#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 0.19 3.61 7.63 0.00 -1.23 -4.94 105.19 110.45 1yho n GLY 2 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.10 5.17 -0.15 1.61 0.01 -1.26 -5.00 113.70 111.98 1yho s SER 3 Ca 0.00 0.04 -0.01 0.00 1.31 0.00 0.00 55.95 57.29 1yho s SER 3 Cb 0.00 -1.69 -0.01 0.00 0.21 0.00 0.00 66.02 64.53 1yho s SER 3 CO 0.00 0.26 -0.11 -0.22 0.41 0.00 0.00 173.24 173.58 1yho s LEU 4 N -0.17 2.75 -0.18 2.44 2.96 -1.26 -1.95 118.68 123.26 1yho s LEU 4 Ca 0.05 -0.34 -0.01 0.00 -0.22 0.00 0.00 54.13 53.61 1yho s LEU 4 Cb -0.13 -1.64 0.00 0.00 0.50 0.00 0.00 46.19 44.93 1yho s LEU 4 CO 0.02 0.13 -0.13 0.20 -1.32 0.00 0.00 176.35 175.24 1yho s ASN 5 N 0.58 3.69 -0.13 3.68 0.01 0.05 -2.11 114.94 120.71 1yho s ASN 5 Ca -0.07 -0.50 -0.07 0.00 -0.71 0.00 0.00 52.86 51.51 1yho s ASN 5 Cb -0.15 -1.59 -0.04 0.00 0.41 0.00 0.00 41.25 39.87 1yho s ASN 5 CO 0.03 0.03 0.12 0.00 -1.51 0.00 0.00 177.10 175.77 1yho s ILE 7 N -0.76 -0.21 0.03 0.00 2.07 -0.93 1.00 121.20 122.41 1yho s ILE 7 Ca 0.13 0.21 -0.10 0.00 -1.41 0.00 0.00 60.65 59.48 1yho s ILE 7 Cb -0.12 -0.37 0.01 0.00 0.13 0.00 0.00 42.46 42.11 1yho s ILE 7 CO 0.03 0.02 0.20 0.68 -1.91 0.00 0.00 174.94 173.97 1yho s VAL 8 N 2.24 0.10 0.04 4.00 -7.23 -0.25 -4.48 120.40 114.83 1yho s VAL 8 Ca 0.04 -0.84 0.01 0.00 -1.81 0.00 0.00 61.98 59.38 1yho s VAL 8 Cb -0.13 -0.85 -0.04 0.00 0.56 0.00 0.00 36.38 35.92 1yho s VAL 8 CO -0.07 -0.46 0.10 0.00 -0.31 0.00 0.00 175.10 174.37 1yho s ALA 9 N -2.38 3.66 -0.03 1.32 0.00 -1.26 -1.77 121.76 121.30 1yho s ALA 9 Ca -0.06 -0.92 -0.07 0.00 0.00 0.00 0.00 51.96 50.91 1yho s ALA 9 Cb -0.02 -1.57 0.01 0.00 0.00 0.00 0.00 23.12 21.54 1yho s ALA 9 CO -0.03 0.74 0.16 0.14 0.00 0.00 0.00 175.76 176.77 1yho s VAL 10 N -1.33 0.04 0.79 0.00 -7.23 0.23 -4.64 120.40 108.27 1yho s VAL 10 Ca 0.27 -0.35 -0.12 0.00 -1.81 0.00 0.00 61.98 59.98 1yho s VAL 10 Cb -0.12 -0.34 0.07 0.00 0.56 0.00 0.00 36.38 36.54 1yho s VAL 10 CO 0.20 -0.19 1.16 -0.55 -0.31 0.00 0.00 175.10 175.41 1yho s SER 11 N -0.66 4.63 0.58 4.85 0.15 0.13 -0.67 113.70 122.73 1yho s SER 11 Ca -0.07 0.82 0.39 0.00 0.70 0.00 0.00 55.95 57.78 1yho s SER 11 Cb -0.04 -1.35 2.07 0.00 -1.71 0.00 0.00 66.02 64.98 1yho s SER 11 CO 0.01 -1.83 2.19 -0.61 1.20 0.00 0.00 173.24 174.20 1yho h GLN 12 N -0.99 0.00 -0.78 5.44 4.15 -1.16 -0.93 115.11 120.83 1yho h GLN 12 Ca -0.46 0.00 -0.10 0.00 0.77 0.00 0.00 58.65 58.86 1yho h GLN 12 Cb 1.32 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.95 1yho h GLN 12 CO 0.66 0.00 0.13 -1.71 -1.93 0.00 0.00 178.83 175.98 1yho n ASN 13 N -2.91 4.16 -2.32 -0.69 2.85 -1.26 -4.87 115.26 110.21 1yho n ASN 13 Ca -0.02 -2.80 -0.21 0.00 -0.11 0.00 0.00 54.58 51.44 1yho n ASN 13 Cb 0.09 -0.66 -0.02 0.00 1.24 0.00 0.00 39.78 40.43 1yho n ASN 13 CO 0.00 0.00 0.00 0.23 -2.11 0.00 0.00 177.26 175.38 1yho n MET 14 N 0.14 -1.67 -4.04 1.20 2.81 -0.35 -4.93 117.12 110.27 1yho n MET 14 Ca 0.26 1.03 -0.35 0.00 -1.81 0.00 0.00 57.70 56.83 1yho n MET 14 Cb 1.04 -5.67 -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 -2.12 2.06 -0.19 3.03 0.00 -1.24 -0.72 107.32 108.14 1yho s GLY 15 Ca 0.00 -0.74 0.00 0.00 0.00 0.00 0.00 44.72 43.98 1yho s GLY 15 CO 0.00 -0.54 -0.18 0.29 0.00 0.00 0.00 173.10 172.67 1yho n ILE 16 N 1.70 1.10 -3.57 0.90 -5.35 -0.84 0.20 119.36 113.51 1yho n ILE 16 Ca -0.17 -0.41 -0.10 0.00 -0.27 0.00 0.00 62.75 61.80 1yho n ILE 16 Cb 0.54 -1.24 -0.05 0.00 -1.74 0.00 0.00 39.64 37.15 1yho n ILE 16 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1yho s GLY 17 N -5.81 -0.30 -0.19 3.28 0.00 -1.26 -4.62 107.32 98.43 1yho s GLY 17 Ca -0.26 1.88 -0.01 0.00 0.00 0.00 0.00 44.72 46.33 1yho s GLY 17 CO 0.44 0.93 -0.14 1.25 0.00 0.00 0.00 173.10 175.58 1yho s LYS 18 N -1.39 3.18 -1.63 2.90 2.36 0.31 -2.01 119.74 123.46 1yho s LYS 18 Ca -0.01 -0.74 0.00 0.00 -2.55 0.00 0.00 55.97 52.67 1yho s LYS 18 Cb -0.01 -2.73 0.00 0.00 -1.05 0.00 0.00 37.83 34.05 1yho s LYS 18 CO 0.00 -0.14 0.00 0.09 1.55 0.00 0.00 175.35 176.85 1yho n ASN 19 N 4.51 -5.26 0.00 1.43 4.13 -1.26 -1.77 115.26 117.04 1yho n ASN 19 Ca -0.20 0.08 0.00 0.00 1.68 0.00 0.00 54.58 56.14 1yho n ASN 19 Cb 0.51 -4.33 0.00 0.00 -1.54 0.00 0.00 39.78 34.42 1yho n ASN 19 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1yho n GLY 20 N -0.96 0.44 3.04 7.41 0.00 -1.26 -5.05 105.19 108.81 1yho n GLY 20 Ca -0.21 -0.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.92 0.16 0.31 1.61 1.11 -0.73 -5.01 116.67 111.21 1yho s ASP 21 Ca 0.00 -0.41 -0.29 0.00 0.18 0.00 0.00 52.55 52.03 1yho s ASP 21 Cb 0.00 0.15 -0.10 0.00 1.07 0.00 0.00 42.92 44.04 1yho s ASP 21 CO 0.00 -0.35 1.35 -0.76 1.18 0.00 0.00 175.17 176.58 1yho s LEU 22 N -1.53 4.41 0.23 1.23 1.43 -1.26 0.11 118.68 123.30 1yho s LEU 22 Ca -0.14 2.70 -0.07 0.00 -1.03 0.00 0.00 54.13 55.58 1yho s LEU 22 Cb -0.08 -3.64 0.24 0.00 0.03 0.00 0.00 46.19 42.74 1yho s LEU 22 CO -0.01 -0.59 1.89 -0.65 0.23 0.00 0.00 176.35 177.23 1yho h PRO 23 N 3.76 1.10 -6.63 1.29 0.11 -1.82 -3.43 132.00 126.39 1yho h PRO 23 Ca -0.48 -0.07 -0.51 0.00 0.11 0.00 0.00 66.00 65.05 1yho h PRO 23 Cb 1.22 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 32.07 1yho h PRO 23 CO 0.68 0.73 -0.01 1.67 -0.21 0.00 0.00 178.00 180.86 1yho s TRP 24 N -6.11 3.44 1.18 0.65 -2.14 -1.26 -4.90 118.94 109.80 1yho s TRP 24 Ca -0.13 0.94 -0.17 0.00 2.66 0.00 0.00 56.10 59.40 1yho s TRP 24 Cb 0.17 -2.33 0.28 0.00 -3.10 0.00 0.00 33.47 28.48 1yho s TRP 24 CO 0.80 0.10 1.06 -1.25 -2.66 0.00 0.00 176.95 175.00 1yho s PRO 25 N -3.32 -1.06 -0.18 3.25 0.04 -1.26 -4.88 135.00 127.58 1yho s PRO 25 Ca 0.49 0.23 -0.37 0.00 0.04 0.00 0.00 61.00 61.39 1yho s PRO 25 Cb -0.11 -1.59 -0.14 0.00 0.04 0.00 0.00 34.50 32.71 1yho s PRO 25 CO 0.25 -3.67 1.81 -2.30 0.04 0.00 0.00 177.00 173.14 1yho n PRO 26 N -4.78 1.66 -3.73 0.56 -0.02 -1.26 -4.94 135.00 122.48 1yho n PRO 26 Ca 0.09 0.61 -0.38 0.00 -2.02 0.00 0.00 63.50 61.80 1yho n PRO 26 Cb 0.58 -2.37 -0.12 0.00 -0.02 0.00 0.00 33.50 31.57 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 3.79 4.39 0.27 2.45 2.96 -1.26 -4.97 118.68 126.31 1yho s LEU 27 Ca 0.96 -1.14 -0.04 0.00 -0.22 0.00 0.00 54.13 53.69 1yho s LEU 27 Cb -0.89 -1.89 0.35 0.00 0.50 0.00 0.00 46.19 44.27 1yho s LEU 27 CO 0.59 -0.34 1.92 0.03 -1.32 0.00 0.00 176.35 177.23 1yho h ARG 28 N 8.25 1.21 -0.52 1.98 3.08 -1.98 0.37 114.38 126.78 1yho h ARG 28 Ca -0.23 -0.07 -0.05 0.00 0.07 0.00 0.00 59.98 59.69 1yho h ARG 28 Cb 1.08 -0.27 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 1yho h ARG 28 CO 0.61 0.80 0.13 -0.97 -1.07 0.00 0.00 179.97 179.47 1yho h ASN 29 N 1.25 0.79 -0.14 7.04 -1.24 -1.98 0.18 115.58 121.49 1yho h ASN 29 Ca 0.38 -0.23 -0.15 0.00 0.71 0.00 0.00 56.30 57.01 1yho h ASN 29 Cb -0.03 -0.21 0.01 0.00 0.73 0.00 0.00 38.32 38.81 1yho h ASN 29 CO -0.11 0.82 -0.50 -0.08 -1.29 0.00 0.00 177.43 176.27 1yho h GLU 30 N 0.73 0.58 -0.43 6.67 4.81 -1.84 0.11 114.58 125.21 1yho h GLU 30 Ca 0.16 -0.44 -0.05 0.00 -0.13 0.00 0.00 59.36 58.91 1yho h GLU 30 Cb 0.33 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 1yho h GLU 30 CO 0.00 1.06 0.08 0.74 -0.73 0.00 0.00 179.01 180.17 1yho h PHE 31 N 0.22 0.74 -0.08 0.92 -1.00 -0.21 0.10 116.94 117.62 1yho h PHE 31 Ca -0.02 -0.10 -0.08 0.00 2.81 0.00 0.00 57.97 60.58 1yho h PHE 31 Cb 1.12 -0.20 0.00 0.00 3.61 0.00 0.00 35.95 40.48 1yho h PHE 31 CO 0.10 0.70 -0.27 0.00 -1.61 0.00 0.00 178.31 177.23 1yho h ARG 32 N 0.56 0.32 -0.72 1.51 3.08 -0.69 -2.27 114.38 116.16 1yho h ARG 32 Ca 0.13 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1yho h ARG 32 Cb 0.35 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.41 1yho h ARG 32 CO 0.01 0.87 0.42 -0.92 -1.07 0.00 0.00 179.97 179.28 1yho h TYR 33 N -0.16 0.96 -0.16 3.04 3.20 -0.77 0.66 116.97 123.75 1yho h TYR 33 Ca -0.01 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 1yho h TYR 33 Cb 0.90 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 1yho h TYR 33 CO 0.12 0.66 0.05 0.35 -1.64 0.00 0.00 178.16 177.70 1yho h PHE 34 N 0.99 0.27 -0.28 -3.82 3.04 -0.84 0.06 116.94 116.36 1yho h PHE 34 Ca 0.26 -0.03 -0.10 0.00 3.98 0.00 0.00 57.97 62.08 1yho h PHE 34 Cb -0.01 -0.08 -0.01 0.00 2.56 0.00 0.00 35.95 38.41 1yho h PHE 34 CO -0.01 0.37 -0.23 0.37 -2.02 0.00 0.00 178.31 176.79 1yho h GLN 35 N 0.09 0.66 -0.49 1.11 4.15 -1.19 -2.20 115.11 117.23 1yho h GLN 35 Ca 0.05 -0.33 -0.02 0.00 0.77 0.00 0.00 58.65 59.12 1yho h GLN 35 Cb 0.23 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.90 1yho h GLN 35 CO -0.00 0.93 0.21 -0.09 -1.93 0.00 0.00 178.83 177.95 1yho h ARG 36 N 0.39 0.70 0.01 1.69 1.12 0.38 0.18 114.38 118.85 1yho h ARG 36 Ca 0.05 -0.09 -0.00 0.00 -1.11 0.00 0.00 59.98 58.83 1yho h ARG 36 Cb 0.79 -0.13 0.00 0.00 -0.01 0.00 0.00 29.97 30.62 1yho h ARG 36 CO 0.06 0.57 -0.00 1.98 -3.11 0.00 0.00 179.97 179.46 1yho h MET 37 N 0.69 -0.01 -0.50 0.20 4.05 -0.88 -1.87 114.93 116.61 1yho h MET 37 Ca 0.17 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.58 1yho h MET 37 Cb 0.12 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.90 1yho h MET 37 CO -0.02 0.46 0.27 1.79 0.23 0.00 0.00 176.91 179.64 1yho h THR 38 N -0.48 1.18 -0.84 -0.77 1.35 -1.21 -2.64 112.91 109.50 1yho h THR 38 Ca -0.00 -0.46 -0.01 0.00 -0.55 0.00 0.00 66.41 65.39 1yho h THR 38 Cb 0.47 0.57 -0.04 0.00 -1.73 0.00 0.00 68.15 67.42 1yho h THR 38 CO 0.00 0.19 0.48 0.71 -0.25 0.00 0.00 175.52 176.65 1yho h THR 39 N 0.66 1.24 -2.02 6.82 1.35 -1.00 -3.39 112.91 116.57 1yho h THR 39 Ca 0.18 -0.55 -0.50 0.00 -0.55 0.00 0.00 66.41 64.98 1yho h THR 39 Cb 0.06 0.08 -0.03 0.00 -1.73 0.00 0.00 68.15 66.53 1yho h THR 39 CO -0.03 0.26 1.38 -0.89 -0.25 0.00 0.00 175.52 175.99 1yho s THR 40 N -5.82 3.33 0.28 6.82 2.01 -0.71 -4.97 115.64 116.59 1yho s THR 40 Ca -0.12 0.21 -0.08 0.00 0.31 0.00 0.00 61.69 62.01 1yho s THR 40 Cb 0.17 -3.81 -0.06 0.00 0.01 0.00 0.00 72.50 68.81 1yho s THR 40 CO 0.81 -0.76 0.59 -0.94 -0.69 0.00 0.00 174.62 173.63 1yho s SER 41 N 8.33 6.55 0.24 3.53 1.04 -1.26 -4.93 113.70 127.19 1yho s SER 41 Ca 0.72 0.88 0.04 0.00 0.48 0.00 0.00 55.95 58.07 1yho s SER 41 Cb -0.14 -2.21 0.25 0.00 0.10 0.00 0.00 66.02 64.02 1yho s SER 41 CO 0.23 -0.17 1.56 0.28 0.98 0.00 0.00 173.24 176.12 1yho h SER 42 N 2.03 0.30 -3.59 7.02 0.02 -1.96 -3.43 113.55 113.94 1yho h SER 42 Ca -0.47 -0.17 -0.66 0.00 -0.84 0.00 0.00 61.79 59.65 1yho h SER 42 Cb 1.18 -0.09 -0.32 0.00 0.14 0.00 0.00 62.40 63.31 1yho h SER 42 CO 0.67 0.82 -0.87 0.68 -1.14 0.00 0.00 176.83 176.99 1yho s VAL 43 N -3.80 1.92 0.31 2.27 -7.23 -1.26 -5.12 120.40 107.48 1yho s VAL 43 Ca -0.04 -0.96 -0.27 0.00 -1.81 0.00 0.00 61.98 58.90 1yho s VAL 43 Cb 0.12 -1.65 -0.10 0.00 0.56 0.00 0.00 36.38 35.31 1yho s VAL 43 CO 0.80 0.53 0.96 -1.61 -0.31 0.00 0.00 175.10 175.47 1yho s GLU 44 N 0.20 4.63 0.00 4.82 2.02 -1.26 -3.72 118.70 125.39 1yho s GLU 44 Ca -0.13 1.40 0.00 0.00 0.02 0.00 0.00 54.97 56.26 1yho s GLU 44 Cb -0.16 -2.92 0.00 0.00 0.10 0.00 0.00 34.13 31.15 1yho s GLU 44 CO 0.06 0.31 0.00 0.41 0.02 0.00 0.00 175.26 176.07 1yho n GLY 45 N 0.81 0.71 3.48 -1.39 0.00 -1.26 -5.07 105.19 102.46 1yho n GLY 45 Ca 0.01 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.70 1.70 -0.13 1.61 -0.14 -1.24 -5.12 119.74 115.71 1yho s LYS 46 Ca 0.00 -1.76 0.00 0.00 -1.36 0.00 0.00 55.97 52.86 1yho s LYS 46 Cb 0.00 -1.78 -0.01 0.00 -1.68 0.00 0.00 37.83 34.36 1yho s LYS 46 CO 0.00 0.33 -0.15 -1.14 -0.76 0.00 0.00 175.35 173.64 1yho s GLN 47 N -3.51 3.31 -0.08 1.68 0.74 -1.13 -5.06 119.66 115.60 1yho s GLN 47 Ca 0.30 -0.72 -0.09 0.00 0.05 0.00 0.00 55.36 54.90 1yho s GLN 47 Cb -0.05 -2.60 -0.05 0.00 1.10 0.00 0.00 33.01 31.42 1yho s GLN 47 CO 0.15 0.16 0.22 -0.80 -0.55 0.00 0.00 175.29 174.48 1yho s ASN 48 N 0.46 6.52 -0.20 6.67 0.01 -1.26 -3.18 114.94 123.95 1yho s ASN 48 Ca -0.11 0.62 -0.05 0.00 -0.71 0.00 0.00 52.86 52.61 1yho s ASN 48 Cb -0.16 -2.12 -0.03 0.00 0.41 0.00 0.00 41.25 39.35 1yho s ASN 48 CO 0.05 0.38 0.01 -0.22 -1.51 0.00 0.00 177.10 175.81 1yho s LEU 49 N -1.06 3.31 0.01 0.60 0.20 -0.96 -1.94 118.68 118.84 1yho s LEU 49 Ca 0.18 -0.18 0.03 0.00 0.69 0.00 0.00 54.13 54.85 1yho s LEU 49 Cb -0.13 -1.84 -0.03 0.00 -0.43 0.00 0.00 46.19 43.75 1yho s LEU 49 CO 0.07 0.07 -0.05 0.68 -0.29 0.00 0.00 176.35 176.82 1yho s VAL 50 N 0.99 3.73 -0.10 1.68 -7.23 0.04 -1.13 120.40 118.39 1yho s VAL 50 Ca 0.02 -0.78 0.03 0.00 -1.81 0.00 0.00 61.98 59.44 1yho s VAL 50 Cb -0.14 -2.64 -0.01 0.00 0.56 0.00 0.00 36.38 34.15 1yho s VAL 50 CO 0.02 0.37 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.35 1yho s ILE 51 N -1.03 2.52 0.21 -0.62 1.01 -0.12 -0.38 121.20 122.77 1yho s ILE 51 Ca 0.18 -0.86 0.04 0.00 0.00 0.00 0.00 60.65 60.00 1yho s ILE 51 Cb -0.11 -2.00 -0.05 0.00 0.01 0.00 0.00 42.46 40.31 1yho s ILE 51 CO 0.09 0.55 -0.03 -0.32 0.00 0.00 0.00 174.94 175.23 1yho s MET 52 N 0.21 1.25 0.61 2.79 1.75 0.23 -0.95 119.30 125.19 1yho s MET 52 Ca -0.12 -1.61 -0.02 0.00 -1.25 0.00 0.00 55.69 52.69 1yho s MET 52 Cb -0.16 -0.60 0.04 0.00 2.84 0.00 0.00 34.83 36.96 1yho s MET 52 CO 0.06 -0.05 0.87 0.20 -0.65 0.00 0.00 175.02 175.45 1yho s GLY 53 N -3.26 1.77 0.20 2.11 0.00 -1.17 -2.02 107.32 104.95 1yho s GLY 53 Ca 0.25 -1.16 -0.09 0.00 0.00 0.00 0.00 44.72 43.73 1yho s GLY 53 CO 0.06 -0.82 1.74 1.70 0.00 0.00 0.00 173.10 175.77 1yho h LYS 54 N -0.20 1.11 -0.20 2.90 3.64 -1.96 -1.07 116.57 120.79 1yho h LYS 54 Ca -0.43 -0.24 -0.03 0.00 -1.27 0.00 0.00 60.65 58.68 1yho h LYS 54 Cb 1.30 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 1yho h LYS 54 CO 0.56 0.95 0.00 0.87 -2.27 0.00 0.00 179.45 179.56 1yho h LYS 55 N 1.06 0.35 -0.46 1.90 1.79 -1.95 -1.87 116.57 117.39 1yho h LYS 55 Ca 0.23 -0.11 -0.00 0.00 -2.18 0.00 0.00 60.65 58.59 1yho h LYS 55 Cb 0.30 -0.03 -0.02 0.00 -1.58 0.00 0.00 32.23 30.89 1yho h LYS 55 CO -0.01 0.55 0.28 1.15 -1.08 0.00 0.00 179.45 180.34 1yho h THR 56 N 0.12 1.14 -0.64 -0.16 2.02 -1.92 -0.31 112.91 113.16 1yho h THR 56 Ca 0.06 -0.31 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 1yho h THR 56 Cb 0.39 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 67.28 1yho h THR 56 CO 0.01 0.14 0.35 -0.25 0.37 0.00 0.00 175.52 176.14 1yho h TRP 57 N 0.61 0.86 0.00 3.16 2.91 -1.15 -1.19 115.95 121.15 1yho h TRP 57 Ca 0.17 -0.01 -0.02 0.00 1.13 0.00 0.00 58.89 60.16 1yho h TRP 57 Cb -0.02 -0.28 -0.00 0.00 -0.51 0.00 0.00 29.16 28.35 1yho h TRP 57 CO -0.03 0.59 -0.08 0.74 -1.03 0.00 0.00 178.44 178.64 1yho h PHE 58 N 0.89 0.00 0.00 2.65 -1.00 -0.80 -3.13 116.94 115.54 1yho h PHE 58 Ca 0.23 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 60.81 1yho h PHE 58 Cb 0.02 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.55 1yho h PHE 58 CO 0.01 0.08 -1.04 0.66 -1.61 0.00 0.00 178.31 176.40 1yho h SER 59 N 0.00 0.00 -3.55 2.17 4.64 0.07 -3.46 113.55 113.42 1yho h SER 59 Ca -0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 1yho h SER 59 Cb 0.87 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.99 1yho h SER 59 CO 0.01 0.84 0.59 -0.63 -0.87 0.00 0.00 176.83 176.77 1yho s ILE 60 N -2.77 3.31 0.74 0.95 1.01 -0.64 -5.01 121.20 118.78 1yho s ILE 60 Ca 0.00 1.15 -0.11 0.00 0.00 0.00 0.00 60.65 61.69 1yho s ILE 60 Cb 0.09 -3.73 0.04 0.00 0.01 0.00 0.00 42.46 38.86 1yho s ILE 60 CO 0.80 0.21 1.08 -2.16 0.00 0.00 0.00 174.94 174.87 1yho s PRO 61 N -0.59 2.52 0.30 2.79 0.04 -1.26 -4.96 135.00 133.84 1yho s PRO 61 Ca 0.52 1.11 0.15 0.00 0.04 0.00 0.00 61.00 62.82 1yho s PRO 61 Cb -0.35 -1.93 0.38 0.00 0.04 0.00 0.00 34.50 32.64 1yho s PRO 61 CO 0.40 -1.44 1.59 0.93 0.04 0.00 0.00 177.00 178.53 1yho h GLU 62 N -0.91 0.00 -0.59 4.56 5.08 -1.95 -3.15 114.58 117.62 1yho h GLU 62 Ca -0.44 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.01 1yho h GLU 62 Cb 1.22 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 1yho h GLU 62 CO 0.53 0.53 0.40 0.87 -1.00 0.00 0.00 179.01 180.34 1yho h LYS 63 N 0.00 0.43 -0.59 2.33 1.79 -2.02 -0.86 116.57 117.65 1yho h LYS 63 Ca -0.01 -0.03 -0.33 0.00 -2.18 0.00 0.00 60.65 58.11 1yho h LYS 63 Cb 1.15 -0.10 -0.20 0.00 -1.58 0.00 0.00 32.23 31.50 1yho h LYS 63 CO 0.07 0.28 0.10 0.09 -1.08 0.00 0.00 179.45 178.92 1yho n ASN 64 N -4.47 3.41 -3.93 0.86 3.02 -1.19 -4.96 115.26 108.00 1yho n ASN 64 Ca 0.09 -3.76 -0.14 0.00 -0.03 0.00 0.00 54.58 50.74 1yho n ASN 64 Cb 0.34 -0.69 -0.14 0.00 -0.61 0.00 0.00 39.78 38.68 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 -3.35 0.27 0.32 3.52 3.52 -0.33 -3.31 118.95 119.58 1yho s ARG 65 Ca 0.50 -0.12 -0.28 0.00 -0.13 0.00 0.00 55.73 55.70 1yho s ARG 65 Cb 0.43 -0.26 -0.09 0.00 -1.56 0.00 0.00 34.95 33.47 1yho s ARG 65 CO 0.02 0.07 1.13 -1.25 -0.81 0.00 0.00 175.30 174.46 1yho s PRO 66 N -0.09 4.46 -0.55 5.12 0.04 -1.26 -4.89 135.00 137.83 1yho s PRO 66 Ca 0.01 1.82 -0.26 0.00 0.04 0.00 0.00 61.00 62.61 1yho s PRO 66 Cb -0.01 -3.02 -0.08 0.00 0.04 0.00 0.00 34.50 31.43 1yho s PRO 66 CO -0.00 0.04 2.37 -1.17 0.04 0.00 0.00 177.00 178.28 1yho s LEU 67 N -1.79 3.31 0.82 -3.56 2.96 -1.21 -4.93 118.68 114.28 1yho s LEU 67 Ca 0.48 0.85 -0.11 0.00 -0.22 0.00 0.00 54.13 55.14 1yho s LEU 67 Cb -0.31 -2.51 0.09 0.00 0.50 0.00 0.00 46.19 43.95 1yho s LEU 67 CO 0.40 -3.02 1.10 -0.75 -1.32 0.00 0.00 176.35 172.77 1yho s LYS 68 N 8.28 1.84 0.00 1.98 2.20 -1.26 -3.67 119.74 129.12 1yho s LYS 68 Ca 0.94 1.19 0.00 0.00 -0.36 0.00 0.00 55.97 57.74 1yho s LYS 68 Cb -0.16 -1.85 0.00 0.00 -1.51 0.00 0.00 37.83 34.31 1yho s LYS 68 CO 0.22 -1.94 0.00 0.41 -0.36 0.00 0.00 175.35 173.68 1yho n GLY 69 N -0.90 2.87 3.05 5.54 0.00 -1.26 -4.99 105.19 109.50 1yho n GLY 69 Ca 0.09 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1yho n GLY 69 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1yho s ARG 70 N 0.00 0.44 -0.16 1.61 3.03 -1.24 -4.73 118.95 117.90 1yho s ARG 70 Ca 0.00 -0.68 -0.29 0.00 2.03 0.00 0.00 55.73 56.79 1yho s ARG 70 Cb 0.00 0.17 -0.01 0.00 -1.03 0.00 0.00 34.95 34.08 1yho s ARG 70 CO 0.00 -0.09 1.13 0.42 -1.13 0.00 0.00 175.30 175.63 1yho s ILE 71 N -2.01 4.50 -0.29 4.99 1.01 -0.82 -4.81 121.20 123.77 1yho s ILE 71 Ca -0.10 1.81 -0.18 0.00 0.00 0.00 0.00 60.65 62.17 1yho s ILE 71 Cb -0.05 -4.16 -0.02 0.00 0.01 0.00 0.00 42.46 38.23 1yho s ILE 71 CO -0.02 -0.11 0.52 0.20 0.00 0.00 0.00 174.94 175.53 1yho s ASN 72 N 1.48 6.40 -0.08 3.58 0.01 -1.26 -0.78 114.94 124.29 1yho s ASN 72 Ca 0.50 0.35 0.05 0.00 -0.71 0.00 0.00 52.86 53.05 1yho s ASN 72 Cb -0.19 -2.28 -0.00 0.00 0.41 0.00 0.00 41.25 39.18 1yho s ASN 72 CO 0.13 -0.36 -0.24 -0.22 -1.51 0.00 0.00 177.10 174.90 1yho s LEU 73 N 2.36 2.07 -0.06 0.60 0.20 0.48 -1.10 118.68 123.23 1yho s LEU 73 Ca 0.21 -0.53 0.04 0.00 0.69 0.00 0.00 54.13 54.53 1yho s LEU 73 Cb -0.15 -1.38 -0.02 0.00 -0.43 0.00 0.00 46.19 44.20 1yho s LEU 73 CO 0.11 0.20 -0.16 -0.69 -0.29 0.00 0.00 176.35 175.51 1yho s VAL 74 N 0.11 2.85 -0.42 1.68 1.01 -0.64 0.76 120.40 125.74 1yho s VAL 74 Ca -0.12 -0.79 -0.13 0.00 0.00 0.00 0.00 61.98 60.94 1yho s VAL 74 Cb -0.16 -2.11 0.05 0.00 0.00 0.00 0.00 36.38 34.16 1yho s VAL 74 CO 0.06 0.57 0.30 -0.76 0.00 0.00 0.00 175.10 175.28 1yho s LEU 75 N -0.43 5.19 -0.09 3.92 1.02 -0.85 -1.33 118.68 126.09 1yho s LEU 75 Ca 0.05 -1.17 0.02 0.00 0.02 0.00 0.00 54.13 53.05 1yho s LEU 75 Cb -0.12 -2.10 0.01 0.00 0.02 0.00 0.00 46.19 44.00 1yho s LEU 75 CO 0.02 -0.51 -0.14 -0.44 0.02 0.00 0.00 176.35 175.29 1yho s SER 76 N 2.02 2.27 -0.02 2.29 0.01 -0.42 -4.27 113.70 115.58 1yho s SER 76 Ca 0.04 -0.39 0.15 0.00 1.31 0.00 0.00 55.95 57.06 1yho s SER 76 Cb -0.21 -1.02 -0.20 0.00 0.21 0.00 0.00 66.02 64.80 1yho s SER 76 CO 0.07 0.02 0.65 -1.14 0.41 0.00 0.00 173.24 173.25 1yho n ARG 77 N 4.08 0.63 0.09 12.44 0.63 -1.26 -3.99 116.66 129.29 1yho n ARG 77 Ca -0.20 0.22 -0.20 0.00 -0.92 0.00 0.00 57.85 56.76 1yho n ARG 77 Cb 0.51 -1.76 -0.15 0.00 0.45 0.00 0.00 32.46 31.52 1yho n ARG 77 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 1yho h GLU 78 N 0.00 0.35 -6.52 -0.14 4.81 -1.95 -3.46 114.58 107.68 1yho h GLU 78 Ca -0.26 -0.60 -0.53 0.00 -0.13 0.00 0.00 59.36 57.84 1yho h GLU 78 Cb 1.85 0.22 -0.03 0.00 0.63 0.00 0.00 28.75 31.42 1yho h GLU 78 CO 0.06 1.25 0.12 -0.51 -0.73 0.00 0.00 179.01 179.20 1yho s LEU 79 N -7.22 4.45 -0.20 1.64 1.43 -1.26 -4.98 118.68 112.54 1yho s LEU 79 Ca -0.09 1.48 0.16 0.00 -1.03 0.00 0.00 54.13 54.65 1yho s LEU 79 Cb 0.06 -3.42 -0.24 0.00 0.03 0.00 0.00 46.19 42.62 1yho s LEU 79 CO 0.88 0.12 0.06 2.29 0.23 0.00 0.00 176.35 179.93 1yho n LYS 80 N 1.12 0.68 -4.09 1.70 0.00 -1.26 -4.80 118.16 111.51 1yho n LYS 80 Ca -0.04 0.02 -0.30 0.00 -0.00 0.00 0.00 58.31 57.98 1yho n LYS 80 Cb 0.50 -1.53 -0.07 0.00 -0.00 0.00 0.00 35.03 33.93 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 -2.50 2.75 0.16 -1.58 2.02 -1.26 -5.03 118.70 113.26 1yho s GLU 81 Ca -0.12 -0.74 -0.31 0.00 0.02 0.00 0.00 54.97 53.82 1yho s GLU 81 Cb 0.06 -2.65 -0.08 0.00 0.10 0.00 0.00 34.13 31.56 1yho s GLU 81 CO 0.81 0.56 1.33 -1.25 0.02 0.00 0.00 175.26 176.73 1yho s PRO 82 N -2.30 4.36 0.77 0.39 0.04 -1.26 -4.99 135.00 132.02 1yho s PRO 82 Ca 0.27 2.04 -0.15 0.00 0.04 0.00 0.00 61.00 63.20 1yho s PRO 82 Cb -0.12 -3.23 0.01 0.00 0.04 0.00 0.00 34.50 31.21 1yho s PRO 82 CO 0.20 -0.33 0.83 -2.30 0.04 0.00 0.00 177.00 175.45 1yho n PRO 83 N 3.25 0.28 -1.73 0.56 -0.02 -1.26 -4.86 135.00 131.22 1yho n PRO 83 Ca 0.08 0.15 -0.42 0.00 -2.02 0.00 0.00 63.50 61.30 1yho n PRO 83 Cb 0.43 -2.12 -0.03 0.00 -0.02 0.00 0.00 33.50 31.76 1yho n PRO 83 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1yho s GLN 84 N -3.39 4.14 0.00 -0.52 2.00 -1.26 -1.68 119.66 118.96 1yho s GLN 84 Ca 0.69 2.58 0.00 0.00 -2.00 0.00 0.00 55.36 56.63 1yho s GLN 84 Cb -0.32 -3.58 0.00 0.00 0.80 0.00 0.00 33.01 29.91 1yho s GLN 84 CO 0.55 -0.83 0.00 0.41 -0.50 0.00 0.00 175.29 174.91 1yho n GLY 85 N 4.21 3.08 3.74 2.59 0.00 -1.26 -5.04 105.19 112.51 1yho n GLY 85 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.85 3.40 0.17 4.61 0.00 -0.67 -4.59 121.76 121.83 1yho s ALA 86 Ca 0.00 0.87 -0.08 0.00 0.00 0.00 0.00 51.96 52.75 1yho s ALA 86 Cb 0.00 -3.37 0.04 0.00 0.00 0.00 0.00 23.12 19.78 1yho s ALA 86 CO 0.00 -0.26 1.52 0.45 0.00 0.00 0.00 175.76 177.47 1yho h HIS 87 N 4.98 1.01 -3.03 0.00 3.86 -1.43 -3.46 115.15 117.07 1yho h HIS 87 Ca -0.45 -0.29 -0.04 0.00 -1.16 0.00 0.00 60.37 58.43 1yho h HIS 87 Cb 1.21 -0.22 -0.13 0.00 1.06 0.00 0.00 27.41 29.33 1yho h HIS 87 CO 0.62 1.09 0.10 -0.06 0.86 0.00 0.00 177.93 180.53 1yho s PHE 88 N -4.39 -0.43 0.02 2.45 0.08 -1.02 -5.00 117.98 109.68 1yho s PHE 88 Ca -0.10 0.26 0.02 0.00 0.12 0.00 0.00 56.93 57.23 1yho s PHE 88 Cb 0.12 0.43 -0.01 0.00 -0.57 0.00 0.00 43.02 42.98 1yho s PHE 88 CO 0.87 -0.76 -0.07 -1.17 -0.10 0.00 0.00 175.22 173.98 1yho s LEU 89 N -2.56 2.11 -0.03 -0.37 2.96 -1.26 -1.62 118.68 117.90 1yho s LEU 89 Ca -0.00 -0.29 0.04 0.00 -0.22 0.00 0.00 54.13 53.66 1yho s LEU 89 Cb -0.00 -0.28 -0.00 0.00 0.50 0.00 0.00 46.19 46.40 1yho s LEU 89 CO -0.10 -0.02 -0.14 -0.44 -1.32 0.00 0.00 176.35 174.33 1yho s SER 90 N -0.71 1.73 0.20 3.68 0.01 -0.44 -4.94 113.70 113.23 1yho s SER 90 Ca -0.02 -0.28 0.05 0.00 1.31 0.00 0.00 55.95 57.02 1yho s SER 90 Cb -0.05 -0.41 0.11 0.00 0.21 0.00 0.00 66.02 65.88 1yho s SER 90 CO 0.00 0.13 1.46 -0.09 0.41 0.00 0.00 173.24 175.15 1yho h ARG 91 N 6.19 0.13 -3.94 12.44 2.43 -1.88 -1.11 114.38 128.64 1yho h ARG 91 Ca -0.33 -0.12 -0.12 0.00 -0.81 0.00 0.00 59.98 58.60 1yho h ARG 91 Cb 1.17 0.03 -0.16 0.00 -0.42 0.00 0.00 29.97 30.59 1yho h ARG 91 CO 0.48 0.83 -0.54 0.45 -1.51 0.00 0.00 179.97 179.68 1yho s SER 92 N -6.87 0.26 0.48 -3.80 0.15 -1.26 -4.11 113.70 98.54 1yho s SER 92 Ca -0.02 -0.70 0.12 0.00 0.70 0.00 0.00 55.95 56.05 1yho s SER 92 Cb 0.11 0.24 1.10 0.00 -1.71 0.00 0.00 66.02 65.76 1yho s SER 92 CO 0.80 -0.58 2.11 0.25 1.20 0.00 0.00 173.24 177.03 1yho h LEU 93 N 3.34 0.19 -0.67 3.45 5.85 -2.00 -1.75 115.31 123.72 1yho h LEU 93 Ca -0.33 -0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.29 1yho h LEU 93 Cb 1.18 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.14 1yho h LEU 93 CO 0.56 0.14 -0.02 -0.78 -0.34 0.00 0.00 178.44 178.00 1yho h ASP 94 N 0.22 0.99 -0.09 1.25 3.58 -1.99 -1.11 116.42 119.27 1yho h ASP 94 Ca 0.06 -0.28 -0.02 0.00 0.42 0.00 0.00 57.03 57.21 1yho h ASP 94 Cb -0.02 -0.27 -0.00 0.00 1.72 0.00 0.00 39.33 40.76 1yho h ASP 94 CO -0.01 1.05 -0.00 -0.78 -2.88 0.00 0.00 179.24 176.62 1yho h ASP 95 N 0.92 0.16 -0.86 2.28 1.82 -1.75 -1.95 116.42 117.04 1yho h ASP 95 Ca 0.16 -0.32 -0.02 0.00 -0.39 0.00 0.00 57.03 56.46 1yho h ASP 95 Cb 0.56 -0.04 -0.04 0.00 0.68 0.00 0.00 39.33 40.49 1yho h ASP 95 CO 0.03 0.44 0.48 0.00 -1.61 0.00 0.00 179.24 178.58 1yho h ALA 96 N 0.72 1.10 -0.76 -0.78 0.00 -1.39 -2.12 119.26 116.02 1yho h ALA 96 Ca 0.02 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1yho h ALA 96 Cb 0.36 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1yho h ALA 96 CO 0.01 0.60 0.31 -0.07 0.00 0.00 0.00 179.25 180.09 1yho h LEU 97 N 1.19 1.04 -0.71 0.00 3.38 -1.14 -2.33 115.31 116.76 1yho h LEU 97 Ca 0.30 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 1yho h LEU 97 Cb 0.02 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 1yho h LEU 97 CO -0.05 0.92 0.18 0.11 0.09 0.00 0.00 178.44 179.69 1yho h LYS 98 N 1.11 1.13 -0.35 1.13 1.57 -0.89 0.16 116.57 120.43 1yho h LYS 98 Ca 0.26 -0.27 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1yho h LYS 98 Cb 0.20 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1yho h LYS 98 CO -0.02 0.99 0.19 -0.07 -0.57 0.00 0.00 179.45 179.96 1yho h LEU 99 N 1.06 0.44 -0.69 2.94 3.38 -1.06 0.82 115.31 122.21 1yho h LEU 99 Ca 0.22 -0.10 -0.09 0.00 0.09 0.00 0.00 57.88 58.00 1yho h LEU 99 Cb 0.37 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1yho h LEU 99 CO 0.00 0.42 -0.42 0.00 0.09 0.00 0.00 178.44 178.53 1yho h THR 100 N 0.44 0.89 0.00 0.22 1.03 -1.27 -3.08 112.91 111.14 1yho h THR 100 Ca 0.12 -1.73 -0.07 0.00 -0.01 0.00 0.00 66.41 64.72 1yho h THR 100 Cb 0.08 2.07 -0.01 0.00 -1.07 0.00 0.00 68.15 69.21 1yho h THR 100 CO -0.02 0.41 -0.87 -0.33 -0.01 0.00 0.00 175.52 174.71 1yho h GLU 101 N 0.00 0.00 -7.09 0.00 5.08 -0.24 -3.38 114.58 108.95 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 1.04 0.00 0.11 0.00 0.50 0.00 0.00 28.75 30.40 1yho h GLU 101 CO 0.05 0.18 0.49 -0.65 -1.00 0.00 0.00 179.01 178.09 1yho s GLN 102 N -3.13 3.01 0.27 2.33 -1.52 0.28 -4.80 119.66 116.10 1yho s GLN 102 Ca 0.01 1.88 0.03 0.00 -1.95 0.00 0.00 55.36 55.33 1yho s GLN 102 Cb 0.08 -1.98 0.36 0.00 -0.22 0.00 0.00 33.01 31.25 1yho s GLN 102 CO 0.77 -1.19 1.66 -1.00 -0.25 0.00 0.00 175.29 175.28 1yho h PRO 103 N 0.99 0.37 -0.33 2.91 0.13 -1.88 0.47 132.00 134.66 1yho h PRO 103 Ca -0.50 -0.18 0.02 0.00 -0.87 0.00 0.00 66.00 64.47 1yho h PRO 103 Cb 1.30 -0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.41 1yho h PRO 103 CO 0.55 0.71 0.22 0.93 -0.23 0.00 0.00 178.00 180.19 1yho h GLU 104 N 0.31 0.37 0.00 0.86 5.08 -1.92 -2.77 114.58 116.51 1yho h GLU 104 Ca 0.03 -0.02 -0.23 0.00 -1.00 0.00 0.00 59.36 58.14 1yho h GLU 104 Cb 0.84 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.96 1yho h GLU 104 CO 0.07 0.24 -2.14 1.28 -1.00 0.00 0.00 179.01 177.46 1yho n LEU 105 N -4.49 0.00 0.26 1.33 4.32 -1.12 -4.34 117.00 112.95 1yho n LEU 105 Ca 0.02 0.00 0.18 0.00 -0.02 0.00 0.00 56.01 56.20 1yho n LEU 105 Cb 0.12 0.31 0.89 0.00 -1.62 0.00 0.00 43.42 43.12 1yho n LEU 105 CO 0.35 0.31 1.15 0.00 -1.22 0.00 0.00 177.39 177.98 1yho h ALA 106 N 1.17 1.55 -0.03 -1.18 0.00 0.23 0.80 119.26 121.81 1yho h ALA 106 Ca -0.34 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.44 1yho h ALA 106 Cb 1.74 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.52 1yho h ALA 106 CO 0.02 -0.29 -0.55 -0.97 0.00 0.00 0.00 179.25 177.46 1yho h ASN 107 N 0.00 0.09 0.00 0.00 -0.73 -1.72 -3.29 115.58 109.93 1yho h ASN 107 Ca 0.06 -0.05 -0.31 0.00 1.87 0.00 0.00 56.30 57.87 1yho h ASN 107 Cb 0.51 -0.03 -0.06 0.00 0.27 0.00 0.00 38.32 39.01 1yho h ASN 107 CO -0.00 0.63 -2.17 0.29 -0.37 0.00 0.00 177.43 175.81 1yho n LYS 108 N -3.89 1.16 -4.20 6.67 4.76 0.30 -4.97 118.16 118.00 1yho n LYS 108 Ca -0.02 0.01 -0.31 0.00 -2.87 0.00 0.00 58.31 55.12 1yho n LYS 108 Cb 0.57 -1.43 -0.08 0.00 -1.84 0.00 0.00 35.03 32.24 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 -2.41 4.06 0.06 -0.18 1.01 0.25 -2.86 120.40 120.34 1yho s VAL 109 Ca -0.10 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.04 1yho s VAL 109 Cb 0.05 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.55 1yho s VAL 109 CO 0.67 0.22 0.00 -0.67 0.00 0.00 0.00 175.10 175.32 1yho n ASP 110 N 0.89 0.04 -4.86 3.32 2.03 -1.19 -4.20 116.55 112.58 1yho n ASP 110 Ca -0.12 0.11 -0.31 0.00 0.52 0.00 0.00 54.79 54.99 1yho n ASP 110 Cb 0.52 0.06 -0.05 0.00 -0.72 0.00 0.00 41.12 40.93 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 -1.26 3.22 0.07 -0.67 -1.94 -1.26 0.11 119.30 117.57 1yho s MET 111 Ca 0.00 -0.54 0.08 0.00 -1.71 0.00 0.00 55.69 53.52 1yho s MET 111 Cb 0.00 -2.92 -0.04 0.00 2.01 0.00 0.00 34.83 33.89 1yho s MET 111 CO 0.00 0.59 -0.19 0.08 -0.01 0.00 0.00 175.02 175.49 1yho s VAL 112 N -1.46 2.74 -0.09 -6.03 1.01 -0.82 -2.26 120.40 113.48 1yho s VAL 112 Ca 0.33 -1.35 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 1yho s VAL 112 Cb -0.13 -2.19 0.03 0.00 0.00 0.00 0.00 36.38 34.09 1yho s VAL 112 CO 0.26 0.24 -0.04 0.26 0.00 0.00 0.00 175.10 175.81 1yho s TRP 113 N -1.00 1.11 -0.26 5.22 0.52 -0.28 -0.77 118.94 123.47 1yho s TRP 113 Ca 0.16 -0.47 -0.19 0.00 0.02 0.00 0.00 56.10 55.62 1yho s TRP 113 Cb -0.10 -1.02 -0.02 0.00 -1.15 0.00 0.00 33.47 31.18 1yho s TRP 113 CO 0.07 -0.41 0.57 0.42 0.02 0.00 0.00 176.95 177.62 1yho s ILE 114 N 1.73 5.03 -0.51 2.03 1.09 0.64 -0.95 121.20 130.25 1yho s ILE 114 Ca 0.03 0.99 0.02 0.00 -1.10 0.00 0.00 60.65 60.60 1yho s ILE 114 Cb -0.13 -3.88 0.45 0.00 -1.06 0.00 0.00 42.46 37.84 1yho s ILE 114 CO -0.06 0.05 1.67 0.52 -0.10 0.00 0.00 174.94 177.02 1yho n VAL 115 N 5.18 3.15 0.00 2.92 0.31 -0.13 -2.19 118.33 127.57 1yho n VAL 115 Ca -0.02 -3.54 0.00 0.00 -0.01 0.00 0.00 64.34 60.76 1yho n VAL 115 Cb 0.49 -1.16 0.00 0.00 -0.91 0.00 0.00 33.84 32.27 1yho n VAL 115 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1yho n GLY 116 N -0.81 0.27 0.00 2.92 0.00 -1.26 -4.69 105.19 101.61 1yho n GLY 116 Ca 0.54 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1yho n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yho n GLY 117 N 0.39 1.78 0.33 -0.02 0.00 -1.26 -3.04 105.19 103.38 1yho n GLY 117 Ca 0.00 -1.83 -0.05 0.00 0.00 0.00 0.00 46.02 44.13 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 1.04 -0.53 1.61 0.02 -1.99 -2.34 113.55 111.36 1yho h SER 118 Ca 0.00 -0.17 0.04 0.00 -0.84 0.00 0.00 61.79 60.83 1yho h SER 118 Cb 0.00 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.23 1yho h SER 118 CO 0.00 0.93 0.28 0.28 -1.14 0.00 0.00 176.83 177.18 1yho h SER 119 N 1.09 0.41 -0.41 3.07 0.02 -2.00 -0.64 113.55 115.08 1yho h SER 119 Ca 0.25 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 61.16 1yho h SER 119 Cb 0.23 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 1yho h SER 119 CO -0.02 0.28 0.06 0.58 -1.14 0.00 0.00 176.83 176.59 1yho h VAL 120 N 0.54 1.23 -0.49 2.27 2.07 -1.80 -2.51 116.25 117.55 1yho h VAL 120 Ca 0.23 -0.88 -0.05 0.00 0.82 0.00 0.00 66.70 66.82 1yho h VAL 120 Cb 0.12 0.79 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1yho h VAL 120 CO -0.15 0.32 0.10 1.88 0.02 0.00 0.00 177.57 179.73 1yho h TYR 121 N 0.73 0.85 -0.15 1.57 -1.99 -0.79 -1.52 116.97 115.67 1yho h TYR 121 Ca 0.15 -0.11 0.00 0.00 2.00 0.00 0.00 58.73 60.77 1yho h TYR 121 Cb 0.36 -0.24 -0.01 0.00 2.00 0.00 0.00 36.73 38.85 1yho h TYR 121 CO 0.02 0.77 0.10 -0.22 -0.00 0.00 0.00 178.16 178.82 1yho h LYS 122 N 0.68 0.20 -0.87 4.88 3.64 -0.89 0.40 116.57 124.61 1yho h LYS 122 Ca 0.15 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1yho h LYS 122 Cb 0.36 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.10 1yho h LYS 122 CO 0.01 0.14 0.47 0.93 -2.27 0.00 0.00 179.45 178.72 1yho h GLU 123 N 0.20 1.21 -0.07 1.90 4.39 -1.37 -2.50 114.58 118.34 1yho h GLU 123 Ca 0.05 -0.15 -0.15 0.00 0.34 0.00 0.00 59.36 59.46 1yho h GLU 123 Cb -0.02 -0.24 -0.01 0.00 -0.10 0.00 0.00 28.75 28.39 1yho h GLU 123 CO -0.01 0.89 -0.63 0.00 -1.16 0.00 0.00 179.01 178.10 1yho h ALA 124 N 1.25 0.81 -0.00 3.43 0.00 -0.94 -2.95 119.26 120.85 1yho h ALA 124 Ca 0.30 -0.56 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1yho h ALA 124 Cb 0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1yho h ALA 124 CO -0.05 0.74 0.01 0.52 0.00 0.00 0.00 179.25 180.48 1yho h MET 125 N 0.18 0.00 -0.73 0.00 2.86 0.26 0.01 114.93 117.52 1yho h MET 125 Ca -0.01 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.58 1yho h MET 125 Cb 1.15 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.78 1yho h MET 125 CO 0.10 0.00 0.06 -1.71 1.06 0.00 0.00 176.91 176.42 1yho n ASN 126 N -3.19 4.44 -4.72 1.22 5.15 -1.11 -4.94 115.26 112.10 1yho n ASN 126 Ca -0.03 -2.77 -0.41 0.00 -0.60 0.00 0.00 54.58 50.77 1yho n ASN 126 Cb 0.09 -0.66 -0.04 0.00 -0.53 0.00 0.00 39.78 38.64 1yho n ASN 126 CO 0.00 0.00 0.00 -1.00 1.40 0.00 0.00 177.26 177.66 1yho s HIS 127 N -2.34 3.75 0.07 1.20 3.76 -0.01 -4.97 115.29 116.75 1yho s HIS 127 Ca 0.41 1.76 -0.11 0.00 -0.15 0.00 0.00 55.06 56.97 1yho s HIS 127 Cb 0.32 -3.09 -0.26 0.00 1.11 0.00 0.00 32.58 30.66 1yho s HIS 127 CO 0.11 0.09 1.14 -1.00 -0.85 0.00 0.00 174.74 174.23 1yho h PRO 128 N 5.99 0.51 -7.56 8.40 0.13 -1.92 -3.47 132.00 134.08 1yho h PRO 128 Ca -0.42 -0.71 -0.44 0.00 -0.87 0.00 0.00 66.00 63.56 1yho h PRO 128 Cb 1.21 0.24 0.16 0.00 0.13 0.00 0.00 31.00 32.75 1yho h PRO 128 CO 0.73 1.31 0.28 0.20 -0.23 0.00 0.00 178.00 180.28 1yho s GLY 129 N -4.50 1.64 0.31 1.56 0.00 -1.26 -4.63 107.32 100.45 1yho s GLY 129 Ca -0.08 -0.90 -0.29 0.00 0.00 0.00 0.00 44.72 43.46 1yho s GLY 129 CO 0.91 -0.15 1.45 -1.58 0.00 0.00 0.00 173.10 173.73 1yho s HIS 130 N -3.37 2.87 -0.07 1.90 2.46 -1.26 -4.89 115.29 112.93 1yho s HIS 130 Ca 0.70 1.11 -0.09 0.00 0.47 0.00 0.00 55.06 57.25 1yho s HIS 130 Cb -0.09 -3.88 0.02 0.00 -0.13 0.00 0.00 32.58 28.49 1yho s HIS 130 CO 0.54 -2.72 0.24 -1.17 -2.47 0.00 0.00 174.74 169.16 1yho s LEU 131 N -1.17 1.09 -0.17 8.88 0.20 -1.25 -4.54 118.68 121.73 1yho s LEU 131 Ca 0.56 0.35 -0.08 0.00 0.69 0.00 0.00 54.13 55.65 1yho s LEU 131 Cb -0.44 0.88 -0.04 0.00 -0.43 0.00 0.00 46.19 46.16 1yho s LEU 131 CO 0.51 -0.17 0.11 -0.54 -0.29 0.00 0.00 176.35 175.97 1yho s LYS 132 N -0.26 3.85 -0.18 1.98 1.02 -0.90 -1.56 119.74 123.70 1yho s LYS 132 Ca -0.04 -0.23 0.01 0.00 0.02 0.00 0.00 55.97 55.72 1yho s LYS 132 Cb -0.03 -3.27 0.04 0.00 -0.52 0.00 0.00 37.83 34.05 1yho s LYS 132 CO 0.01 0.46 -0.11 -1.17 -0.92 0.00 0.00 175.35 173.62 1yho s LEU 133 N -0.12 2.05 -0.22 3.17 0.20 0.27 0.26 118.68 124.29 1yho s LEU 133 Ca 0.09 -0.76 -0.06 0.00 0.69 0.00 0.00 54.13 54.10 1yho s LEU 133 Cb -0.12 -1.18 -0.03 0.00 -0.43 0.00 0.00 46.19 44.44 1yho s LEU 133 CO 0.00 -0.13 0.02 -0.36 -0.29 0.00 0.00 176.35 175.60 1yho s PHE 134 N 1.45 3.06 -0.04 5.38 0.40 0.28 0.67 117.98 129.18 1yho s PHE 134 Ca 0.01 -0.46 0.05 0.00 -0.60 0.00 0.00 56.93 55.92 1yho s PHE 134 Cb -0.15 -2.13 -0.01 0.00 0.51 0.00 0.00 43.02 41.24 1yho s PHE 134 CO -0.09 -0.28 -0.18 0.14 0.70 0.00 0.00 175.22 175.51 1yho s VAL 135 N 1.19 1.49 -0.27 -0.44 -7.23 -0.79 -1.09 120.40 113.27 1yho s VAL 135 Ca 0.03 -0.76 -0.05 0.00 -1.81 0.00 0.00 61.98 59.39 1yho s VAL 135 Cb -0.14 -1.27 0.01 0.00 0.56 0.00 0.00 36.38 35.53 1yho s VAL 135 CO 0.02 0.43 0.03 -0.89 -0.31 0.00 0.00 175.10 174.38 1yho s THR 136 N -0.06 3.69 -0.26 5.32 2.01 -0.73 -1.67 115.64 123.94 1yho s THR 136 Ca -0.02 -0.68 -0.19 0.00 0.31 0.00 0.00 61.69 61.12 1yho s THR 136 Cb -0.11 -2.85 -0.03 0.00 0.01 0.00 0.00 72.50 69.53 1yho s THR 136 CO 0.02 0.18 0.54 -0.13 -0.69 0.00 0.00 174.62 174.55 1yho s ARG 137 N 1.47 4.08 -0.41 4.92 0.52 -0.61 0.78 118.95 129.69 1yho s ARG 137 Ca 0.03 0.38 -0.18 0.00 -0.52 0.00 0.00 55.73 55.44 1yho s ARG 137 Cb -0.16 -3.65 0.02 0.00 0.52 0.00 0.00 34.95 31.67 1yho s ARG 137 CO 0.00 -0.37 0.49 0.42 0.02 0.00 0.00 175.30 175.87 1yho s ILE 138 N 2.36 5.02 -1.17 1.52 -1.09 0.16 -0.95 121.20 127.05 1yho s ILE 138 Ca 0.22 -0.12 -0.20 0.00 -2.23 0.00 0.00 60.65 58.32 1yho s ILE 138 Cb -0.16 -4.06 -0.04 0.00 -1.58 0.00 0.00 42.46 36.62 1yho s ILE 138 CO 0.09 -0.42 1.91 0.80 -1.23 0.00 0.00 174.94 176.09 1yho n MET 139 N 5.77 2.16 -3.64 2.79 1.56 -0.04 -0.87 117.12 124.84 1yho n MET 139 Ca -0.06 -2.60 -0.05 0.00 -0.27 0.00 0.00 57.70 54.73 1yho n MET 139 Cb 0.48 -3.47 -0.07 0.00 2.15 0.00 0.00 33.22 32.31 1yho n MET 139 CO 0.00 0.00 0.00 -1.14 -0.73 0.00 0.00 175.97 174.10 1yho s GLN 140 N 5.24 0.39 -0.15 2.12 0.74 -1.26 -4.41 119.66 122.33 1yho s GLN 140 Ca 0.60 0.55 -0.29 0.00 0.05 0.00 0.00 55.36 56.27 1yho s GLN 140 Cb 0.05 0.14 -0.03 0.00 1.10 0.00 0.00 33.01 34.27 1yho s GLN 140 CO 0.10 -0.06 1.47 -0.51 -0.55 0.00 0.00 175.29 175.74 1yho s ASP 141 N 0.73 6.72 0.03 6.67 1.11 -1.26 -4.17 116.67 126.51 1yho s ASP 141 Ca -0.02 1.84 -0.04 0.00 0.18 0.00 0.00 52.55 54.51 1yho s ASP 141 Cb -0.04 -2.54 -0.02 0.00 1.07 0.00 0.00 42.92 41.40 1yho s ASP 141 CO -0.11 -0.94 0.06 -0.36 1.18 0.00 0.00 175.17 175.00 1yho s PHE 142 N 4.07 0.24 0.03 4.23 0.08 -1.26 -5.12 117.98 120.25 1yho s PHE 142 Ca 0.65 -0.54 -0.25 0.00 0.12 0.00 0.00 56.93 56.90 1yho s PHE 142 Cb -0.26 -0.17 -0.05 0.00 -0.57 0.00 0.00 43.02 41.96 1yho s PHE 142 CO 0.23 -0.32 0.76 -2.00 -0.10 0.00 0.00 175.22 173.79 1yho s GLU 143 N -2.41 4.49 0.01 0.44 2.12 -1.26 -4.87 118.70 117.22 1yho s GLU 143 Ca -0.07 1.05 -0.03 0.00 0.36 0.00 0.00 54.97 56.28 1yho s GLU 143 Cb -0.03 -3.38 -0.01 0.00 0.26 0.00 0.00 34.13 30.98 1yho s GLU 143 CO -0.04 0.25 0.04 -1.12 -0.54 0.00 0.00 175.26 173.85 1yho s SER 144 N 0.08 0.12 -0.27 -1.70 0.01 -1.26 -4.59 113.70 106.10 1yho s SER 144 Ca 0.39 -0.31 -0.04 0.00 1.31 0.00 0.00 55.95 57.29 1yho s SER 144 Cb -0.20 0.14 -0.15 0.00 0.21 0.00 0.00 66.02 66.02 1yho s SER 144 CO 0.22 -0.29 -0.27 0.47 0.41 0.00 0.00 173.24 173.79 1yho n ASP 145 N 1.73 1.97 -4.62 2.44 9.92 -1.06 -4.90 116.55 122.03 1yho n ASP 145 Ca -0.22 0.05 -0.40 0.00 -0.53 0.00 0.00 54.79 53.70 1yho n ASP 145 Cb 0.56 -0.58 -0.08 0.00 -0.64 0.00 0.00 41.12 40.38 1yho n ASP 145 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1yho s THR 146 N -2.52 5.09 -0.08 -3.53 2.01 -0.85 -5.04 115.64 110.72 1yho s THR 146 Ca -0.36 0.85 -0.09 0.00 0.31 0.00 0.00 61.69 62.39 1yho s THR 146 Cb 0.11 -3.81 -0.05 0.00 0.01 0.00 0.00 72.50 68.77 1yho s THR 146 CO 0.56 0.11 0.23 -0.36 -0.69 0.00 0.00 174.62 174.47 1yho s PHE 147 N 2.17 3.64 -0.17 4.92 0.08 -1.26 -1.99 117.98 125.36 1yho s PHE 147 Ca 0.21 0.68 -0.22 0.00 0.12 0.00 0.00 56.93 57.71 1yho s PHE 147 Cb -0.16 -2.05 -0.02 0.00 -0.57 0.00 0.00 43.02 40.22 1yho s PHE 147 CO 0.09 0.71 0.68 0.12 -0.10 0.00 0.00 175.22 176.72 1yho s PHE 148 N -1.03 3.42 0.58 0.36 5.36 0.10 -4.94 117.98 121.83 1yho s PHE 148 Ca 0.18 1.05 -0.19 0.00 -0.96 0.00 0.00 56.93 57.01 1yho s PHE 148 Cb -0.13 -2.84 -0.06 0.00 -0.34 0.00 0.00 43.02 39.64 1yho s PHE 148 CO 0.07 -0.15 0.88 -2.30 -1.46 0.00 0.00 175.22 172.27 1yho n PRO 149 N 4.89 0.85 -2.42 10.12 -0.02 -1.26 -4.92 135.00 142.25 1yho n PRO 149 Ca -0.00 0.33 -0.42 0.00 -2.02 0.00 0.00 63.50 61.39 1yho n PRO 149 Cb 0.50 -2.07 -0.03 0.00 -0.02 0.00 0.00 33.50 31.88 1yho n PRO 149 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1yho s GLU 150 N -2.57 4.45 0.16 -0.52 2.12 -1.26 -5.01 118.70 116.08 1yho s GLU 150 Ca 0.73 1.79 -0.28 0.00 0.36 0.00 0.00 54.97 57.57 1yho s GLU 150 Cb -0.43 -3.32 -0.07 0.00 0.26 0.00 0.00 34.13 30.56 1yho s GLU 150 CO 0.49 -0.21 0.88 0.42 -0.54 0.00 0.00 175.26 176.30 1yho s ILE 151 N 0.79 4.34 -0.04 -3.70 1.01 -1.26 -5.04 121.20 117.29 1yho s ILE 151 Ca 0.57 1.92 -0.21 0.00 0.00 0.00 0.00 60.65 62.93 1yho s ILE 151 Cb -0.30 -4.25 -0.05 0.00 0.01 0.00 0.00 42.46 37.87 1yho s ILE 151 CO 0.31 0.45 0.61 -1.81 0.00 0.00 0.00 174.94 174.49 1yho s ASP 152 N -0.75 6.92 0.33 3.58 1.01 -1.26 -4.96 116.67 121.54 1yho s ASP 152 Ca 0.41 1.11 0.16 0.00 0.71 0.00 0.00 52.55 54.93 1yho s ASP 152 Cb -0.24 -2.36 0.49 0.00 1.01 0.00 0.00 42.92 41.82 1yho s ASP 152 CO 0.29 0.02 1.65 0.25 0.21 0.00 0.00 175.17 177.59 1yho h LEU 153 N 6.18 0.00 -1.40 1.23 7.12 -1.97 0.33 115.31 126.80 1yho h LEU 153 Ca -0.43 0.00 -0.06 0.00 0.13 0.00 0.00 57.88 57.52 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 0.72 0.48 -0.22 -0.33 -0.13 0.00 0.00 178.44 178.97 1yho h GLU 154 N 0.00 0.12 0.00 1.25 5.08 -2.02 -3.25 114.58 115.77 1yho h GLU 154 Ca -0.00 -0.03 -0.35 0.00 -1.00 0.00 0.00 59.36 57.97 1yho h GLU 154 Cb 1.04 -0.01 -0.06 0.00 0.50 0.00 0.00 28.75 30.21 1yho h GLU 154 CO 0.06 0.34 -2.33 1.63 -1.00 0.00 0.00 179.01 177.71 1yho n LYS 155 N -4.23 0.64 -4.03 2.33 4.76 -1.15 -4.98 118.16 111.50 1yho n LYS 155 Ca -0.01 0.12 -0.31 0.00 -2.87 0.00 0.00 58.31 55.24 1yho n LYS 155 Cb 0.31 -1.47 -0.06 0.00 -1.84 0.00 0.00 35.03 31.96 1yho n LYS 155 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1yho s TYR 156 N -2.47 3.26 -0.25 2.13 1.51 0.11 -2.17 117.35 119.48 1yho s TYR 156 Ca -0.29 0.12 -0.06 0.00 -1.01 0.00 0.00 57.07 55.83 1yho s TYR 156 Cb 0.08 -1.66 -0.01 0.00 -0.11 0.00 0.00 41.96 40.26 1yho s TYR 156 CO 0.57 0.54 0.03 0.21 -1.11 0.00 0.00 175.55 175.79 1yho s LYS 157 N -2.34 3.43 -0.22 -0.62 2.20 0.26 -4.12 119.74 118.34 1yho s LYS 157 Ca 0.30 -0.61 -0.29 0.00 -0.36 0.00 0.00 55.97 55.00 1yho s LYS 157 Cb -0.12 -3.22 -0.03 0.00 -1.51 0.00 0.00 37.83 32.95 1yho s LYS 157 CO 0.22 -0.25 1.63 -1.17 -0.36 0.00 0.00 175.35 175.43 1yho s LEU 158 N 1.54 3.88 -0.60 5.43 0.20 -1.26 -2.16 118.68 125.71 1yho s LEU 158 Ca 0.05 1.62 -0.00 0.00 0.69 0.00 0.00 54.13 56.49 1yho s LEU 158 Cb -0.15 -3.53 0.15 0.00 -0.43 0.00 0.00 46.19 42.23 1yho s LEU 158 CO 0.01 -1.28 0.39 -0.76 -0.29 0.00 0.00 176.35 174.42 1yho s LEU 159 N 5.28 4.93 0.07 -0.68 1.43 0.16 -4.98 118.68 124.89 1yho s LEU 159 Ca 0.72 -2.94 -0.34 0.00 -1.03 0.00 0.00 54.13 50.54 1yho s LEU 159 Cb -0.25 -1.78 -0.18 0.00 0.03 0.00 0.00 46.19 44.01 1yho s LEU 159 CO 0.30 -0.32 1.53 -0.65 0.23 0.00 0.00 176.35 177.44 1yho h PRO 160 N 6.81 -1.05 -4.67 1.29 0.11 -1.93 -2.04 132.00 130.52 1yho h PRO 160 Ca -0.03 0.07 -0.70 0.00 0.11 0.00 0.00 66.00 65.45 1yho h PRO 160 Cb 0.93 0.24 -0.27 0.00 0.11 0.00 0.00 31.00 32.00 1yho h PRO 160 CO 0.70 -0.70 -0.59 -1.21 -0.21 0.00 0.00 178.00 176.00 1yho s GLU 161 N -5.72 2.72 -0.09 1.05 2.02 -1.26 -4.50 118.70 112.92 1yho s GLU 161 Ca -0.18 -1.12 0.04 0.00 0.02 0.00 0.00 54.97 53.73 1yho s GLU 161 Cb 0.03 -3.52 -0.01 0.00 0.10 0.00 0.00 34.13 30.74 1yho s GLU 161 CO 0.56 -0.65 -0.21 -0.47 0.02 0.00 0.00 175.26 174.51 1yho s TYR 162 N 1.45 2.57 0.29 1.61 6.14 -1.26 -5.10 117.35 123.06 1yho s TYR 162 Ca -0.00 -0.77 -0.29 0.00 0.64 0.00 0.00 57.07 56.64 1yho s TYR 162 Cb -0.19 -1.69 -0.13 0.00 0.42 0.00 0.00 41.96 40.37 1yho s TYR 162 CO 0.04 -0.25 1.28 -2.30 0.64 0.00 0.00 175.55 174.95 1yho n PRO 163 N 3.20 1.93 0.00 4.97 -0.02 -1.26 -2.12 135.00 141.70 1yho n PRO 163 Ca -0.18 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 61.98 1yho n PRO 163 Cb 0.52 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1yho n PRO 163 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1yho n GLY 164 N 1.34 2.74 3.84 -1.23 0.00 -1.26 -5.01 105.19 105.60 1yho n GLY 164 Ca 0.08 -0.41 -0.35 0.00 0.00 0.00 0.00 46.02 45.34 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 -1.39 5.19 0.31 1.61 0.11 -0.90 -5.08 120.40 120.25 1yho s VAL 165 Ca 0.00 -0.03 -0.29 0.00 -2.93 0.00 0.00 61.98 58.74 1yho s VAL 165 Cb 0.00 -3.30 -0.10 0.00 -1.53 0.00 0.00 36.38 31.45 1yho s VAL 165 CO 0.00 0.52 1.13 -0.76 -3.33 0.00 0.00 175.10 172.66 1yho s LEU 166 N -1.29 4.47 -0.11 2.54 1.43 -1.26 -4.54 118.68 119.92 1yho s LEU 166 Ca 0.18 2.32 0.14 0.00 -1.03 0.00 0.00 54.13 55.75 1yho s LEU 166 Cb -0.12 -3.71 -0.20 0.00 0.03 0.00 0.00 46.19 42.19 1yho s LEU 166 CO 0.08 -0.27 0.14 -0.24 0.23 0.00 0.00 176.35 176.28 1yho n SER 167 N 0.93 1.30 -4.77 2.29 2.88 -1.26 -4.53 113.62 110.46 1yho n SER 167 Ca -0.00 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.13 1yho n SER 167 Cb 0.45 1.11 -0.01 0.00 -0.75 0.00 0.00 64.21 65.01 1yho n SER 167 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1yho s ASP 168 N -4.57 6.52 -0.00 -3.46 -1.08 -1.26 -4.52 116.67 108.30 1yho s ASP 168 Ca -0.07 2.88 -0.30 0.00 -0.52 0.00 0.00 52.55 54.54 1yho s ASP 168 Cb 0.06 -2.65 -0.06 0.00 -1.46 0.00 0.00 42.92 38.81 1yho s ASP 168 CO 0.63 -0.75 1.47 -0.69 0.52 0.00 0.00 175.17 176.35 1yho s VAL 169 N -0.91 3.60 0.60 1.11 1.01 -1.26 -4.72 120.40 119.83 1yho s VAL 169 Ca 0.53 0.97 -0.06 0.00 0.00 0.00 0.00 61.98 63.42 1yho s VAL 169 Cb -0.44 -3.62 0.02 0.00 0.00 0.00 0.00 36.38 32.34 1yho s VAL 169 CO 0.56 -0.01 0.91 -1.10 0.00 0.00 0.00 175.10 175.46 1yho s GLN 170 N 2.65 2.83 -0.12 2.72 1.11 -0.50 -4.86 119.66 123.49 1yho s GLN 170 Ca 0.66 -0.05 -0.05 0.00 0.01 0.00 0.00 55.36 55.94 1yho s GLN 170 Cb -0.33 -2.26 0.06 0.00 -1.01 0.00 0.00 33.01 29.47 1yho s GLN 170 CO 0.27 -0.77 0.25 -2.00 0.01 0.00 0.00 175.29 173.05 1yho s GLU 171 N -5.02 0.16 -0.06 2.91 2.12 -1.26 -2.01 118.70 115.54 1yho s GLU 171 Ca 0.55 0.66 -0.03 0.00 0.36 0.00 0.00 54.97 56.52 1yho s GLU 171 Cb -0.11 -0.08 0.04 0.00 0.26 0.00 0.00 34.13 34.24 1yho s GLU 171 CO 0.45 -0.25 0.13 -2.00 -0.54 0.00 0.00 175.26 173.05 1yho s GLU 172 N 2.04 0.04 -1.67 4.30 -6.30 -0.48 -4.84 118.70 111.78 1yho s GLU 172 Ca -0.02 0.40 -0.02 0.00 -2.50 0.00 0.00 54.97 52.84 1yho s GLU 172 Cb -0.11 -0.25 0.00 0.00 0.00 0.00 0.00 34.13 33.77 1yho s GLU 172 CO -0.08 -0.22 0.18 1.17 0.02 0.00 0.00 175.26 176.33 1yho n LYS 173 N 4.64 -2.67 -1.04 4.30 4.81 -1.26 -1.03 118.16 125.91 1yho n LYS 173 Ca -0.18 0.95 -0.01 0.00 -0.87 0.00 0.00 58.31 58.19 1yho n LYS 173 Cb 0.51 -5.67 -0.01 0.00 0.02 0.00 0.00 35.03 29.88 1yho n LYS 173 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1yho n GLY 174 N -1.15 0.49 3.19 3.14 0.00 -1.26 -5.02 105.19 104.58 1yho n GLY 174 Ca -0.20 -0.83 -0.34 0.00 0.00 0.00 0.00 46.02 44.64 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 2.85 -0.09 -0.61 1.01 -0.19 -5.10 121.20 117.03 1yho s ILE 175 Ca 0.00 -1.06 -0.07 0.00 0.00 0.00 0.00 60.65 59.52 1yho s ILE 175 Cb 0.00 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 1yho s ILE 175 CO 0.00 0.18 0.17 -1.59 0.00 0.00 0.00 174.94 173.70 1yho s LYS 176 N 1.31 3.48 0.02 2.79 -2.85 -1.26 -1.38 119.74 121.86 1yho s LYS 176 Ca -0.00 -0.11 -0.19 0.00 -1.00 0.00 0.00 55.97 54.66 1yho s LYS 176 Cb -0.17 -3.17 0.04 0.00 -2.06 0.00 0.00 37.83 32.47 1yho s LYS 176 CO -0.04 0.75 0.43 1.52 0.10 0.00 0.00 175.35 178.11 1yho s TYR 177 N -1.09 -0.31 0.11 1.78 1.13 -0.85 -0.86 117.35 117.25 1yho s TYR 177 Ca 0.18 0.36 0.09 0.00 -1.41 0.00 0.00 57.07 56.29 1yho s TYR 177 Cb -0.13 0.23 -0.04 0.00 -1.10 0.00 0.00 41.96 40.93 1yho s TYR 177 CO 0.08 -0.55 -0.19 -1.59 -2.51 0.00 0.00 175.55 170.78 1yho s LYS 178 N -2.14 1.76 -0.23 -3.49 -2.85 -0.12 -1.40 119.74 111.26 1yho s LYS 178 Ca -0.07 -1.18 -0.10 0.00 -1.00 0.00 0.00 55.97 53.62 1yho s LYS 178 Cb -0.01 -2.09 -0.05 0.00 -2.06 0.00 0.00 37.83 33.62 1yho s LYS 178 CO 0.00 0.48 0.13 0.12 0.10 0.00 0.00 175.35 176.19 1yho s PHE 179 N -1.10 3.28 0.03 1.78 2.19 -1.26 -1.58 117.98 121.31 1yho s PHE 179 Ca 0.17 0.12 0.08 0.00 0.33 0.00 0.00 56.93 57.63 1yho s PHE 179 Cb -0.10 -2.23 -0.02 0.00 -1.31 0.00 0.00 43.02 39.35 1yho s PHE 179 CO 0.09 0.03 -0.24 -1.21 1.83 0.00 0.00 175.22 175.72 1yho s GLU 180 N 0.99 1.73 -0.09 10.12 2.02 -0.67 -4.79 118.70 128.02 1yho s GLU 180 Ca 0.06 -1.00 0.02 0.00 0.02 0.00 0.00 54.97 54.08 1yho s GLU 180 Cb -0.13 -1.83 -0.02 0.00 0.10 0.00 0.00 34.13 32.25 1yho s GLU 180 CO 0.04 0.48 -0.15 0.08 0.02 0.00 0.00 175.26 175.72 1yho s VAL 181 N -0.74 2.93 -0.06 2.63 1.01 -0.77 -1.88 120.40 123.52 1yho s VAL 181 Ca 0.10 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.37 1yho s VAL 181 Cb -0.09 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 34.12 1yho s VAL 181 CO 0.01 0.56 -0.13 -0.31 0.00 0.00 0.00 175.10 175.23 1yho s TYR 182 N -0.18 1.49 0.02 5.22 1.51 0.21 0.37 117.35 126.00 1yho s TYR 182 Ca -0.01 -0.52 0.07 0.00 -1.01 0.00 0.00 57.07 55.61 1yho s TYR 182 Cb -0.13 -1.07 -0.03 0.00 -0.11 0.00 0.00 41.96 40.62 1yho s TYR 182 CO 0.03 -0.25 -0.21 -1.21 -1.11 0.00 0.00 175.55 172.81 1yho s GLU 183 N 0.52 2.05 -0.23 -0.62 2.02 -0.92 0.96 118.70 122.48 1yho s GLU 183 Ca -0.12 -0.98 -0.10 0.00 0.02 0.00 0.00 54.97 53.79 1yho s GLU 183 Cb -0.15 -2.14 -0.05 0.00 0.10 0.00 0.00 34.13 31.90 1yho s GLU 183 CO 0.03 0.54 0.14 0.21 0.02 0.00 0.00 175.26 176.21 1yho s LYS 184 N -1.21 4.02 -0.05 1.61 2.36 -0.60 0.93 119.74 126.79 1yho s LYS 184 Ca 0.13 -0.30 -0.02 0.00 -2.55 0.00 0.00 55.97 53.23 1yho s LYS 184 Cb -0.10 -3.48 -0.04 0.00 -1.05 0.00 0.00 37.83 33.16 1yho s LYS 184 CO 0.03 0.07 0.04 1.21 1.55 0.00 0.00 175.35 178.25 1yho s ASN 185 N 1.02 5.51 0.00 1.43 2.47 -0.92 -3.83 114.94 120.62 1yho s ASN 185 Ca 0.07 0.17 0.00 0.00 0.42 0.00 0.00 52.86 53.52 1yho s ASN 185 Cb -0.14 -1.58 0.00 0.00 -1.45 0.00 0.00 41.25 38.08 1yho s ASN 185 CO 0.04 0.34 0.00 0.47 -3.72 0.00 0.00 177.10 174.23