.19 -0.31 0.00 0.00 0.00 175.10 175.17 1yho s TYR 182 N -0.15 2.00 0.01 5.22 1.51 0.24 0.32 117.35 126.51 1yho s TYR 182 Ca 0.06 -0.74 0.07 0.00 -1.01 0.00 0.00 57.07 55.45 1yho s TYR 182 Cb -0.12 -1.37 -0.03 0.00 -0.11 0.00 0.00 41.96 40.33 1yho s TYR 182 CO 0.02 -0.30 -0.21 -2.00 -1.11 0.00 0.00 175.55 171.94 1yho s GLU 183 N 0.35 2.09 -0.23 -0.62 2.56 -0.78 0.58 118.70 122.65 1yho s GLU 183 Ca -0.13 -0.95 -0.10 0.00 0.00 0.00 0.00 54.97 53.79 1yho s GLU 183 Cb -0.16 -2.14 -0.05 0.00 2.00 0.00 0.00 34.13 33.79 1yho s GLU 183 CO 0.05 0.55 0.13 0.21 -0.56 0.00 0.00 175.26 175.65 1yho s LYS 184 N -1.09 4.02 -0.14 4.30 2.20 -0.65 0.25 119.74 128.62 1yho s LYS 184 Ca 0.12 -0.30 -0.06 0.00 -0.36 0.00 0.00 55.97 55.37 1yho s LYS 184 Cb -0.10 -3.44 -0.04 0.00 -1.51 0.00 0.00 37.83 32.73 1yho s LYS 184 CO 0.02 0.10 0.07 -0.80 -0.36 0.00 0.00 175.35 174.39 1yho s ASN 185 N 0.91 5.79 0.00 1.43 0.01 -0.94 -4.11 114.94 118.04 1yho s ASN 185 Ca 0.06 0.22 0.08 0.00 -0.71 0.00 0.00 52.86 52.52 1yho s ASN 185 Cb -0.13 -1.88 0.49 0.00 0.41 0.00 0.00 41.25 40.13 1yho s ASN 185 CO 0.03 0.29 0.94 -0.67 -1.51 0.00 0.00 177.10 176.18