#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hvy n PRO 27 N 0.00 1.28 -1.70 0.52 -0.02 -1.26 -4.85 135.00 128.98 1hvy n PRO 27 Ca 0.00 0.47 -0.44 0.00 -2.02 0.00 0.00 63.50 61.51 1hvy n PRO 27 Cb 0.00 -2.17 -0.04 0.00 -0.02 0.00 0.00 33.50 31.28 1hvy n PRO 27 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1hvy n HIS 28 N 5.16 2.55 0.27 6.00 -0.00 -1.26 -4.85 115.22 123.09 1hvy n HIS 28 Ca 0.25 0.12 0.15 0.00 0.46 0.00 0.00 57.72 58.70 1hvy n HIS 28 Cb 0.16 -2.63 0.87 0.00 -0.12 0.00 0.00 29.99 28.27 1hvy n HIS 28 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 1hvy h GLY 29 N 6.58 0.00 2.00 1.57 0.00 -1.95 -0.80 103.07 110.47 1hvy h GLY 29 Ca -0.44 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1hvy h GLY 29 CO 0.93 0.00 -0.07 -2.09 0.00 0.00 0.00 176.54 175.31 1hvy h GLU 30 N 0.00 0.00 0.00 4.80 4.81 -1.97 -1.26 114.58 120.96 1hvy h GLU 30 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 1hvy h GLU 30 Cb 0.16 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.54 1hvy h GLU 30 CO -0.00 0.07 0.00 -0.07 -0.73 0.00 0.00 179.01 178.28 1hvy h LEU 31 N 0.00 0.00 0.48 1.64 3.38 -1.51 -2.24 115.31 117.06 1hvy h LEU 31 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1hvy h LEU 31 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1hvy h LEU 31 CO 0.01 0.00 -0.23 1.56 0.09 0.00 0.00 178.44 179.87 1hvy h GLN 32 N 0.00 -0.62 -0.26 1.13 1.08 -1.39 -0.57 115.11 114.48 1hvy h GLN 32 Ca 0.00 0.04 -0.00 0.00 -1.45 0.00 0.00 58.65 57.24 1hvy h GLN 32 Cb 0.18 0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.74 1hvy h GLN 32 CO 0.00 -0.32 0.15 -0.92 -0.95 0.00 0.00 178.83 176.79 1hvy h TYR 33 N -0.89 0.34 -0.75 2.96 5.03 -1.59 -1.95 116.97 120.13 1hvy h TYR 33 Ca -0.07 -0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.22 1hvy h TYR 33 Cb 0.59 -0.11 -0.04 0.00 1.55 0.00 0.00 36.73 38.72 1hvy h TYR 33 CO 0.00 0.27 0.37 -0.07 -1.32 0.00 0.00 178.16 177.41 1hvy h LEU 34 N 0.31 0.96 -1.11 2.82 3.38 -1.47 -1.80 115.31 118.41 1hvy h LEU 34 Ca 0.09 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1hvy h LEU 34 Cb 0.03 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1hvy h LEU 34 CO -0.02 0.80 0.38 1.23 0.09 0.00 0.00 178.44 180.92 1hvy h GLY 35 N 1.10 1.07 0.99 0.83 0.00 -0.70 -0.82 103.07 105.54 1hvy h GLY 35 Ca 0.26 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 47.02 1hvy h GLY 35 CO -0.03 0.47 -0.06 1.46 0.00 0.00 0.00 176.54 178.37 1hvy h GLN 36 N 1.00 0.81 -0.46 4.80 4.20 -0.66 -0.60 115.11 124.20 1hvy h GLN 36 Ca 0.25 -0.29 0.02 0.00 0.06 0.00 0.00 58.65 58.69 1hvy h GLN 36 Cb 0.05 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 27.74 1hvy h GLN 36 CO -0.04 0.90 0.28 0.82 -0.67 0.00 0.00 178.83 180.12 1hvy h ILE 37 N 0.64 1.06 -0.72 2.54 1.08 -0.79 0.06 117.51 121.38 1hvy h ILE 37 Ca 0.12 -0.19 -0.05 0.00 -0.39 0.00 0.00 64.86 64.35 1hvy h ILE 37 Cb 0.58 0.45 -0.03 0.00 -3.07 0.00 0.00 36.82 34.74 1hvy h ILE 37 CO 0.03 0.10 0.26 1.56 -0.69 0.00 0.00 178.15 179.41 1hvy h GLN 38 N 0.56 1.09 -0.51 2.37 4.20 -1.01 -1.39 115.11 120.43 1hvy h GLN 38 Ca 0.18 -0.22 -0.04 0.00 0.06 0.00 0.00 58.65 58.64 1hvy h GLN 38 Cb 0.00 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 1hvy h GLN 38 CO -0.08 0.92 0.15 1.25 -0.67 0.00 0.00 178.83 180.40 1hvy h HIS 39 N 1.04 0.82 -0.11 2.96 2.76 -0.54 -2.32 115.15 119.76 1hvy h HIS 39 Ca 0.24 -0.09 -0.09 0.00 -2.20 0.00 0.00 60.37 58.23 1hvy h HIS 39 Cb 0.25 -0.24 -0.01 0.00 1.55 0.00 0.00 27.41 28.96 1hvy h HIS 39 CO 0.02 0.72 -0.32 0.82 -1.30 0.00 0.00 177.93 177.87 1hvy h ILE 40 N 0.69 1.27 -0.23 6.26 2.04 -0.76 -2.99 117.51 123.79 1hvy h ILE 40 Ca 0.16 -1.27 -0.16 0.00 1.00 0.00 0.00 64.86 64.60 1hvy h ILE 40 Cb 0.29 1.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 1hvy h ILE 40 CO -0.00 0.38 -0.50 -0.07 0.00 0.00 0.00 178.15 177.95 1hvy h LEU 41 N 0.18 0.71 -3.52 1.44 3.38 -1.01 0.52 115.31 117.01 1hvy h LEU 41 Ca 0.02 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.63 1hvy h LEU 41 Cb 0.66 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1hvy h LEU 41 CO 0.05 1.09 0.00 -2.11 0.09 0.00 0.00 178.44 177.56 1hvy n ARG 42 N -3.99 4.63 -0.92 1.13 1.85 -0.90 -5.06 116.66 113.41 1hvy n ARG 42 Ca -0.03 -3.12 0.00 0.00 -1.00 0.00 0.00 57.85 53.70 1hvy n ARG 42 Cb 0.59 -2.21 -0.00 0.00 -1.05 0.00 0.00 32.46 29.79 1hvy n ARG 42 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1hvy n GLY 44 N 0.49 -0.27 3.68 2.89 0.00 0.17 -5.08 105.19 107.06 1hvy n GLY 44 Ca 0.27 -0.06 -0.29 0.00 0.00 0.00 0.00 46.02 45.94 1hvy n GLY 44 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1hvy s VAL 45 N -4.33 3.91 0.16 1.61 -7.23 -0.48 -4.67 120.40 109.38 1hvy s VAL 45 Ca 0.00 -1.12 -0.31 0.00 -1.81 0.00 0.00 61.98 58.74 1hvy s VAL 45 Cb 0.00 -2.89 -0.11 0.00 0.56 0.00 0.00 36.38 33.94 1hvy s VAL 45 CO 0.00 0.05 1.76 -0.60 -0.31 0.00 0.00 175.10 176.00 1hvy s ARG 46 N -2.49 4.14 -0.09 4.82 3.52 -1.26 0.03 118.95 127.62 1hvy s ARG 46 Ca 0.26 2.57 -0.04 0.00 -0.13 0.00 0.00 55.73 58.40 1hvy s ARG 46 Cb -0.11 -3.33 0.05 0.00 -1.56 0.00 0.00 34.95 30.00 1hvy s ARG 46 CO 0.18 -0.78 0.18 0.21 -0.81 0.00 0.00 175.30 174.28 1hvy s LYS 47 N 1.93 0.09 0.86 5.12 2.20 0.34 -4.88 119.74 125.39 1hvy s LYS 47 Ca 0.77 0.53 -0.11 0.00 -0.36 0.00 0.00 55.97 56.80 1hvy s LYS 47 Cb -0.47 -0.19 0.11 0.00 -1.51 0.00 0.00 37.83 35.76 1hvy s LYS 47 CO 0.34 -0.24 1.09 -0.51 -0.36 0.00 0.00 175.35 175.67 1hvy s ASP 48 N 1.84 3.82 0.17 1.43 -0.00 -1.26 -0.98 116.67 121.70 1hvy s ASP 48 Ca -0.02 1.54 -0.12 0.00 -0.00 0.00 0.00 52.55 53.95 1hvy s ASP 48 Cb -0.12 -2.23 0.01 0.00 -0.00 0.00 0.00 42.92 40.58 1hvy s ASP 48 CO -0.07 -2.43 0.37 1.51 -0.00 0.00 0.00 175.17 174.56 1hvy s ASP 49 N -3.47 -0.07 0.44 0.27 -4.77 -1.26 -4.83 116.67 102.98 1hvy s ASP 49 Ca 0.63 -0.70 0.27 0.00 -3.30 0.00 0.00 52.55 49.44 1hvy s ASP 49 Cb -0.17 0.48 1.33 0.00 -1.09 0.00 0.00 42.92 43.46 1hvy s ASP 49 CO 0.56 -0.94 1.69 -0.09 0.70 0.00 0.00 175.17 177.10 1hvy h ARG 50 N 2.43 0.18 -0.00 2.11 2.43 -2.02 0.26 114.38 119.77 1hvy h ARG 50 Ca -0.31 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 1hvy h ARG 50 Cb 1.24 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 1hvy h ARG 50 CO 0.45 0.12 -0.05 0.25 -1.51 0.00 0.00 179.97 179.23 1hvy n THR 51 N -4.60 0.00 -0.82 0.20 -2.24 -1.26 -4.90 114.28 100.66 1hvy n THR 51 Ca 0.32 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 62.08 1hvy n THR 51 Cb 1.23 -0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.12 1hvy n THR 51 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hvy n GLY 52 N 1.27 0.50 0.18 3.38 0.00 0.91 -4.47 105.19 106.96 1hvy n GLY 52 Ca 0.15 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.98 1hvy n GLY 52 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1hvy h THR 53 N 0.00 1.31 0.00 2.61 2.02 -1.87 -3.47 112.91 113.51 1hvy h THR 53 Ca 0.00 -2.34 0.00 0.00 0.77 0.00 0.00 66.41 64.84 1hvy h THR 53 Cb 0.08 2.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.94 1hvy h THR 53 CO 0.00 0.72 0.00 0.61 0.37 0.00 0.00 175.52 177.22 1hvy n GLY 54 N 1.10 0.74 3.53 2.16 0.00 -1.26 -4.61 105.19 106.85 1hvy n GLY 54 Ca -0.10 -1.60 -0.09 0.00 0.00 0.00 0.00 46.02 44.22 1hvy n GLY 54 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hvy s THR 55 N -2.52 0.01 -0.20 2.61 -4.23 -0.15 -2.26 115.64 108.91 1hvy s THR 55 Ca 0.00 -1.35 -0.04 0.00 -1.18 0.00 0.00 61.69 59.11 1hvy s THR 55 Cb 0.00 -2.09 -0.02 0.00 1.34 0.00 0.00 72.50 71.73 1hvy s THR 55 CO 0.00 -0.06 -0.03 -0.76 -0.54 0.00 0.00 174.62 173.23 1hvy s LEU 56 N -3.00 3.10 0.09 4.79 1.43 -0.80 -0.50 118.68 123.78 1hvy s LEU 56 Ca 0.21 -0.27 0.06 0.00 -1.03 0.00 0.00 54.13 53.10 1hvy s LEU 56 Cb 0.00 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.41 1hvy s LEU 56 CO 0.06 0.05 -0.17 -0.55 0.23 0.00 0.00 176.35 175.98 1hvy s SER 57 N 1.06 2.03 -0.02 2.29 0.15 0.10 -1.79 113.70 117.52 1hvy s SER 57 Ca 0.01 -0.66 0.01 0.00 0.70 0.00 0.00 55.95 56.02 1hvy s SER 57 Cb -0.15 -0.08 0.01 0.00 -1.71 0.00 0.00 66.02 64.09 1hvy s SER 57 CO 0.01 -0.03 -0.04 -0.69 1.20 0.00 0.00 173.24 173.69 1hvy s VAL 58 N -1.31 0.38 -0.23 4.45 1.01 -0.51 -1.38 120.40 122.81 1hvy s VAL 58 Ca 0.02 -0.15 -0.07 0.00 0.00 0.00 0.00 61.98 61.79 1hvy s VAL 58 Cb -0.10 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.89 1hvy s VAL 58 CO 0.03 0.14 0.05 0.12 0.00 0.00 0.00 175.10 175.44 1hvy s PHE 59 N 0.26 3.08 0.00 5.22 2.19 -1.26 -0.75 117.98 126.72 1hvy s PHE 59 Ca -0.03 -0.42 0.00 0.00 0.33 0.00 0.00 56.93 56.81 1hvy s PHE 59 Cb -0.06 -2.19 0.00 0.00 -1.31 0.00 0.00 43.02 39.46 1hvy s PHE 59 CO -0.00 -0.31 0.00 0.41 1.83 0.00 0.00 175.22 177.14 1hvy n GLY 60 N 4.70 -1.12 3.19 13.12 0.00 -0.28 -5.02 105.19 119.79 1hvy n GLY 60 Ca -0.16 -0.67 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 1hvy n GLY 60 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1hvy s MET 61 N -0.63 0.79 -0.19 1.61 -1.94 -1.02 -4.99 119.30 112.93 1hvy s MET 61 Ca 0.00 -0.85 -0.14 0.00 -1.71 0.00 0.00 55.69 52.99 1hvy s MET 61 Cb 0.00 0.32 0.05 0.00 2.01 0.00 0.00 34.83 37.22 1hvy s MET 61 CO 0.00 -0.24 0.48 -1.14 -0.01 0.00 0.00 175.02 174.11 1hvy s GLN 62 N -3.42 0.52 0.02 2.03 0.74 -1.26 -1.07 119.66 117.22 1hvy s GLN 62 Ca 0.02 0.78 0.01 0.00 0.05 0.00 0.00 55.36 56.21 1hvy s GLN 62 Cb 0.03 0.15 -0.02 0.00 1.10 0.00 0.00 33.01 34.27 1hvy s GLN 62 CO -0.09 -0.11 -0.05 0.00 -0.55 0.00 0.00 175.29 174.49 1hvy s ALA 63 N 0.82 0.39 -0.13 1.58 0.00 0.01 -4.98 121.76 119.45 1hvy s ALA 63 Ca -0.05 -0.55 0.03 0.00 0.00 0.00 0.00 51.96 51.39 1hvy s ALA 63 Cb -0.05 0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.11 1hvy s ALA 63 CO -0.06 -0.03 -0.22 0.50 0.00 0.00 0.00 175.76 175.95 1hvy s ARG 64 N -1.12 3.06 -0.21 0.00 3.52 -1.26 0.60 118.95 123.54 1hvy s ARG 64 Ca -0.08 -0.85 -0.02 0.00 -0.13 0.00 0.00 55.73 54.65 1hvy s ARG 64 Cb -0.08 -2.42 0.00 0.00 -1.56 0.00 0.00 34.95 30.89 1hvy s ARG 64 CO -0.00 0.04 -0.10 0.71 -0.81 0.00 0.00 175.30 175.14 1hvy s TYR 65 N 0.68 2.89 0.38 5.12 2.02 0.25 -4.97 117.35 123.73 1hvy s TYR 65 Ca -0.10 -1.20 -0.27 0.00 -0.37 0.00 0.00 57.07 55.13 1hvy s TYR 65 Cb -0.16 -2.04 -0.09 0.00 -0.40 0.00 0.00 41.96 39.27 1hvy s TYR 65 CO 0.01 -0.64 1.30 0.45 -1.57 0.00 0.00 175.55 175.10 1hvy s SER 66 N 1.41 6.45 0.00 2.29 0.15 -1.26 -1.21 113.70 121.53 1hvy s SER 66 Ca 0.05 2.65 0.08 0.00 0.70 0.00 0.00 55.95 59.43 1hvy s SER 66 Cb -0.14 -2.64 0.16 0.00 -1.71 0.00 0.00 66.02 61.69 1hvy s SER 66 CO -0.07 -0.75 1.02 0.18 1.20 0.00 0.00 173.24 174.82 1hvy n LEU 67 N 0.31 2.28 -4.61 3.45 4.77 0.33 -4.63 117.00 118.91 1hvy n LEU 67 Ca 0.03 -1.64 -0.43 0.00 -0.03 0.00 0.00 56.01 53.94 1hvy n LEU 67 Cb 0.43 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.40 1hvy n LEU 67 CO 0.56 0.54 1.04 -0.13 -1.33 0.00 0.00 177.39 178.08 1hvy s ARG 68 N -0.87 3.77 -1.97 3.23 0.52 -1.24 -3.80 118.95 118.58 1hvy s ARG 68 Ca 0.14 0.70 0.00 0.00 -0.52 0.00 0.00 55.73 56.05 1hvy s ARG 68 Cb 0.08 -3.89 0.00 0.00 0.52 0.00 0.00 34.95 31.65 1hvy s ARG 68 CO 0.11 -1.32 0.00 -0.25 0.02 0.00 0.00 175.30 173.85 1hvy n ASP 69 N 7.80 -5.75 -3.53 0.23 8.00 -1.26 -4.94 116.55 117.11 1hvy n ASP 69 Ca 0.13 0.21 -0.09 0.00 0.71 0.00 0.00 54.79 55.75 1hvy n ASP 69 Cb 0.49 -4.90 -0.02 0.00 -0.02 0.00 0.00 41.12 36.67 1hvy n ASP 69 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1hvy s GLU 70 N -4.51 1.05 -0.09 -1.24 -1.05 -1.25 -4.91 118.70 106.70 1hvy s GLU 70 Ca 0.00 -0.43 0.01 0.00 -0.15 0.00 0.00 54.97 54.40 1hvy s GLU 70 Cb 0.00 0.46 0.02 0.00 -0.44 0.00 0.00 34.13 34.17 1hvy s GLU 70 CO 0.00 -0.47 -0.10 0.12 0.95 0.00 0.00 175.26 175.77 1hvy s PHE 71 N -3.37 1.46 -0.90 4.83 2.19 0.15 -4.55 117.98 117.80 1hvy s PHE 71 Ca 0.05 -0.65 -0.17 0.00 0.33 0.00 0.00 56.93 56.49 1hvy s PHE 71 Cb -0.01 -1.15 -0.11 0.00 -1.31 0.00 0.00 43.02 40.44 1hvy s PHE 71 CO -0.08 -0.41 2.03 -0.35 1.83 0.00 0.00 175.22 178.24 1hvy n PRO 72 N 4.45 1.85 -3.52 10.12 -0.04 -1.26 -3.72 135.00 142.88 1hvy n PRO 72 Ca -0.17 -1.83 -0.41 0.00 -0.04 0.00 0.00 63.50 61.04 1hvy n PRO 72 Cb 0.51 -2.83 -0.11 0.00 -0.04 0.00 0.00 33.50 31.03 1hvy n PRO 72 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1hvy s LEU 73 N 0.97 4.70 0.27 1.53 2.96 -1.26 -4.36 118.68 123.48 1hvy s LEU 73 Ca 0.52 -0.64 -0.29 0.00 -0.22 0.00 0.00 54.13 53.50 1hvy s LEU 73 Cb 0.13 -2.12 -0.14 0.00 0.50 0.00 0.00 46.19 44.56 1hvy s LEU 73 CO 0.05 -0.32 1.08 0.18 -1.32 0.00 0.00 176.35 176.02 1hvy n LEU 74 N 5.10 1.96 -0.00 -0.68 4.77 -1.26 -4.66 117.00 122.24 1hvy n LEU 74 Ca -0.12 1.17 0.07 0.00 -0.03 0.00 0.00 56.01 57.11 1hvy n LEU 74 Cb 0.48 -1.30 -0.10 0.00 -2.33 0.00 0.00 43.42 40.17 1hvy n LEU 74 CO 0.38 -1.26 -0.43 0.35 -1.33 0.00 0.00 177.39 175.10 1hvy n THR 75 N 0.52 0.00 0.73 -5.08 -2.24 -1.26 -4.36 114.28 102.59 1hvy n THR 75 Ca 0.10 -0.27 0.07 0.00 -2.27 0.00 0.00 64.05 61.68 1hvy n THR 75 Cb 0.31 0.49 0.38 0.00 -2.10 0.00 0.00 70.33 69.41 1hvy n THR 75 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1hvy n THR 76 N -1.75 0.49 -3.49 4.28 -2.24 -1.26 -0.18 114.28 110.13 1hvy n THR 76 Ca -0.01 0.12 -0.14 0.00 -2.27 0.00 0.00 64.05 61.76 1hvy n THR 76 Cb 0.33 -0.88 -0.04 0.00 -2.10 0.00 0.00 70.33 67.64 1hvy n THR 76 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1hvy s LYS 77 N -2.48 1.16 -0.29 -0.78 -2.85 -1.26 -4.57 119.74 108.67 1hvy s LYS 77 Ca 0.15 -0.29 -0.27 0.00 -1.00 0.00 0.00 55.97 54.57 1hvy s LYS 77 Cb 0.10 0.53 0.01 0.00 -2.06 0.00 0.00 37.83 36.41 1hvy s LYS 77 CO 0.21 -0.46 0.95 0.50 0.10 0.00 0.00 175.35 176.65 1hvy s ARG 78 N -2.94 4.07 0.09 1.78 3.52 -1.14 -4.61 118.95 119.73 1hvy s ARG 78 Ca -0.03 0.94 -0.20 0.00 -0.13 0.00 0.00 55.73 56.31 1hvy s ARG 78 Cb -0.00 -3.71 -0.07 0.00 -1.56 0.00 0.00 34.95 29.61 1hvy s ARG 78 CO -0.06 -0.74 0.59 0.08 -0.81 0.00 0.00 175.30 174.36 1hvy s VAL 79 N 3.26 4.70 -1.00 7.11 1.01 -1.26 -4.70 120.40 129.53 1hvy s VAL 79 Ca 0.40 1.25 -0.21 0.00 0.00 0.00 0.00 61.98 63.41 1hvy s VAL 79 Cb -0.14 -3.91 -0.11 0.00 0.00 0.00 0.00 36.38 32.23 1hvy s VAL 79 CO 0.12 0.53 1.94 0.33 0.00 0.00 0.00 175.10 178.02 1hvy n PHE 80 N 1.64 2.47 -0.32 5.22 7.35 -1.26 -4.77 117.46 127.79 1hvy n PHE 80 Ca -0.09 -1.84 0.02 0.00 -0.76 0.00 0.00 57.45 54.77 1hvy n PHE 80 Cb 0.51 -2.14 0.15 0.00 0.35 0.00 0.00 39.48 38.35 1hvy n PHE 80 CO 0.00 0.00 0.00 2.35 -0.76 0.00 0.00 176.76 178.35 1hvy h TRP 81 N 8.35 1.02 -0.75 -5.13 2.91 -1.99 -1.46 115.95 118.89 1hvy h TRP 81 Ca 0.37 0.03 0.04 0.00 1.13 0.00 0.00 58.89 60.46 1hvy h TRP 81 Cb 0.77 -0.33 -0.04 0.00 -0.51 0.00 0.00 29.16 29.05 1hvy h TRP 81 CO 1.26 0.50 0.50 -0.22 -1.03 0.00 0.00 178.44 179.45 1hvy h LYS 82 N 0.99 0.85 -0.28 2.65 3.64 -2.00 -0.40 116.57 122.02 1hvy h LYS 82 Ca 0.39 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.67 1hvy h LYS 82 Cb 0.20 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1hvy h LYS 82 CO -0.18 0.56 -0.03 0.78 -2.27 0.00 0.00 179.45 178.31 1hvy h GLY 83 N 0.88 0.57 0.56 5.01 0.00 -1.68 -0.92 103.07 107.48 1hvy h GLY 83 Ca 0.31 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 47.20 1hvy h GLY 83 CO -0.10 0.40 -0.40 -2.08 0.00 0.00 0.00 176.54 174.37 1hvy h VAL 84 N 0.30 0.20 0.03 4.60 2.07 -0.65 0.13 116.25 122.92 1hvy h VAL 84 Ca 0.08 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.61 1hvy h VAL 84 Cb 0.48 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1hvy h VAL 84 CO 0.02 0.00 -0.13 0.25 0.02 0.00 0.00 177.57 177.73 1hvy h LEU 85 N -0.79 -0.36 -0.88 2.57 5.85 -1.12 -2.18 115.31 118.40 1hvy h LEU 85 Ca -0.03 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 1hvy h LEU 85 Cb 0.72 0.15 -0.04 0.00 0.37 0.00 0.00 40.66 41.86 1hvy h LEU 85 CO -0.08 -0.18 0.41 -0.08 -0.34 0.00 0.00 178.44 178.17 1hvy h GLU 86 N -0.23 1.22 -0.54 1.25 4.57 -1.10 -1.83 114.58 117.92 1hvy h GLU 86 Ca 0.03 -0.17 -0.00 0.00 -1.18 0.00 0.00 59.36 58.04 1hvy h GLU 86 Cb 0.27 -0.22 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 1hvy h GLU 86 CO -0.10 0.93 0.33 1.49 -1.18 0.00 0.00 179.01 180.48 1hvy h GLU 87 N 1.21 0.73 -0.34 1.92 4.81 -0.50 -1.68 114.58 120.73 1hvy h GLU 87 Ca 0.29 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.43 1hvy h GLU 87 Cb 0.11 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1hvy h GLU 87 CO -0.04 0.52 0.10 1.25 -0.73 0.00 0.00 179.01 180.10 1hvy h LEU 88 N 0.73 0.50 -1.49 1.64 5.85 -1.03 -0.75 115.31 120.76 1hvy h LEU 88 Ca 0.19 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.70 1hvy h LEU 88 Cb -0.03 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 1hvy h LEU 88 CO -0.04 0.59 0.29 -0.07 -0.34 0.00 0.00 178.44 178.86 1hvy h LEU 89 N 0.39 0.55 -0.59 2.25 3.38 -1.22 -1.08 115.31 119.00 1hvy h LEU 89 Ca 0.11 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1hvy h LEU 89 Cb 0.27 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1hvy h LEU 89 CO -0.00 0.42 0.05 -0.25 0.09 0.00 0.00 178.44 178.75 1hvy h TRP 90 N 0.64 1.09 0.05 1.13 7.01 -0.80 -2.13 115.95 122.95 1hvy h TRP 90 Ca 0.17 -0.17 -0.00 0.00 2.11 0.00 0.00 58.89 61.00 1hvy h TRP 90 Cb -0.03 -0.29 0.00 0.00 -2.10 0.00 0.00 29.16 26.74 1hvy h TRP 90 CO 0.00 0.96 -0.02 0.74 -2.79 0.00 0.00 178.44 177.33 1hvy h PHE 91 N 0.91 -0.06 -0.64 2.65 0.04 -0.38 -2.80 116.94 116.66 1hvy h PHE 91 Ca 0.17 -0.00 0.15 0.00 2.80 0.00 0.00 57.97 61.09 1hvy h PHE 91 Cb 0.49 0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.63 1hvy h PHE 91 CO 0.04 0.17 0.44 0.82 -0.60 0.00 0.00 178.31 179.17 1hvy h ILE 92 N -0.28 0.77 0.00 -0.55 2.04 -1.07 0.65 117.51 119.07 1hvy h ILE 92 Ca -0.01 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 65.79 1hvy h ILE 92 Cb 0.25 0.55 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1hvy h ILE 92 CO 0.01 0.04 0.00 0.29 0.00 0.00 0.00 178.15 178.49 1hvy n LYS 93 N -4.42 0.13 -1.11 2.37 5.02 -0.81 -4.87 118.16 114.46 1hvy n LYS 93 Ca 0.12 0.09 -0.03 0.00 -2.02 0.00 0.00 58.31 56.46 1hvy n LYS 93 Cb 0.57 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.06 1hvy n LYS 93 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1hvy n GLY 94 N 0.82 0.63 3.78 0.72 0.00 0.23 -5.01 105.19 106.36 1hvy n GLY 94 Ca 0.08 -0.92 -0.37 0.00 0.00 0.00 0.00 46.02 44.81 1hvy n GLY 94 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1hvy s SER 95 N -2.96 7.22 -0.04 1.61 0.15 -1.07 -3.92 113.70 114.69 1hvy s SER 95 Ca 0.00 1.90 0.05 0.00 0.70 0.00 0.00 55.95 58.60 1hvy s SER 95 Cb 0.00 -2.58 0.08 0.00 -1.71 0.00 0.00 66.02 61.81 1hvy s SER 95 CO 0.00 -0.16 0.94 0.35 1.20 0.00 0.00 173.24 175.57 1hvy n THR 96 N 0.46 0.90 -3.51 6.45 -2.24 -1.26 -4.05 114.28 111.02 1hvy n THR 96 Ca 0.02 -1.00 -0.42 0.00 -2.27 0.00 0.00 64.05 60.39 1hvy n THR 96 Cb 0.50 0.40 -0.10 0.00 -2.10 0.00 0.00 70.33 69.02 1hvy n THR 96 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1hvy s ASN 97 N -1.31 5.98 0.57 3.42 3.04 -1.26 -1.19 114.94 124.19 1hvy s ASN 97 Ca 0.09 -0.86 0.25 0.00 0.04 0.00 0.00 52.86 52.37 1hvy s ASN 97 Cb 0.08 -2.11 1.62 0.00 -1.54 0.00 0.00 41.25 39.29 1hvy s ASN 97 CO 0.01 -0.40 2.19 0.00 -3.04 0.00 0.00 177.10 175.86 1hvy h ALA 98 N 8.55 1.75 -0.19 1.71 0.00 -0.95 -1.67 119.26 128.46 1hvy h ALA 98 Ca -0.27 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 1hvy h ALA 98 Cb 1.12 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1hvy h ALA 98 CO 0.70 -0.07 -0.16 0.87 0.00 0.00 0.00 179.25 180.58 1hvy h LYS 99 N 0.00 0.32 0.00 0.00 1.57 -1.91 -0.78 116.57 115.77 1hvy h LYS 99 Ca 0.02 -0.09 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 1hvy h LYS 99 Cb 0.12 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.38 1hvy h LYS 99 CO -0.00 0.49 -0.18 0.93 -0.57 0.00 0.00 179.45 180.11 1hvy h GLU 100 N 0.30 0.00 0.08 3.15 5.08 -1.68 -1.77 114.58 119.73 1hvy h GLU 100 Ca 0.06 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.08 1hvy h GLU 100 Cb 0.47 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 1hvy h GLU 100 CO 0.03 0.18 -1.85 1.25 -1.00 0.00 0.00 179.01 177.62 1hvy h LEU 101 N 0.00 0.25 -1.21 1.33 5.85 -1.55 -3.36 115.31 116.61 1hvy h LEU 101 Ca -0.00 -0.55 -0.01 0.00 0.84 0.00 0.00 57.88 58.16 1hvy h LEU 101 Cb 0.60 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 1hvy h LEU 101 CO 0.02 1.49 0.37 -1.28 -0.34 0.00 0.00 178.44 178.71 1hvy h SER 102 N 0.04 0.81 0.29 1.25 0.87 -0.85 -1.50 113.55 114.47 1hvy h SER 102 Ca -0.36 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 1hvy h SER 102 Cb 2.03 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 63.78 1hvy h SER 102 CO 0.09 0.65 0.00 0.77 -0.53 0.00 0.00 176.83 177.81 1hvy h SER 103 N 0.92 0.00 0.09 6.23 4.64 -1.48 0.54 113.55 124.50 1hvy h SER 103 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1hvy h SER 103 Cb 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 1hvy h SER 103 CO -0.04 0.00 -0.10 0.29 -0.87 0.00 0.00 176.83 176.11 1hvy n LYS 104 N -2.52 1.34 -0.40 4.77 4.76 -0.57 -4.92 118.16 120.62 1hvy n LYS 104 Ca -0.01 -0.78 0.00 0.00 -2.87 0.00 0.00 58.31 54.65 1hvy n LYS 104 Cb 0.12 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.83 1hvy n LYS 104 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1hvy n GLY 105 N 1.24 0.77 2.99 0.72 0.00 0.18 -5.06 105.19 106.04 1hvy n GLY 105 Ca 0.16 -0.28 -0.31 0.00 0.00 0.00 0.00 46.02 45.59 1hvy n GLY 105 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hvy s VAL 106 N -2.00 1.80 -1.22 1.61 0.11 -1.19 -5.00 120.40 114.50 1hvy s VAL 106 Ca 0.00 -1.40 0.18 0.00 -2.93 0.00 0.00 61.98 57.83 1hvy s VAL 106 Cb 0.00 -2.00 0.70 0.00 -1.53 0.00 0.00 36.38 33.55 1hvy s VAL 106 CO 0.00 -0.07 1.60 2.29 -3.33 0.00 0.00 175.10 175.59 1hvy n LYS 107 N 4.57 3.60 -0.16 1.54 0.00 -1.26 -3.10 118.16 123.34 1hvy n LYS 107 Ca -0.13 -2.77 0.28 0.00 -0.00 0.00 0.00 58.31 55.69 1hvy n LYS 107 Cb 0.43 -1.86 0.72 0.00 -0.00 0.00 0.00 35.03 34.32 1hvy n LYS 107 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 177.40 176.56 1hvy h ILE 108 N 4.02 0.54 -0.13 0.58 3.07 -1.95 -1.41 117.51 122.23 1hvy h ILE 108 Ca 0.00 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.41 1hvy h ILE 108 Cb 1.39 0.56 0.00 0.00 -0.27 0.00 0.00 36.82 38.50 1hvy h ILE 108 CO 0.21 0.00 0.00 0.79 -1.05 0.00 0.00 178.15 178.10 1hvy n TRP 109 N -4.23 0.15 -0.05 0.16 7.02 -1.26 -4.68 117.44 114.55 1hvy n TRP 109 Ca 0.18 -0.12 -0.09 0.00 -1.02 0.00 0.00 57.50 56.45 1hvy n TRP 109 Cb 0.94 -0.00 -0.03 0.00 -2.42 0.00 0.00 31.31 29.80 1hvy n TRP 109 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 1hvy h ASP 110 N 3.03 0.16 -0.64 -0.99 3.32 -1.55 -2.87 116.42 116.87 1hvy h ASP 110 Ca 0.00 0.01 0.04 0.00 0.02 0.00 0.00 57.03 57.10 1hvy h ASP 110 Cb 0.69 -0.02 -0.05 0.00 0.22 0.00 0.00 39.33 40.17 1hvy h ASP 110 CO 0.00 0.12 0.38 0.00 -1.72 0.00 0.00 179.24 178.02 1hvy h ALA 111 N 1.10 0.85 0.00 3.45 0.00 -1.83 0.34 119.26 123.16 1hvy h ALA 111 Ca 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1hvy h ALA 111 Cb 0.02 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1hvy h ALA 111 CO -0.05 0.09 0.00 0.09 0.00 0.00 0.00 179.25 179.38 1hvy n ASN 112 N -4.75 0.00 -0.22 0.00 4.13 -1.10 -1.55 115.26 111.77 1hvy n ASN 112 Ca 0.07 0.48 0.03 0.00 1.68 0.00 0.00 54.58 56.84 1hvy n ASN 112 Cb 0.12 -0.49 0.02 0.00 -1.54 0.00 0.00 39.78 37.90 1hvy n ASN 112 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1hvy n GLY 113 N -0.90 -0.70 3.73 7.41 0.00 -0.00 -4.68 105.19 110.05 1hvy n GLY 113 Ca 0.01 -0.18 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 1hvy n GLY 113 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1hvy s SER 114 N -0.63 4.57 0.21 1.61 1.04 -0.53 -1.27 113.70 118.70 1hvy s SER 114 Ca 0.07 2.37 -0.10 0.00 0.48 0.00 0.00 55.95 58.77 1hvy s SER 114 Cb 0.05 -2.59 0.30 0.00 0.10 0.00 0.00 66.02 63.88 1hvy s SER 114 CO 0.09 -2.01 1.70 -0.09 0.98 0.00 0.00 173.24 173.91 1hvy h ARG 115 N 0.13 0.22 0.14 4.02 9.65 -1.92 -1.09 114.38 125.53 1hvy h ARG 115 Ca -0.49 -0.01 0.01 0.00 -1.10 0.00 0.00 59.98 58.39 1hvy h ARG 115 Cb 1.30 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 29.81 1hvy h ARG 115 CO 0.52 0.15 -0.16 -0.44 2.80 0.00 0.00 179.97 182.84 1hvy h ASP 116 N 0.23 -0.42 -0.58 -3.80 3.45 -1.93 -0.81 116.42 112.57 1hvy h ASP 116 Ca 0.32 0.04 -0.04 0.00 0.43 0.00 0.00 57.03 57.78 1hvy h ASP 116 Cb 0.49 0.15 -0.03 0.00 -0.56 0.00 0.00 39.33 39.38 1hvy h ASP 116 CO -0.43 -0.24 0.21 0.15 -1.57 0.00 0.00 179.24 177.36 1hvy h PHE 117 N -0.33 0.94 -0.52 4.55 3.57 -1.73 0.30 116.94 123.71 1hvy h PHE 117 Ca 0.01 -0.07 -0.06 0.00 3.53 0.00 0.00 57.97 61.38 1hvy h PHE 117 Cb 0.33 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 1hvy h PHE 117 CO -0.14 0.74 0.08 -0.07 -2.23 0.00 0.00 178.31 176.69 1hvy h LEU 118 N 0.89 0.83 -0.74 0.59 3.38 -0.98 -2.83 115.31 116.46 1hvy h LEU 118 Ca 0.20 -0.26 -0.13 0.00 0.09 0.00 0.00 57.88 57.78 1hvy h LEU 118 Cb 0.23 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1hvy h LEU 118 CO -0.01 0.88 -0.45 0.44 0.09 0.00 0.00 178.44 179.40 1hvy h ASP 119 N 0.75 0.45 0.24 -0.43 3.32 -0.78 0.15 116.42 120.13 1hvy h ASP 119 Ca 0.16 -0.21 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1hvy h ASP 119 Cb 0.41 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1hvy h ASP 119 CO 0.01 0.84 0.00 -1.54 -1.72 0.00 0.00 179.24 176.83 1hvy n SER 120 N -4.00 0.00 -0.21 6.45 3.41 0.06 -0.70 113.62 118.63 1hvy n SER 120 Ca -0.02 0.31 0.04 0.00 -0.26 0.00 0.00 58.87 58.94 1hvy n SER 120 Cb 0.53 -0.38 0.01 0.00 -0.26 0.00 0.00 64.21 64.10 1hvy n SER 120 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1hvy n LEU 121 N -1.38 1.18 0.00 1.04 4.77 -0.94 -4.99 117.00 116.68 1hvy n LEU 121 Ca 0.03 -0.81 0.00 0.00 -0.03 0.00 0.00 56.01 55.21 1hvy n LEU 121 Cb 0.09 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1hvy n LEU 121 CO 0.08 0.24 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 1hvy n GLY 122 N 0.74 0.72 2.40 -0.72 0.00 0.12 -4.97 105.19 103.48 1hvy n GLY 122 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.75 1hvy n GLY 122 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1hvy n PHE 123 N -2.11 1.76 0.18 1.61 3.72 0.49 -4.59 117.46 118.53 1hvy n PHE 123 Ca 0.00 -2.26 0.03 0.00 -0.05 0.00 0.00 57.45 55.17 1hvy n PHE 123 Cb 0.00 -1.65 0.33 0.00 -0.94 0.00 0.00 39.48 37.22 1hvy n PHE 123 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1hvy h SER 124 N 3.68 0.00 0.82 4.37 4.64 -1.87 -2.70 113.55 122.50 1hvy h SER 124 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1hvy h SER 124 Cb 0.66 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.75 1hvy h SER 124 CO 1.06 0.42 -0.05 0.35 -0.87 0.00 0.00 176.83 177.74 1hvy n THR 125 N -3.89 0.00 -3.14 2.95 -2.24 -1.26 -4.83 114.28 101.86 1hvy n THR 125 Ca -0.01 -0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.38 1hvy n THR 125 Cb 0.47 -0.42 -0.06 0.00 -2.10 0.00 0.00 70.33 68.22 1hvy n THR 125 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1hvy s ARG 126 N -2.87 4.32 0.52 -0.78 3.52 -1.02 -5.05 118.95 117.60 1hvy s ARG 126 Ca 0.18 0.89 -0.20 0.00 -0.13 0.00 0.00 55.73 56.47 1hvy s ARG 126 Cb 0.19 -3.14 -0.06 0.00 -1.56 0.00 0.00 34.95 30.37 1hvy s ARG 126 CO 0.52 0.55 1.13 -1.21 -0.81 0.00 0.00 175.30 175.49 1hvy s GLU 127 N -1.37 3.46 0.23 5.12 0.41 -1.26 -4.95 118.70 120.33 1hvy s GLU 127 Ca 0.35 1.63 -0.32 0.00 -0.41 0.00 0.00 54.97 56.22 1hvy s GLU 127 Cb -0.20 -2.09 -0.12 0.00 -1.78 0.00 0.00 34.13 29.94 1hvy s GLU 127 CO 0.22 -0.77 1.62 -1.91 -0.49 0.00 0.00 175.26 173.93 1hvy n GLU 128 N -1.13 2.55 0.00 1.61 2.13 -1.26 -1.78 120.64 122.76 1hvy n GLU 128 Ca 0.11 0.91 0.00 0.00 0.66 0.00 0.00 57.16 58.84 1hvy n GLU 128 Cb 0.50 -2.70 0.00 0.00 0.27 0.00 0.00 31.44 29.51 1hvy n GLU 128 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1hvy n GLY 129 N 3.10 1.25 3.54 8.31 0.00 -0.39 -4.90 105.19 116.10 1hvy n GLY 129 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1hvy n GLY 129 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hvy s ASP 130 N -1.91 6.22 0.00 1.61 3.68 -0.73 -0.25 116.67 125.29 1hvy s ASP 130 Ca 0.00 -0.43 0.27 0.00 2.13 0.00 0.00 52.55 54.53 1hvy s ASP 130 Cb 0.00 -2.53 1.45 0.00 -1.45 0.00 0.00 42.92 40.38 1hvy s ASP 130 CO 0.00 -1.70 1.95 0.18 0.13 0.00 0.00 175.17 175.73 1hvy n LEU 131 N 8.91 0.00 0.00 -1.34 4.77 -0.33 -4.92 117.00 124.09 1hvy n LEU 131 Ca 0.03 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1hvy n LEU 131 Cb 0.48 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1hvy n LEU 131 CO 0.70 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 1hvy n GLY 132 N 0.94 -2.06 3.11 -0.72 0.00 -1.26 -2.39 105.19 102.81 1hvy n GLY 132 Ca 0.15 -1.59 -0.39 0.00 0.00 0.00 0.00 46.02 44.19 1hvy n GLY 132 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1hvy n PRO 133 N -0.06 1.18 -0.37 1.61 -0.02 -1.26 -4.82 135.00 131.26 1hvy n PRO 133 Ca 0.00 -1.54 0.00 0.00 -2.02 0.00 0.00 63.50 59.94 1hvy n PRO 133 Cb 0.00 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 30.76 1hvy n PRO 133 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 1hvy n VAL 134 N 5.92 0.00 -0.28 -1.45 0.24 -1.26 -4.58 118.33 116.92 1hvy n VAL 134 Ca 0.46 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.68 1hvy n VAL 134 Cb 0.35 -1.55 -0.07 0.00 -1.47 0.00 0.00 33.84 31.11 1hvy n VAL 134 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 1hvy n TYR 135 N -1.25 -0.30 -0.27 6.34 4.01 -1.26 -0.67 117.16 123.76 1hvy n TYR 135 Ca 0.00 0.84 0.08 0.00 -0.16 0.00 0.00 57.90 58.66 1hvy n TYR 135 Cb 0.00 -0.54 0.20 0.00 -0.31 0.00 0.00 39.34 38.69 1hvy n TYR 135 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 1hvy h GLY 136 N 0.00 1.03 0.92 2.72 0.00 -1.75 0.38 103.07 106.37 1hvy h GLY 136 Ca 0.11 0.05 -0.12 0.00 0.00 0.00 0.00 47.33 47.36 1hvy h GLY 136 CO -0.63 -0.31 -0.35 -2.75 0.00 0.00 0.00 176.54 172.50 1hvy h PHE 137 N 0.15 0.75 -0.37 5.60 3.57 -1.02 -2.77 116.94 122.86 1hvy h PHE 137 Ca 0.46 -0.26 -0.07 0.00 3.53 0.00 0.00 57.97 61.63 1hvy h PHE 137 Cb 0.85 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 1hvy h PHE 137 CO -0.36 1.00 -0.05 1.96 -2.23 0.00 0.00 178.31 178.64 1hvy h GLN 138 N 0.29 0.69 -0.72 1.11 1.08 -0.07 0.40 115.11 117.89 1hvy h GLN 138 Ca 0.01 -0.24 -0.03 0.00 -1.45 0.00 0.00 58.65 56.94 1hvy h GLN 138 Cb 0.94 -0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 28.29 1hvy h GLN 138 CO 0.08 0.82 0.32 -1.49 -0.95 0.00 0.00 178.83 177.61 1hvy h TRP 139 N 0.50 1.06 0.00 2.96 4.06 -0.37 -2.82 115.95 121.35 1hvy h TRP 139 Ca 0.10 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.99 1hvy h TRP 139 Cb 0.54 -0.32 0.00 0.00 -1.00 0.00 0.00 29.16 28.37 1hvy h TRP 139 CO 0.04 0.80 -1.64 0.54 -3.56 0.00 0.00 178.44 174.63 1hvy n ARG 140 N -4.39 0.62 -2.79 0.49 5.12 -1.04 -1.21 116.66 113.46 1hvy n ARG 140 Ca 0.06 -0.13 -0.00 0.00 -1.93 0.00 0.00 57.85 55.84 1hvy n ARG 140 Cb 0.15 -1.45 0.06 0.00 -1.16 0.00 0.00 32.46 30.06 1hvy n ARG 140 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 1hvy n HIS 141 N -1.99 0.94 -1.64 -1.55 8.25 0.14 -3.40 115.22 115.97 1hvy n HIS 141 Ca -0.02 -2.06 -0.49 0.00 -0.26 0.00 0.00 57.72 54.89 1hvy n HIS 141 Cb 0.46 -0.07 -0.05 0.00 1.12 0.00 0.00 29.99 31.45 1hvy n HIS 141 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1hvy n PHE 142 N -0.66 1.95 -0.01 4.41 7.35 -0.77 -1.57 117.46 128.15 1hvy n PHE 142 Ca 0.05 0.42 0.00 0.00 -0.76 0.00 0.00 57.45 57.16 1hvy n PHE 142 Cb 0.81 -2.46 0.00 0.00 0.35 0.00 0.00 39.48 38.19 1hvy n PHE 142 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1hvy n GLY 143 N 3.09 1.36 3.82 7.13 0.00 -1.26 -0.46 105.19 118.87 1hvy n GLY 143 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 1hvy n GLY 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1hvy s ALA 144 N -2.47 2.56 -0.35 4.61 0.00 -0.61 -4.84 121.76 120.64 1hvy s ALA 144 Ca 0.00 -0.00 -0.25 0.00 0.00 0.00 0.00 51.96 51.71 1hvy s ALA 144 Cb 0.00 -3.15 0.01 0.00 0.00 0.00 0.00 23.12 19.98 1hvy s ALA 144 CO 0.00 -1.37 0.88 -1.21 0.00 0.00 0.00 175.76 174.06 1hvy s GLU 145 N -5.08 3.85 0.04 0.00 0.41 -1.26 -5.01 118.70 111.65 1hvy s GLU 145 Ca 0.59 0.55 -0.30 0.00 -0.41 0.00 0.00 54.97 55.39 1hvy s GLU 145 Cb -0.14 -3.79 -0.05 0.00 -1.78 0.00 0.00 34.13 28.37 1hvy s GLU 145 CO 0.55 -0.88 1.18 -0.47 -0.49 0.00 0.00 175.26 175.15 1hvy s TYR 146 N 3.32 3.43 0.00 1.61 5.04 -1.26 -4.94 117.35 124.54 1hvy s TYR 146 Ca 0.36 1.32 0.00 0.00 -2.44 0.00 0.00 57.07 56.31 1hvy s TYR 146 Cb -0.13 -3.40 0.00 0.00 0.35 0.00 0.00 41.96 38.79 1hvy s TYR 146 CO 0.17 -1.18 0.00 0.54 -1.34 0.00 0.00 175.55 173.74 1hvy n ARG 147 N 4.07 0.00 -4.03 4.97 3.00 -1.26 -5.09 116.66 118.32 1hvy n ARG 147 Ca 0.09 0.00 -0.10 0.00 -0.01 0.00 0.00 57.85 57.83 1hvy n ARG 147 Cb 0.47 -0.04 -0.07 0.00 0.00 0.00 0.00 32.46 32.82 1hvy n ARG 147 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.63 177.79 1hvy s ASP 148 N -0.82 -0.01 0.23 0.55 1.47 -1.26 -5.04 116.67 111.79 1hvy s ASP 148 Ca 0.00 -1.01 0.14 0.00 1.18 0.00 0.00 52.55 52.87 1hvy s ASP 148 Cb 0.00 0.51 0.78 0.00 -0.34 0.00 0.00 42.92 43.87 1hvy s ASP 148 CO 0.00 -1.02 1.42 1.15 0.68 0.00 0.00 175.17 177.40 1hvy n MET 149 N -0.32 0.09 0.00 2.11 0.00 -1.26 -1.84 117.12 115.90 1hvy n MET 149 Ca -0.02 0.58 0.09 0.00 0.00 0.00 0.00 57.70 58.35 1hvy n MET 149 Cb 0.63 -1.85 -0.10 0.00 0.00 0.00 0.00 33.22 31.90 1hvy n MET 149 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1hvy n GLU 150 N -2.00 0.64 -1.35 3.17 -0.58 -1.26 -4.73 120.64 114.53 1hvy n GLU 150 Ca -0.01 -0.08 -0.34 0.00 -0.42 0.00 0.00 57.16 56.31 1hvy n GLU 150 Cb 0.06 -1.42 0.10 0.00 -0.57 0.00 0.00 31.44 29.62 1hvy n GLU 150 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 1hvy s SER 151 N -2.79 4.09 -0.40 1.62 0.01 -0.77 -4.99 113.70 110.47 1hvy s SER 151 Ca 0.08 2.29 -0.15 0.00 1.31 0.00 0.00 55.95 59.49 1hvy s SER 151 Cb 0.15 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.81 1hvy s SER 151 CO 0.78 -2.33 0.30 -0.62 0.41 0.00 0.00 173.24 171.77 1hvy s ASP 152 N -2.20 6.11 -0.27 2.44 2.15 -1.26 -4.94 116.67 118.70 1hvy s ASP 152 Ca 0.72 -0.85 0.13 0.00 0.43 0.00 0.00 52.55 52.98 1hvy s ASP 152 Cb -0.27 -2.16 0.79 0.00 -0.30 0.00 0.00 42.92 40.98 1hvy s ASP 152 CO 0.47 -0.43 1.77 -1.22 -0.17 0.00 0.00 175.17 175.59 1hvy n TYR 153 N 5.16 2.19 -1.68 -5.34 4.02 -1.26 -4.99 117.16 115.27 1hvy n TYR 153 Ca -0.11 -0.90 -0.52 0.00 -0.01 0.00 0.00 57.90 56.36 1hvy n TYR 153 Cb 0.47 -0.57 -0.06 0.00 -0.02 0.00 0.00 39.34 39.16 1hvy n TYR 153 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1hvy n SER 154 N 0.32 2.68 0.00 7.72 7.64 -1.26 -0.49 113.62 130.23 1hvy n SER 154 Ca 0.32 1.05 0.00 0.00 1.01 0.00 0.00 58.87 61.25 1hvy n SER 154 Cb 1.26 -1.26 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 1hvy n SER 154 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1hvy n GLY 155 N 3.89 0.52 3.72 0.23 0.00 -1.26 -5.00 105.19 107.29 1hvy n GLY 155 Ca 0.23 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.89 1hvy n GLY 155 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1hvy s GLN 156 N -0.46 3.59 0.02 1.61 -0.21 0.36 -5.00 119.66 119.58 1hvy s GLN 156 Ca 0.00 -0.29 0.00 0.00 0.02 0.00 0.00 55.36 55.09 1hvy s GLN 156 Cb 0.00 -3.12 0.00 0.00 1.00 0.00 0.00 33.01 30.89 1hvy s GLN 156 CO 0.00 0.53 0.00 0.41 -2.12 0.00 0.00 175.29 174.11 1hvy n GLY 157 N 2.75 -1.35 3.63 3.09 0.00 -1.26 -4.48 105.19 107.56 1hvy n GLY 157 Ca -0.18 -1.51 -0.40 0.00 0.00 0.00 0.00 46.02 43.93 1hvy n GLY 157 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hvy s VAL 158 N -1.14 5.05 -1.08 1.61 1.01 0.39 -4.74 120.40 121.51 1hvy s VAL 158 Ca 0.00 0.96 -0.19 0.00 0.00 0.00 0.00 61.98 62.75 1hvy s VAL 158 Cb 0.00 -3.86 0.10 0.00 0.00 0.00 0.00 36.38 32.62 1hvy s VAL 158 CO 0.00 0.09 1.41 -0.62 0.00 0.00 0.00 175.10 175.97 1hvy s ASP 159 N 1.45 6.71 0.30 3.32 -1.08 -1.22 -1.84 116.67 124.30 1hvy s ASP 159 Ca 0.23 -2.10 -0.02 0.00 -0.52 0.00 0.00 52.55 50.14 1hvy s ASP 159 Cb -0.16 -2.49 0.44 0.00 -1.46 0.00 0.00 42.92 39.25 1hvy s ASP 159 CO 0.09 -1.17 1.95 1.56 0.52 0.00 0.00 175.17 178.12 1hvy h GLN 160 N 8.59 1.04 -0.28 4.34 4.20 -1.41 -2.14 115.11 129.46 1hvy h GLN 160 Ca 0.26 -0.09 -0.01 0.00 0.06 0.00 0.00 58.65 58.87 1hvy h GLN 160 Cb 0.96 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 28.51 1hvy h GLN 160 CO 1.31 0.72 0.13 1.25 -0.67 0.00 0.00 178.83 181.57 1hvy h LEU 161 N 1.06 0.36 -0.68 1.46 5.85 -1.80 0.42 115.31 121.99 1hvy h LEU 161 Ca 0.28 -0.12 -0.14 0.00 0.84 0.00 0.00 57.88 58.74 1hvy h LEU 161 Cb -0.06 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.87 1hvy h LEU 161 CO -0.05 0.39 -0.45 -0.61 -0.34 0.00 0.00 178.44 177.37 1hvy h GLN 162 N 0.32 0.48 -0.72 1.25 5.75 -1.84 -2.24 115.11 118.11 1hvy h GLN 162 Ca 0.10 -0.26 -0.04 0.00 -0.15 0.00 0.00 58.65 58.29 1hvy h GLN 162 Cb 0.12 0.01 -0.03 0.00 1.07 0.00 0.00 27.48 28.65 1hvy h GLN 162 CO -0.01 0.84 0.28 0.00 -2.65 0.00 0.00 178.83 177.29 1hvy h ARG 163 N 0.39 1.08 -0.33 1.69 2.47 -1.12 0.12 114.38 118.68 1hvy h ARG 163 Ca 0.03 -0.20 -0.02 0.00 -1.26 0.00 0.00 59.98 58.53 1hvy h ARG 163 Cb 0.95 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 29.08 1hvy h ARG 163 CO 0.08 0.89 0.14 0.28 0.56 0.00 0.00 179.97 181.92 1hvy h VAL 164 N 1.03 1.17 -0.23 2.04 2.07 -0.71 -1.18 116.25 120.44 1hvy h VAL 164 Ca 0.24 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1hvy h VAL 164 Cb 0.22 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1hvy h VAL 164 CO -0.02 0.18 0.10 0.40 0.02 0.00 0.00 177.57 178.26 1hvy h ILE 165 N 0.38 1.15 -0.99 4.57 2.04 -1.10 -0.34 117.51 123.23 1hvy h ILE 165 Ca 0.11 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.54 1hvy h ILE 165 Cb 0.15 1.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.20 1hvy h ILE 165 CO -0.01 0.15 0.65 0.44 0.00 0.00 0.00 178.15 179.38 1hvy h ASP 166 N 0.24 1.13 -0.15 1.72 3.45 -0.65 -1.81 116.42 120.35 1hvy h ASP 166 Ca 0.08 -0.03 -0.15 0.00 0.43 0.00 0.00 57.03 57.36 1hvy h ASP 166 Cb 0.14 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 38.62 1hvy h ASP 166 CO -0.01 0.82 -0.44 0.74 -1.57 0.00 0.00 179.24 178.78 1hvy h THR 167 N 1.34 1.29 -0.78 0.35 2.02 -0.99 -1.93 112.91 114.21 1hvy h THR 167 Ca 0.36 -1.63 -0.03 0.00 0.77 0.00 0.00 66.41 65.88 1hvy h THR 167 Cb -0.16 1.55 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 1hvy h THR 167 CO -0.08 0.52 0.37 0.40 0.37 0.00 0.00 175.52 177.10 1hvy h ILE 168 N 0.57 1.24 -0.21 3.11 2.04 -0.67 0.12 117.51 123.71 1hvy h ILE 168 Ca 0.04 -0.69 -0.16 0.00 1.00 0.00 0.00 64.86 65.05 1hvy h ILE 168 Cb 0.99 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 1hvy h ILE 168 CO 0.09 0.29 -0.51 0.11 0.00 0.00 0.00 178.15 178.13 1hvy h LYS 169 N 1.11 0.59 0.00 2.37 1.57 -1.15 -3.33 116.57 117.72 1hvy h LYS 169 Ca 0.27 -0.36 -0.29 0.00 -1.87 0.00 0.00 60.65 58.40 1hvy h LYS 169 Cb 0.12 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.41 1hvy h LYS 169 CO -0.03 0.96 -2.09 0.25 -0.57 0.00 0.00 179.45 177.97 1hvy n THR 170 N -3.98 1.09 -3.15 -0.16 -2.24 -0.74 -4.83 114.28 100.27 1hvy n THR 170 Ca -0.03 -0.65 -0.22 0.00 -2.27 0.00 0.00 64.05 60.88 1hvy n THR 170 Cb 0.59 -0.63 -0.05 0.00 -2.10 0.00 0.00 70.33 68.14 1hvy n THR 170 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1hvy n ASN 171 N -2.63 -0.01 0.25 3.42 4.05 0.41 -4.98 115.26 115.78 1hvy n ASN 171 Ca -0.27 -2.81 0.14 0.00 0.45 0.00 0.00 54.58 52.10 1hvy n ASN 171 Cb 1.00 -0.40 0.74 0.00 1.23 0.00 0.00 39.78 42.35 1hvy n ASN 171 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1hvy h PRO 172 N 3.82 0.00 0.00 1.20 0.13 -1.66 -1.07 132.00 134.42 1hvy h PRO 172 Ca 0.05 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.14 1hvy h PRO 172 Cb 0.91 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 1hvy h PRO 172 CO 0.45 0.00 -0.21 -0.44 -0.23 0.00 0.00 178.00 177.57 1hvy h ASP 173 N 0.00 0.00 -1.64 1.44 3.32 -1.89 -3.36 116.42 114.28 1hvy h ASP 173 Ca 0.00 0.00 -0.68 0.00 0.02 0.00 0.00 57.03 56.37 1hvy h ASP 173 Cb 0.33 0.00 0.08 0.00 0.22 0.00 0.00 39.33 39.96 1hvy h ASP 173 CO 0.00 0.21 0.13 -0.67 -1.72 0.00 0.00 179.24 177.19 1hvy n ASP 174 N -3.23 0.77 -1.30 6.45 2.03 -0.41 -4.88 116.55 115.98 1hvy n ASP 174 Ca 0.02 1.14 0.08 0.00 0.52 0.00 0.00 54.79 56.55 1hvy n ASP 174 Cb 0.52 -1.13 0.31 0.00 -0.72 0.00 0.00 41.12 40.10 1hvy n ASP 174 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1hvy n ARG 175 N 1.63 3.57 -0.53 -0.67 1.74 -1.26 -4.41 116.66 116.72 1hvy n ARG 175 Ca 0.16 -2.79 0.06 0.00 -0.77 0.00 0.00 57.85 54.52 1hvy n ARG 175 Cb 0.21 -1.83 0.20 0.00 -1.02 0.00 0.00 32.46 30.02 1hvy n ARG 175 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1hvy n ARG 176 N 0.55 1.58 -2.71 5.56 1.74 -1.26 -4.95 116.66 117.17 1hvy n ARG 176 Ca 0.23 -3.18 -0.43 0.00 -0.77 0.00 0.00 57.85 53.70 1hvy n ARG 176 Cb 0.86 -1.62 -0.01 0.00 -1.02 0.00 0.00 32.46 30.67 1hvy n ARG 176 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1hvy s ILE 177 N -3.18 4.36 0.03 0.55 1.01 -1.26 -4.95 121.20 117.76 1hvy s ILE 177 Ca 0.38 -1.72 0.05 0.00 0.00 0.00 0.00 60.65 59.35 1hvy s ILE 177 Cb 0.36 -5.04 -0.02 0.00 0.01 0.00 0.00 42.46 37.77 1hvy s ILE 177 CO -0.05 -1.84 -0.14 -0.63 0.00 0.00 0.00 174.94 172.28 1hvy s ILE 178 N 3.62 1.11 -0.16 2.92 1.01 -1.26 -1.03 121.20 127.40 1hvy s ILE 178 Ca 0.46 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 60.20 1hvy s ILE 178 Cb 0.00 -0.99 0.03 0.00 0.01 0.00 0.00 42.46 41.51 1hvy s ILE 178 CO -0.01 0.06 -0.14 -0.32 0.00 0.00 0.00 174.94 174.53 1hvy s MET 179 N -0.98 2.33 -0.14 2.79 -2.45 -0.84 -4.91 119.30 115.11 1hvy s MET 179 Ca 0.02 -0.65 0.00 0.00 -1.25 0.00 0.00 55.69 53.82 1hvy s MET 179 Cb -0.07 -2.23 -0.01 0.00 1.25 0.00 0.00 34.83 33.77 1hvy s MET 179 CO 0.01 -0.27 -0.15 0.00 1.05 0.00 0.00 175.02 175.66 1hvy n ALA 181 N 3.70 2.69 -2.33 0.00 0.00 -0.56 -4.65 120.51 119.36 1hvy n ALA 181 Ca -0.18 -0.59 -0.43 0.00 0.00 0.00 0.00 53.44 52.24 1hvy n ALA 181 Cb 0.52 -0.70 -0.02 0.00 0.00 0.00 0.00 19.45 19.25 1hvy n ALA 181 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1hvy s TRP 182 N -3.42 2.32 -0.33 0.00 -0.11 -1.00 -4.87 118.94 111.53 1hvy s TRP 182 Ca -0.08 0.63 0.02 0.00 1.22 0.00 0.00 56.10 57.90 1hvy s TRP 182 Cb 0.13 -4.31 0.10 0.00 -1.50 0.00 0.00 33.47 27.89 1hvy s TRP 182 CO 0.90 -2.05 0.06 1.21 -4.62 0.00 0.00 176.95 172.45 1hvy s ASN 183 N 4.28 4.49 0.28 5.86 3.84 -1.26 -5.01 114.94 127.42 1hvy s ASN 183 Ca 0.61 -1.95 -0.01 0.00 0.21 0.00 0.00 52.86 51.71 1hvy s ASN 183 Cb -0.14 -1.35 0.62 0.00 -0.55 0.00 0.00 41.25 39.83 1hvy s ASN 183 CO 0.31 -0.39 1.62 -0.65 -2.79 0.00 0.00 177.10 175.20 1hvy h PRO 184 N 7.78 0.11 0.00 0.43 0.11 -2.01 0.87 132.00 139.29 1hvy h PRO 184 Ca -0.08 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.00 1hvy h PRO 184 Cb 1.02 -0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 1hvy h PRO 184 CO 0.50 0.07 -0.11 -0.09 -0.21 0.00 0.00 178.00 178.16 1hvy h ARG 185 N 0.11 0.00 0.00 1.05 2.43 -2.02 -3.09 114.38 112.86 1hvy h ARG 185 Ca 0.52 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.69 1hvy h ARG 185 Cb 1.01 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.56 1hvy h ARG 185 CO -0.74 0.11 -1.61 -0.25 -1.51 0.00 0.00 179.97 175.97 1hvy n ASP 186 N -3.89 0.32 -0.34 -3.80 10.43 0.23 -4.61 116.55 114.90 1hvy n ASP 186 Ca -0.02 0.06 0.09 0.00 2.57 0.00 0.00 54.79 57.48 1hvy n ASP 186 Cb 0.20 1.43 0.18 0.00 1.84 0.00 0.00 41.12 44.77 1hvy n ASP 186 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 1hvy n LEU 187 N -2.35 -0.27 0.32 0.64 4.77 -0.80 -0.28 117.00 119.04 1hvy n LEU 187 Ca -0.02 1.63 0.19 0.00 -0.03 0.00 0.00 56.01 57.78 1hvy n LEU 187 Cb 0.55 -0.53 1.06 0.00 -2.33 0.00 0.00 43.42 42.17 1hvy n LEU 187 CO 0.44 -1.59 1.15 1.55 -1.33 0.00 0.00 177.39 177.61 1hvy h PRO 188 N 0.00 0.00 -0.01 3.23 0.13 -1.81 -1.32 132.00 132.22 1hvy h PRO 188 Ca 0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.63 1hvy h PRO 188 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1hvy h PRO 188 CO -0.95 0.00 -0.37 1.28 -0.23 0.00 0.00 178.00 177.73 1hvy n LEU 189 N -3.46 1.12 -4.76 1.56 4.77 0.62 -4.92 117.00 111.93 1hvy n LEU 189 Ca -0.03 -0.32 -0.40 0.00 -0.03 0.00 0.00 56.01 55.23 1hvy n LEU 189 Cb 0.08 -0.11 -0.06 0.00 -2.33 0.00 0.00 43.42 41.00 1hvy n LEU 189 CO 0.24 0.22 0.48 -0.04 -1.33 0.00 0.00 177.39 176.95 1hvy s MET 190 N -2.60 4.53 0.46 3.23 -1.94 -0.50 -4.38 119.30 118.11 1hvy s MET 190 Ca 0.20 1.12 0.25 0.00 -1.71 0.00 0.00 55.69 55.55 1hvy s MET 190 Cb 0.19 -3.30 1.01 0.00 2.01 0.00 0.00 34.83 34.73 1hvy s MET 190 CO 0.58 0.46 1.86 0.00 -0.01 0.00 0.00 175.02 177.91 1hvy h ALA 191 N 4.86 1.04 -1.51 3.03 0.00 -1.78 -3.42 119.26 121.49 1hvy h ALA 191 Ca -0.46 -0.18 0.10 0.00 0.00 0.00 0.00 54.91 54.37 1hvy h ALA 191 Cb 1.21 -0.03 -0.21 0.00 0.00 0.00 0.00 17.79 18.76 1hvy h ALA 191 CO 0.68 0.25 -0.14 -1.17 0.00 0.00 0.00 179.25 178.86 1hvy s LEU 192 N -6.79 -1.17 0.23 0.00 2.96 -1.26 -5.07 118.68 107.58 1hvy s LEU 192 Ca 0.00 1.23 -0.32 0.00 -0.22 0.00 0.00 54.13 54.82 1hvy s LEU 192 Cb 0.10 2.18 -0.13 0.00 0.50 0.00 0.00 46.19 48.84 1hvy s LEU 192 CO 0.62 -0.22 1.58 -2.65 -1.32 0.00 0.00 176.35 174.36 1hvy n PRO 193 N 5.41 2.42 -1.64 0.98 -0.02 -1.26 -4.81 135.00 136.07 1hvy n PRO 193 Ca -0.08 0.87 -0.60 0.00 -2.02 0.00 0.00 63.50 61.67 1hvy n PRO 193 Cb 0.50 -2.63 -0.08 0.00 -0.02 0.00 0.00 33.50 31.27 1hvy n PRO 193 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1hvy n PRO 194 N 2.88 0.48 0.16 0.52 -0.02 -1.26 -4.83 135.00 132.93 1hvy n PRO 194 Ca 0.13 0.17 0.13 0.00 -2.02 0.00 0.00 63.50 61.92 1hvy n PRO 194 Cb 0.33 -1.74 0.41 0.00 -0.02 0.00 0.00 33.50 32.48 1hvy n PRO 194 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hvy s HIS 196 N -3.24 3.47 0.16 0.00 3.76 -1.26 -1.26 115.29 116.91 1hvy s HIS 196 Ca 0.07 -2.55 -0.16 0.00 -0.15 0.00 0.00 55.06 52.27 1hvy s HIS 196 Cb 0.10 -3.27 0.03 0.00 1.11 0.00 0.00 32.58 30.55 1hvy s HIS 196 CO 0.56 -0.89 1.81 0.00 -0.85 0.00 0.00 174.74 175.37 1hvy h ALA 197 N 7.37 0.52 -2.18 -1.40 0.00 -1.41 -3.41 119.26 118.76 1hvy h ALA 197 Ca -0.04 -0.02 0.17 0.00 0.00 0.00 0.00 54.91 55.02 1hvy h ALA 197 Cb 0.98 -0.14 -0.12 0.00 0.00 0.00 0.00 17.79 18.52 1hvy h ALA 197 CO 0.72 -0.06 0.54 -0.48 0.00 0.00 0.00 179.25 179.98 1hvy s LEU 198 N -10.19 -0.23 0.05 0.00 0.05 -1.21 -1.50 118.68 105.65 1hvy s LEU 198 Ca -0.13 -0.21 0.01 0.00 0.05 0.00 0.00 54.13 53.85 1hvy s LEU 198 Cb 0.11 1.99 -0.03 0.00 -2.05 0.00 0.00 46.19 46.21 1hvy s LEU 198 CO 0.72 -0.70 -0.05 0.00 -0.55 0.00 0.00 176.35 175.77 1hvy s GLN 200 N -2.40 0.94 0.10 0.00 0.74 0.43 -1.98 119.66 117.49 1hvy s GLN 200 Ca -0.05 -0.64 0.05 0.00 0.05 0.00 0.00 55.36 54.77 1hvy s GLN 200 Cb -0.04 -0.92 -0.04 0.00 1.10 0.00 0.00 33.01 33.11 1hvy s GLN 200 CO -0.03 0.24 -0.00 -0.06 -0.55 0.00 0.00 175.29 174.88 1hvy s PHE 201 N -0.67 2.97 -0.03 1.67 0.08 -0.19 -0.35 117.98 121.47 1hvy s PHE 201 Ca 0.02 -0.04 -0.03 0.00 0.12 0.00 0.00 56.93 57.01 1hvy s PHE 201 Cb -0.07 -1.52 0.01 0.00 -0.57 0.00 0.00 43.02 40.87 1hvy s PHE 201 CO 0.01 0.48 0.07 -0.47 -0.10 0.00 0.00 175.22 175.21 1hvy s TYR 202 N -1.34 -0.07 -0.06 0.36 5.04 0.31 -4.57 117.35 117.02 1hvy s TYR 202 Ca 0.26 0.17 0.03 0.00 -2.44 0.00 0.00 57.07 55.08 1hvy s TYR 202 Cb -0.11 0.02 0.01 0.00 0.35 0.00 0.00 41.96 42.22 1hvy s TYR 202 CO 0.18 -0.05 -0.14 0.08 -1.34 0.00 0.00 175.55 174.28 1hvy s VAL 203 N -0.03 1.26 -0.15 3.14 1.01 -1.26 0.26 120.40 124.63 1hvy s VAL 203 Ca -0.01 -0.58 -0.24 0.00 0.00 0.00 0.00 61.98 61.15 1hvy s VAL 203 Cb -0.01 -1.12 0.06 0.00 0.00 0.00 0.00 36.38 35.31 1hvy s VAL 203 CO 0.00 0.38 0.61 0.54 0.00 0.00 0.00 175.10 176.63 1hvy s VAL 204 N 0.44 0.01 -1.58 2.92 0.11 -0.87 -4.78 120.40 116.64 1hvy s VAL 204 Ca -0.11 -0.05 -0.08 0.00 -2.93 0.00 0.00 61.98 58.80 1hvy s VAL 204 Cb -0.14 -0.89 0.07 0.00 -1.53 0.00 0.00 36.38 33.89 1hvy s VAL 204 CO 0.04 -0.03 0.46 0.59 -3.33 0.00 0.00 175.10 172.82 1hvy n ASN 205 N 1.95 -1.10 -1.84 3.54 3.02 -1.26 -0.32 115.26 119.25 1hvy n ASN 205 Ca -0.16 -1.10 -0.19 0.00 -0.03 0.00 0.00 54.58 53.10 1hvy n ASN 205 Cb 0.56 -2.48 -0.06 0.00 -0.61 0.00 0.00 39.78 37.19 1hvy n ASN 205 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1hvy n SER 206 N -2.81 -5.12 -4.37 6.41 7.64 -1.26 -4.98 113.62 109.13 1hvy n SER 206 Ca -0.15 0.32 -0.32 0.00 1.01 0.00 0.00 58.87 59.73 1hvy n SER 206 Cb 0.61 -4.47 -0.15 0.00 -1.01 0.00 0.00 64.21 59.19 1hvy n SER 206 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1hvy s GLU 207 N -4.09 2.42 -0.23 1.43 2.02 0.56 -1.62 118.70 119.19 1hvy s GLU 207 Ca 0.00 -0.82 -0.09 0.00 0.02 0.00 0.00 54.97 54.08 1hvy s GLU 207 Cb 0.00 -2.23 -0.04 0.00 0.10 0.00 0.00 34.13 31.96 1hvy s GLU 207 CO 0.00 0.53 0.11 -1.17 0.02 0.00 0.00 175.26 174.75 1hvy s LEU 208 N -0.52 3.82 0.22 1.80 2.96 0.37 -2.05 118.68 125.27 1hvy s LEU 208 Ca 0.07 -0.01 0.10 0.00 -0.22 0.00 0.00 54.13 54.07 1hvy s LEU 208 Cb -0.11 -2.01 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 1hvy s LEU 208 CO 0.01 0.05 -0.11 -0.44 -1.32 0.00 0.00 176.35 174.54 1hvy s SER 209 N 1.13 4.12 -0.01 3.68 0.01 0.14 0.59 113.70 123.36 1hvy s SER 209 Ca 0.06 -0.70 -0.00 0.00 1.31 0.00 0.00 55.95 56.61 1hvy s SER 209 Cb -0.14 -0.63 0.01 0.00 0.21 0.00 0.00 66.02 65.47 1hvy s SER 209 CO 0.04 0.07 0.02 0.00 0.41 0.00 0.00 173.24 173.78 1hvy s GLN 211 N 0.37 2.75 -0.12 0.00 0.74 0.53 -0.21 119.66 123.72 1hvy s GLN 211 Ca -0.03 -0.82 -0.02 0.00 0.05 0.00 0.00 55.36 54.54 1hvy s GLN 211 Cb -0.04 -2.14 -0.03 0.00 1.10 0.00 0.00 33.01 31.89 1hvy s GLN 211 CO -0.01 0.21 -0.05 -1.17 -0.55 0.00 0.00 175.29 173.72 1hvy s LEU 212 N 0.26 3.23 -0.45 3.68 2.96 -0.51 -0.43 118.68 127.43 1hvy s LEU 212 Ca -0.15 -0.08 -0.09 0.00 -0.22 0.00 0.00 54.13 53.59 1hvy s LEU 212 Cb -0.17 -1.75 0.10 0.00 0.50 0.00 0.00 46.19 44.87 1hvy s LEU 212 CO 0.07 0.25 0.31 -0.47 -1.32 0.00 0.00 176.35 175.19 1hvy s TYR 213 N -0.10 3.38 -0.44 5.38 6.14 0.62 -1.53 117.35 130.78 1hvy s TYR 213 Ca 0.02 -1.68 -0.14 0.00 0.64 0.00 0.00 57.07 55.91 1hvy s TYR 213 Cb -0.13 -3.25 0.06 0.00 0.42 0.00 0.00 41.96 39.06 1hvy s TYR 213 CO 0.03 -0.92 0.35 -1.14 0.64 0.00 0.00 175.55 174.50 1hvy s GLN 214 N 1.40 2.93 0.41 4.97 0.74 -0.30 -1.44 119.66 128.36 1hvy s GLN 214 Ca 0.04 -1.26 0.13 0.00 0.05 0.00 0.00 55.36 54.33 1hvy s GLN 214 Cb -0.25 -4.03 0.97 0.00 1.10 0.00 0.00 33.01 30.80 1hvy s GLN 214 CO 0.01 -0.93 1.92 0.07 -0.55 0.00 0.00 175.29 175.81 1hvy h ARG 215 N 8.67 0.48 -2.66 1.67 0.11 -1.47 0.42 114.38 121.60 1hvy h ARG 215 Ca -0.27 -0.03 -0.12 0.00 0.10 0.00 0.00 59.98 59.66 1hvy h ARG 215 Cb 1.11 -0.11 -0.26 0.00 1.11 0.00 0.00 29.97 31.82 1hvy h ARG 215 CO 0.82 0.32 -0.29 -1.54 0.10 0.00 0.00 179.97 179.38 1hvy s SER 216 N -5.99 -0.50 -0.15 0.08 1.04 -1.25 -0.47 113.70 106.45 1hvy s SER 216 Ca -0.08 0.88 0.00 0.00 0.48 0.00 0.00 55.95 57.23 1hvy s SER 216 Cb 0.21 0.78 0.03 0.00 0.10 0.00 0.00 66.02 67.14 1hvy s SER 216 CO 0.77 -0.19 -0.11 -0.83 0.98 0.00 0.00 173.24 173.86 1hvy s GLY 217 N 1.24 1.05 -0.72 7.32 0.00 -0.53 -4.86 107.32 110.82 1hvy s GLY 217 Ca -0.08 -0.85 -0.27 0.00 0.00 0.00 0.00 44.72 43.52 1hvy s GLY 217 CO -0.11 0.67 1.36 -0.35 0.00 0.00 0.00 173.10 174.67 1hvy s ASP 218 N 1.55 6.04 0.33 1.64 3.68 -1.26 -1.66 116.67 126.98 1hvy s ASP 218 Ca 0.04 -0.33 0.04 0.00 2.13 0.00 0.00 52.55 54.43 1hvy s ASP 218 Cb -0.13 -2.56 0.66 0.00 -1.45 0.00 0.00 42.92 39.44 1hvy s ASP 218 CO -0.09 -1.91 1.90 0.24 0.13 0.00 0.00 175.17 175.43 1hvy h MET 219 N 10.73 0.84 0.05 4.34 2.86 -1.48 -1.29 114.93 130.98 1hvy h MET 219 Ca -0.28 -0.05 -0.25 0.00 -2.06 0.00 0.00 59.70 57.06 1hvy h MET 219 Cb 1.07 -0.19 0.02 0.00 0.06 0.00 0.00 31.60 32.56 1hvy h MET 219 CO 1.27 0.56 -1.01 0.78 1.06 0.00 0.00 176.91 179.56 1hvy h GLY 220 N 0.87 0.67 0.00 8.32 0.00 -1.89 -3.39 103.07 107.65 1hvy h GLY 220 Ca 0.40 -1.27 0.00 0.00 0.00 0.00 0.00 47.33 46.46 1hvy h GLY 220 CO -0.17 1.12 -0.05 -0.10 0.00 0.00 0.00 176.54 177.35 1hvy n LEU 221 N -3.92 0.09 -0.02 3.11 7.94 -1.17 -4.76 117.00 118.28 1hvy n LEU 221 Ca -0.12 0.04 -0.11 0.00 -1.11 0.00 0.00 56.01 54.71 1hvy n LEU 221 Cb 0.87 -0.51 -0.06 0.00 0.53 0.00 0.00 43.42 44.25 1hvy n LEU 221 CO 0.54 -0.49 0.83 1.23 -1.11 0.00 0.00 177.39 178.39 1hvy h GLY 222 N -0.05 0.17 -0.32 -3.96 0.00 -1.68 -3.36 103.07 93.87 1hvy h GLY 222 Ca 0.00 -0.09 0.07 0.00 0.00 0.00 0.00 47.33 47.30 1hvy h GLY 222 CO 0.00 0.09 -0.45 -2.08 0.00 0.00 0.00 176.54 174.10 1hvy h VAL 223 N 0.02 0.09 -0.92 4.60 2.07 -1.45 0.40 116.25 121.05 1hvy h VAL 223 Ca 0.04 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.69 1hvy h VAL 223 Cb 0.17 0.09 -0.09 0.00 -1.52 0.00 0.00 31.29 29.94 1hvy h VAL 223 CO -0.00 0.00 0.54 -0.65 0.02 0.00 0.00 177.57 177.47 1hvy h PRO 224 N -0.33 0.78 -0.21 1.57 0.11 -1.75 0.12 132.00 132.29 1hvy h PRO 224 Ca 0.13 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 66.16 1hvy h PRO 224 Cb 0.59 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 31.51 1hvy h PRO 224 CO -0.58 0.52 -0.00 0.35 -0.21 0.00 0.00 178.00 178.07 1hvy h PHE 225 N 0.81 0.40 -0.89 0.65 3.57 -1.39 -2.89 116.94 117.20 1hvy h PHE 225 Ca 0.48 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.89 1hvy h PHE 225 Cb 0.58 -0.10 -0.04 0.00 2.79 0.00 0.00 35.95 39.17 1hvy h PHE 225 CO -0.04 0.56 0.49 -0.91 -2.23 0.00 0.00 178.31 176.19 1hvy h ASN 226 N 0.13 1.11 -0.00 0.41 -0.26 0.79 -1.14 115.58 116.61 1hvy h ASN 226 Ca 0.06 -0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.70 1hvy h ASN 226 Cb 0.41 -0.28 -0.00 0.00 -1.06 0.00 0.00 38.32 37.38 1hvy h ASN 226 CO 0.01 0.89 -0.01 0.40 -1.06 0.00 0.00 177.43 177.66 1hvy h ILE 227 N 1.25 0.98 -0.99 2.81 2.04 -0.77 -1.67 117.51 121.15 1hvy h ILE 227 Ca 0.31 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.19 1hvy h ILE 227 Cb 0.02 0.98 -0.05 0.00 -0.74 0.00 0.00 36.82 37.03 1hvy h ILE 227 CO -0.05 0.00 0.66 0.00 0.00 0.00 0.00 178.15 178.75 1hvy h ALA 228 N 0.99 1.26 -0.04 1.87 0.00 -1.28 -0.62 119.26 121.44 1hvy h ALA 228 Ca 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1hvy h ALA 228 Cb 0.02 -0.40 -0.01 0.00 0.00 0.00 0.00 17.79 17.40 1hvy h ALA 228 CO -0.01 0.64 -0.04 1.03 0.00 0.00 0.00 179.25 180.87 1hvy h SER 229 N 1.34 -0.12 0.74 0.00 0.87 -0.71 0.15 113.55 115.81 1hvy h SER 229 Ca 0.36 0.03 -0.15 0.00 -1.23 0.00 0.00 61.79 60.80 1hvy h SER 229 Cb -0.15 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 1hvy h SER 229 CO -0.08 -0.06 -0.73 1.88 -0.53 0.00 0.00 176.83 177.31 1hvy h TYR 230 N -0.06 0.00 -0.50 2.24 0.05 -1.11 -0.05 116.97 117.54 1hvy h TYR 230 Ca 0.03 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.79 1hvy h TYR 230 Cb 0.10 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.82 1hvy h TYR 230 CO -0.13 0.73 0.21 0.00 -1.05 0.00 0.00 178.16 177.92 1hvy h ALA 231 N 1.27 0.65 -0.62 3.88 0.00 -0.87 -0.00 119.26 123.56 1hvy h ALA 231 Ca -0.01 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1hvy h ALA 231 Cb 1.30 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 1hvy h ALA 231 CO 0.09 0.25 0.28 1.25 0.00 0.00 0.00 179.25 181.12 1hvy h LEU 232 N 0.67 0.83 -0.98 0.00 5.85 -0.47 -1.50 115.31 119.71 1hvy h LEU 232 Ca 0.17 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1hvy h LEU 232 Cb 0.17 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 1hvy h LEU 232 CO -0.02 0.75 0.46 0.25 -0.34 0.00 0.00 178.44 179.54 1hvy h LEU 233 N 0.86 1.05 -0.71 2.25 5.85 -0.54 -1.70 115.31 122.37 1hvy h LEU 233 Ca 0.21 -0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.75 1hvy h LEU 233 Cb 0.15 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.89 1hvy h LEU 233 CO -0.02 0.85 0.04 0.74 -0.34 0.00 0.00 178.44 179.70 1hvy h THR 234 N 1.18 1.26 -0.67 1.05 2.02 -0.48 -2.22 112.91 115.05 1hvy h THR 234 Ca 0.30 -1.09 -0.03 0.00 0.77 0.00 0.00 66.41 66.36 1hvy h THR 234 Cb 0.03 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.17 1hvy h THR 234 CO -0.05 0.40 0.31 1.88 0.37 0.00 0.00 175.52 178.43 1hvy h TYR 235 N 0.95 0.98 0.47 3.16 0.05 -0.78 -0.80 116.97 121.01 1hvy h TYR 235 Ca 0.18 -0.05 -0.02 0.00 0.05 0.00 0.00 58.73 58.88 1hvy h TYR 235 Cb 0.50 -0.30 0.00 0.00 1.01 0.00 0.00 36.73 37.95 1hvy h TYR 235 CO 0.03 0.74 -0.23 0.52 -1.05 0.00 0.00 178.16 178.17 1hvy h MET 236 N 0.93 -0.61 -0.62 4.88 2.86 -1.07 -0.18 114.93 121.11 1hvy h MET 236 Ca 0.23 0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 57.88 1hvy h MET 236 Cb 0.14 0.14 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 1hvy h MET 236 CO -0.03 -0.37 0.27 0.82 1.06 0.00 0.00 176.91 178.66 1hvy h ILE 237 N -0.70 1.21 -0.39 -1.22 2.04 -1.37 -1.42 117.51 115.66 1hvy h ILE 237 Ca -0.06 -0.63 -0.02 0.00 1.00 0.00 0.00 64.86 65.14 1hvy h ILE 237 Cb 0.52 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.03 1hvy h ILE 237 CO 0.11 0.26 0.16 0.00 0.00 0.00 0.00 178.15 178.67 1hvy h ALA 238 N 1.41 0.50 -0.05 1.87 0.00 -1.05 -1.92 119.26 120.03 1hvy h ALA 238 Ca 0.21 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.02 1hvy h ALA 238 Cb 0.14 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 1hvy h ALA 238 CO -0.02 0.10 -0.14 1.25 0.00 0.00 0.00 179.25 180.43 1hvy h HIS 239 N 0.48 -0.37 0.00 0.00 -0.00 -0.39 -0.08 115.15 114.80 1hvy h HIS 239 Ca 0.13 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.52 1hvy h HIS 239 Cb 0.18 0.17 0.00 0.00 -0.00 0.00 0.00 27.41 27.76 1hvy h HIS 239 CO -0.00 -0.21 0.00 0.44 -0.00 0.00 0.00 177.93 178.15 1hvy n ILE 240 N -5.28 0.08 0.12 6.26 -5.35 -0.59 -3.22 119.36 111.37 1hvy n ILE 240 Ca -0.04 0.02 0.07 0.00 -0.27 0.00 0.00 62.75 62.52 1hvy n ILE 240 Cb 0.20 -0.55 0.13 0.00 -1.74 0.00 0.00 39.64 37.68 1hvy n ILE 240 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1hvy n THR 241 N -1.32 0.57 -2.02 7.28 -2.24 -0.73 -4.94 114.28 110.88 1hvy n THR 241 Ca 0.12 -0.79 -0.08 0.00 -2.27 0.00 0.00 64.05 61.04 1hvy n THR 241 Cb 0.24 0.83 -0.01 0.00 -2.10 0.00 0.00 70.33 69.29 1hvy n THR 241 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1hvy n GLY 242 N 0.72 0.17 3.62 3.38 0.00 -0.85 -4.86 105.19 107.36 1hvy n GLY 242 Ca 0.11 -0.56 -0.27 0.00 0.00 0.00 0.00 46.02 45.31 1hvy n GLY 242 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1hvy s LEU 243 N -2.31 2.88 -0.05 0.99 1.43 -0.10 -5.05 118.68 116.48 1hvy s LEU 243 Ca 0.00 -1.26 -0.02 0.00 -1.03 0.00 0.00 54.13 51.83 1hvy s LEU 243 Cb 0.00 -1.03 -0.04 0.00 0.03 0.00 0.00 46.19 45.15 1hvy s LEU 243 CO 0.00 -0.38 0.05 -0.54 0.23 0.00 0.00 176.35 175.70 1hvy s LYS 244 N -3.71 3.04 0.22 1.70 3.01 -0.64 -4.16 119.74 119.20 1hvy s LYS 244 Ca 0.35 -0.43 -0.31 0.00 -1.01 0.00 0.00 55.97 54.57 1hvy s LYS 244 Cb 0.06 -2.85 -0.11 0.00 -1.01 0.00 0.00 37.83 33.93 1hvy s LYS 244 CO 0.18 0.68 1.58 -2.14 0.51 0.00 0.00 175.35 176.17 1hvy s PRO 245 N -1.29 4.18 0.00 -1.68 0.02 -1.26 -0.48 135.00 134.49 1hvy s PRO 245 Ca 0.18 2.46 0.00 0.00 0.02 0.00 0.00 61.00 63.65 1hvy s PRO 245 Cb -0.12 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.31 1hvy s PRO 245 CO 0.08 -0.61 0.00 0.41 -0.33 0.00 0.00 177.00 176.55 1hvy n GLY 246 N 3.14 -0.12 3.33 0.52 0.00 0.20 -3.91 105.19 108.34 1hvy n GLY 246 Ca 0.12 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.92 1hvy n GLY 246 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1hvy s ASP 247 N -0.90 2.65 -0.22 1.61 1.01 -1.25 -0.51 116.67 119.07 1hvy s ASP 247 Ca 0.00 -0.85 0.01 0.00 0.71 0.00 0.00 52.55 52.42 1hvy s ASP 247 Cb 0.00 -0.15 0.03 0.00 1.01 0.00 0.00 42.92 43.81 1hvy s ASP 247 CO 0.00 -0.03 -0.15 0.12 0.21 0.00 0.00 175.17 175.32 1hvy s PHE 248 N -1.98 2.98 -0.26 4.23 5.36 -0.35 -0.92 117.98 127.03 1hvy s PHE 248 Ca 0.15 -1.82 -0.10 0.00 -0.96 0.00 0.00 56.93 54.20 1hvy s PHE 248 Cb -0.06 -1.95 -0.05 0.00 -0.34 0.00 0.00 43.02 40.62 1hvy s PHE 248 CO 0.06 -0.81 0.16 0.42 -1.46 0.00 0.00 175.22 173.59 1hvy s ILE 249 N 1.24 5.12 -0.35 3.12 1.09 0.71 -0.58 121.20 131.55 1hvy s ILE 249 Ca 0.00 0.10 -0.12 0.00 -1.10 0.00 0.00 60.65 59.54 1hvy s ILE 249 Cb -0.16 -3.42 -0.00 0.00 -1.06 0.00 0.00 42.46 37.83 1hvy s ILE 249 CO -0.09 0.29 0.21 -2.28 -0.10 0.00 0.00 174.94 172.97 1hvy s HIS 250 N 1.56 3.22 -0.13 3.97 2.46 0.20 -1.42 115.29 125.14 1hvy s HIS 250 Ca 0.07 -0.53 -0.02 0.00 0.47 0.00 0.00 55.06 55.05 1hvy s HIS 250 Cb -0.15 -2.44 -0.02 0.00 -0.13 0.00 0.00 32.58 29.83 1hvy s HIS 250 CO 0.08 -0.48 -0.08 0.99 -2.47 0.00 0.00 174.74 172.78 1hvy s THR 251 N 1.65 3.53 0.03 0.89 2.01 -0.58 -0.81 115.64 122.35 1hvy s THR 251 Ca 0.05 -0.49 0.07 0.00 0.31 0.00 0.00 61.69 61.62 1hvy s THR 251 Cb -0.18 -2.51 -0.03 0.00 0.01 0.00 0.00 72.50 69.79 1hvy s THR 251 CO 0.08 0.52 -0.20 -0.76 -0.69 0.00 0.00 174.62 173.57 1hvy s LEU 252 N 0.21 2.47 0.00 4.42 1.43 -0.23 -1.16 118.68 125.82 1hvy s LEU 252 Ca -0.05 -0.44 0.00 0.00 -1.03 0.00 0.00 54.13 52.61 1hvy s LEU 252 Cb -0.14 -1.45 0.00 0.00 0.03 0.00 0.00 46.19 44.62 1hvy s LEU 252 CO 0.04 0.27 0.00 0.61 0.23 0.00 0.00 176.35 177.50 1hvy n GLY 253 N 1.78 1.00 3.51 -3.19 0.00 0.14 -2.44 105.19 105.99 1hvy n GLY 253 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1hvy n GLY 253 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1hvy s ASP 254 N -1.00 6.35 -0.35 1.61 -1.08 0.38 -1.13 116.67 121.46 1hvy s ASP 254 Ca 0.00 -1.17 -0.24 0.00 -0.52 0.00 0.00 52.55 50.62 1hvy s ASP 254 Cb 0.00 -2.50 0.01 0.00 -1.46 0.00 0.00 42.92 38.97 1hvy s ASP 254 CO 0.00 -1.51 0.84 0.00 0.52 0.00 0.00 175.17 175.02 1hvy s ALA 255 N 4.58 3.46 0.06 3.66 0.00 0.07 -1.45 121.76 132.14 1hvy s ALA 255 Ca 0.35 -0.50 0.02 0.00 0.00 0.00 0.00 51.96 51.83 1hvy s ALA 255 Cb -0.07 -3.40 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 1hvy s ALA 255 CO 0.02 -1.43 -0.08 -3.38 0.00 0.00 0.00 175.76 170.89 1hvy s HIS 256 N 3.18 0.78 -0.22 0.00 -3.43 -0.67 -1.43 115.29 113.50 1hvy s HIS 256 Ca 0.34 -0.63 -0.02 0.00 -0.80 0.00 0.00 55.06 53.96 1hvy s HIS 256 Cb -0.13 -0.46 0.01 0.00 -1.43 0.00 0.00 32.58 30.58 1hvy s HIS 256 CO 0.16 -0.09 -0.09 0.42 -2.00 0.00 0.00 174.74 173.13 1hvy s ILE 257 N -2.09 2.80 0.39 -5.38 1.01 -0.74 -1.05 121.20 116.14 1hvy s ILE 257 Ca -0.02 -0.85 -0.26 0.00 0.00 0.00 0.00 60.65 59.52 1hvy s ILE 257 Cb -0.05 -2.32 -0.09 0.00 0.01 0.00 0.00 42.46 40.01 1hvy s ILE 257 CO -0.01 0.35 1.24 -0.31 0.00 0.00 0.00 174.94 176.21 1hvy s TYR 258 N 1.36 2.98 0.32 3.97 1.51 -1.26 -1.91 117.35 124.32 1hvy s TYR 258 Ca 0.03 1.48 0.10 0.00 -1.01 0.00 0.00 57.07 57.67 1hvy s TYR 258 Cb -0.15 -3.55 0.89 0.00 -0.11 0.00 0.00 41.96 39.05 1hvy s TYR 258 CO -0.06 -1.69 1.74 -0.07 -1.11 0.00 0.00 175.55 174.35 1hvy h LEU 259 N 2.80 0.67 0.00 -1.29 3.38 -1.70 0.18 115.31 119.34 1hvy h LEU 259 Ca -0.49 0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1hvy h LEU 259 Cb 1.24 0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1hvy h LEU 259 CO 0.63 0.12 0.00 -0.46 0.09 0.00 0.00 178.44 178.82 1hvy n ASN 260 N -4.85 0.00 -0.03 -0.43 2.04 -1.26 -2.60 115.26 108.12 1hvy n ASN 260 Ca 0.26 -1.06 0.07 0.00 -0.44 0.00 0.00 54.58 53.41 1hvy n ASN 260 Cb 0.74 0.00 -0.08 0.00 -2.53 0.00 0.00 39.78 37.91 1hvy n ASN 260 CO 0.00 0.00 0.00 1.41 -0.44 0.00 0.00 177.26 178.23 1hvy n HIS 261 N -0.83 0.00 -0.19 -2.53 8.25 0.62 -4.56 115.22 115.97 1hvy n HIS 261 Ca 0.13 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.53 1hvy n HIS 261 Cb 0.06 0.00 0.04 0.00 1.12 0.00 0.00 29.99 31.21 1hvy n HIS 261 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1hvy h ILE 262 N 0.15 1.10 0.18 1.59 2.04 -1.51 0.29 117.51 121.34 1hvy h ILE 262 Ca 0.00 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.60 1hvy h ILE 262 Cb 0.37 0.32 0.00 0.00 -0.74 0.00 0.00 36.82 36.77 1hvy h ILE 262 CO 0.00 0.13 -0.08 -0.33 0.00 0.00 0.00 178.15 177.87 1hvy h GLU 263 N 0.72 -0.23 -0.58 2.37 4.39 -1.80 -1.83 114.58 117.62 1hvy h GLU 263 Ca 0.22 0.02 -0.05 0.00 0.34 0.00 0.00 59.36 59.89 1hvy h GLU 263 Cb -0.02 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 1hvy h GLU 263 CO -0.08 0.01 0.17 -1.00 -1.16 0.00 0.00 179.01 176.95 1hvy h PRO 264 N -0.44 0.88 -0.62 2.33 0.13 -1.80 -2.83 132.00 129.66 1hvy h PRO 264 Ca -0.02 -0.17 -0.03 0.00 -0.87 0.00 0.00 66.00 64.90 1hvy h PRO 264 Cb 0.34 -0.14 -0.03 0.00 0.13 0.00 0.00 31.00 31.30 1hvy h PRO 264 CO 0.04 0.77 0.25 -0.07 -0.23 0.00 0.00 178.00 178.76 1hvy h LEU 265 N 0.86 0.83 -1.08 1.56 3.38 -0.85 -0.44 115.31 119.57 1hvy h LEU 265 Ca 0.19 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 57.97 1hvy h LEU 265 Cb 0.26 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1hvy h LEU 265 CO -0.01 0.74 -0.22 0.11 0.09 0.00 0.00 178.44 179.16 1hvy h LYS 266 N 0.89 0.39 -0.17 1.13 1.57 -1.09 0.44 116.57 119.72 1hvy h LYS 266 Ca 0.21 -0.13 -0.20 0.00 -1.87 0.00 0.00 60.65 58.66 1hvy h LYS 266 Cb 0.17 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.45 1hvy h LYS 266 CO -0.02 0.59 -0.69 0.82 -0.57 0.00 0.00 179.45 179.58 1hvy h ILE 267 N 0.35 1.31 -0.47 1.86 2.04 -1.23 -2.87 117.51 118.50 1hvy h ILE 267 Ca 0.06 -1.94 -0.04 0.00 1.00 0.00 0.00 64.86 63.94 1hvy h ILE 267 Cb 0.58 1.91 -0.02 0.00 -0.74 0.00 0.00 36.82 38.55 1hvy h ILE 267 CO 0.04 0.61 0.13 -0.61 0.00 0.00 0.00 178.15 178.32 1hvy h GLN 268 N 0.48 0.69 0.00 2.37 4.15 -0.53 -2.14 115.11 120.14 1hvy h GLN 268 Ca -0.02 -0.12 0.00 0.00 0.77 0.00 0.00 58.65 59.28 1hvy h GLN 268 Cb 1.28 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.86 1hvy h GLN 268 CO 0.14 0.61 0.00 -0.07 -1.93 0.00 0.00 178.83 177.58 1hvy h LEU 269 N 0.67 0.00 -0.69 -2.39 3.38 -0.70 -2.20 115.31 113.38 1hvy h LEU 269 Ca 0.16 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1hvy h LEU 269 Cb 0.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1hvy h LEU 269 CO -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 178.49 1hvy n GLN 270 N -2.93 1.40 -3.55 1.13 6.02 -0.80 -4.86 117.38 113.79 1hvy n GLN 270 Ca -0.01 -0.69 -0.36 0.00 -0.01 0.00 0.00 57.00 55.92 1hvy n GLN 270 Cb 0.19 -1.49 -0.07 0.00 1.02 0.00 0.00 30.24 29.89 1hvy n GLN 270 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1hvy s ARG 271 N -2.08 4.22 -0.08 -1.09 0.52 -0.83 -5.05 118.95 114.56 1hvy s ARG 271 Ca 0.38 0.10 -0.30 0.00 -0.52 0.00 0.00 55.73 55.39 1hvy s ARG 271 Cb 0.21 -3.41 -0.03 0.00 0.52 0.00 0.00 34.95 32.24 1hvy s ARG 271 CO 0.37 0.27 1.24 -2.00 0.02 0.00 0.00 175.30 175.20 1hvy s GLU 272 N 0.37 4.31 0.72 3.54 2.56 -1.26 -4.93 118.70 124.02 1hvy s GLU 272 Ca 0.17 1.70 -0.16 0.00 0.00 0.00 0.00 54.97 56.68 1hvy s GLU 272 Cb -0.13 -3.62 0.03 0.00 2.00 0.00 0.00 34.13 32.41 1hvy s GLU 272 CO 0.04 -0.53 1.25 -2.14 -0.56 0.00 0.00 175.26 173.32 1hvy s PRO 273 N 2.60 2.13 0.11 4.30 0.02 -1.26 -4.88 135.00 138.02 1hvy s PRO 273 Ca 0.56 1.90 0.09 0.00 0.02 0.00 0.00 61.00 63.57 1hvy s PRO 273 Cb -0.25 -1.82 -0.04 0.00 0.02 0.00 0.00 34.50 32.42 1hvy s PRO 273 CO 0.20 -1.88 -0.18 1.03 -0.33 0.00 0.00 177.00 175.85 1hvy s ARG 274 N -3.75 1.81 0.05 5.54 0.52 -1.26 -5.06 118.95 116.80 1hvy s ARG 274 Ca 0.78 -1.16 -0.34 0.00 -0.52 0.00 0.00 55.73 54.48 1hvy s ARG 274 Cb -0.33 -2.12 -0.18 0.00 0.52 0.00 0.00 34.95 32.84 1hvy s ARG 274 CO 0.45 0.48 0.85 -2.30 0.02 0.00 0.00 175.30 174.80 1hvy n PRO 275 N 0.84 0.00 -1.63 3.54 -0.02 -1.26 -4.79 135.00 131.69 1hvy n PRO 275 Ca -0.16 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 60.96 1hvy n PRO 275 Cb 0.53 -1.26 0.08 0.00 -0.02 0.00 0.00 33.50 32.82 1hvy n PRO 275 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1hvy s PHE 276 N -0.27 2.02 0.46 6.00 0.08 -1.26 -4.80 117.98 120.22 1hvy s PHE 276 Ca 0.78 1.52 -0.08 0.00 0.12 0.00 0.00 56.93 59.26 1hvy s PHE 276 Cb -1.09 -3.67 0.11 0.00 -0.57 0.00 0.00 43.02 37.80 1hvy s PHE 276 CO 0.53 -2.94 0.58 -0.35 -0.10 0.00 0.00 175.22 172.94 1hvy n PRO 277 N -2.16 -0.87 -4.38 0.24 -0.04 -1.24 -4.73 135.00 121.81 1hvy n PRO 277 Ca 0.16 -0.90 -0.26 0.00 -0.04 0.00 0.00 63.50 62.46 1hvy n PRO 277 Cb 0.48 -0.64 -0.13 0.00 -0.04 0.00 0.00 33.50 33.17 1hvy n PRO 277 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1hvy s LYS 278 N -4.27 1.26 -0.21 0.54 1.02 -0.46 -0.67 119.74 116.94 1hvy s LYS 278 Ca 0.34 -1.19 -0.05 0.00 0.02 0.00 0.00 55.97 55.09 1hvy s LYS 278 Cb -0.01 -1.57 -0.02 0.00 -0.52 0.00 0.00 37.83 35.70 1hvy s LYS 278 CO 0.24 0.37 -0.01 -1.17 -0.92 0.00 0.00 175.35 173.86 1hvy s LEU 279 N -1.85 3.10 -0.17 3.17 2.96 -1.26 -0.71 118.68 123.93 1hvy s LEU 279 Ca 0.09 -0.29 -0.05 0.00 -0.22 0.00 0.00 54.13 53.66 1hvy s LEU 279 Cb -0.10 -1.79 -0.03 0.00 0.50 0.00 0.00 46.19 44.77 1hvy s LEU 279 CO 0.04 0.02 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.95 1hvy s ARG 280 N 1.28 3.73 -0.42 1.98 1.81 0.15 -4.97 118.95 122.51 1hvy s ARG 280 Ca 0.04 -0.48 -0.14 0.00 -1.72 0.00 0.00 55.73 53.42 1hvy s ARG 280 Cb -0.15 -3.01 0.03 0.00 -0.45 0.00 0.00 34.95 31.38 1hvy s ARG 280 CO 0.00 0.21 0.31 0.42 -0.68 0.00 0.00 175.30 175.55 1hvy s ILE 281 N 0.48 5.15 -2.00 1.52 1.01 -1.26 -1.41 121.20 124.69 1hvy s ILE 281 Ca -0.02 -0.78 0.04 0.00 0.00 0.00 0.00 60.65 59.89 1hvy s ILE 281 Cb -0.14 -3.91 0.11 0.00 0.01 0.00 0.00 42.46 38.53 1hvy s ILE 281 CO 0.02 -0.36 0.77 0.18 0.00 0.00 0.00 174.94 175.56 1hvy n LEU 282 N 5.14 0.00 -3.54 2.97 4.77 0.53 -4.81 117.00 122.06 1hvy n LEU 282 Ca -0.11 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.72 1hvy n LEU 282 Cb 0.46 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.50 1hvy n LEU 282 CO 0.42 0.00 0.56 -0.60 -1.33 0.00 0.00 177.39 176.43 1hvy s ARG 283 N -2.00 0.90 -0.35 3.23 3.52 -1.26 -5.06 118.95 117.93 1hvy s ARG 283 Ca 0.06 0.19 -0.29 0.00 -0.13 0.00 0.00 55.73 55.56 1hvy s ARG 283 Cb 0.03 0.43 0.02 0.00 -1.56 0.00 0.00 34.95 33.86 1hvy s ARG 283 CO 0.05 -0.29 1.14 0.21 -0.81 0.00 0.00 175.30 175.59 1hvy s LYS 284 N -1.27 3.96 -0.08 5.12 2.47 -1.26 -5.01 119.74 123.68 1hvy s LYS 284 Ca -0.07 1.01 0.01 0.00 -1.56 0.00 0.00 55.97 55.35 1hvy s LYS 284 Cb -0.00 -3.80 -0.03 0.00 -1.46 0.00 0.00 37.83 32.54 1hvy s LYS 284 CO 0.06 -1.05 -0.08 0.08 0.16 0.00 0.00 175.35 174.53 1hvy s VAL 285 N 3.97 3.61 -0.24 4.02 1.01 -1.26 -5.03 120.40 126.49 1hvy s VAL 285 Ca 0.48 -0.50 0.07 0.00 0.00 0.00 0.00 61.98 62.03 1hvy s VAL 285 Cb -0.12 -2.49 -0.19 0.00 0.00 0.00 0.00 36.38 33.58 1hvy s VAL 285 CO 0.20 0.58 -0.14 -0.62 0.00 0.00 0.00 175.10 175.13 1hvy n GLU 286 N 2.46 0.67 -4.59 2.72 1.02 -1.26 -4.39 120.64 117.27 1hvy n GLU 286 Ca -0.18 0.10 -0.33 0.00 -0.02 0.00 0.00 57.16 56.73 1hvy n GLU 286 Cb 0.53 -1.51 -0.11 0.00 -0.02 0.00 0.00 31.44 30.33 1hvy n GLU 286 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1hvy s LYS 287 N -2.50 2.71 0.36 3.49 -0.14 -1.26 -4.88 119.74 117.52 1hvy s LYS 287 Ca -0.27 -0.58 0.05 0.00 -1.36 0.00 0.00 55.97 53.81 1hvy s LYS 287 Cb 0.08 -2.57 0.72 0.00 -1.68 0.00 0.00 37.83 34.38 1hvy s LYS 287 CO 0.66 0.65 1.97 0.97 -0.76 0.00 0.00 175.35 178.84 1hvy h ILE 288 N 4.14 1.05 0.00 2.17 6.09 -1.96 -0.84 117.51 128.15 1hvy h ILE 288 Ca -0.49 -0.27 0.00 0.00 -1.37 0.00 0.00 64.86 62.74 1hvy h ILE 288 Cb 1.17 0.20 0.00 0.00 0.47 0.00 0.00 36.82 38.66 1hvy h ILE 288 CO 0.53 0.14 0.00 0.47 -3.07 0.00 0.00 178.15 176.22 1hvy n ASP 289 N -4.47 0.00 0.09 2.19 10.43 -1.26 -3.23 116.55 120.29 1hvy n ASP 289 Ca 0.10 -0.08 0.03 0.00 2.57 0.00 0.00 54.79 57.41 1hvy n ASP 289 Cb 0.19 -0.26 -0.02 0.00 1.84 0.00 0.00 41.12 42.87 1hvy n ASP 289 CO 0.00 0.00 0.00 0.44 -1.07 0.00 0.00 177.20 176.57 1hvy h ASP 290 N 0.00 0.00 -3.20 -2.24 3.45 -1.56 -3.47 116.42 109.39 1hvy h ASP 290 Ca 0.00 0.00 -0.57 0.00 0.43 0.00 0.00 57.03 56.89 1hvy h ASP 290 Cb 0.18 0.00 0.11 0.00 -0.56 0.00 0.00 39.33 39.05 1hvy h ASP 290 CO 0.00 0.43 0.52 0.49 -1.57 0.00 0.00 179.24 179.10 1hvy n PHE 291 N -2.97 2.24 -4.28 4.55 3.72 -1.20 -5.02 117.46 114.51 1hvy n PHE 291 Ca -0.04 0.54 -0.18 0.00 -0.05 0.00 0.00 57.45 57.72 1hvy n PHE 291 Cb 0.74 -2.42 -0.11 0.00 -0.94 0.00 0.00 39.48 36.76 1hvy n PHE 291 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1hvy s LYS 292 N -1.64 1.14 0.33 -1.08 -0.14 -1.26 -5.04 119.74 112.05 1hvy s LYS 292 Ca 0.57 -1.40 0.08 0.00 -1.36 0.00 0.00 55.97 53.87 1hvy s LYS 292 Cb -0.58 -0.94 0.79 0.00 -1.68 0.00 0.00 37.83 35.41 1hvy s LYS 292 CO 0.60 0.16 1.82 0.00 -0.76 0.00 0.00 175.35 177.17 1hvy h ALA 293 N 3.07 1.78 0.00 5.17 0.00 -1.95 -0.27 119.26 127.06 1hvy h ALA 293 Ca -0.39 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 1hvy h ALA 293 Cb 1.20 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 1hvy h ALA 293 CO 0.56 -0.09 -0.03 0.93 0.00 0.00 0.00 179.25 180.63 1hvy h GLU 294 N 0.73 0.00 0.00 0.00 3.07 -2.01 -2.77 114.58 113.60 1hvy h GLU 294 Ca 0.52 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.38 1hvy h GLU 294 Cb 0.85 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1hvy h GLU 294 CO -0.29 0.03 0.00 -0.25 -1.40 0.00 0.00 179.01 177.10 1hvy n ASP 295 N -3.40 0.22 -4.44 1.42 10.43 -0.11 -4.80 116.55 115.88 1hvy n ASP 295 Ca -0.02 0.55 -0.30 0.00 2.57 0.00 0.00 54.79 57.59 1hvy n ASP 295 Cb 0.15 -0.60 -0.13 0.00 1.84 0.00 0.00 41.12 42.38 1hvy n ASP 295 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1hvy s PHE 296 N -3.10 2.48 -0.11 1.24 0.40 -1.05 -0.35 117.98 117.49 1hvy s PHE 296 Ca 0.06 -0.30 -0.04 0.00 -0.60 0.00 0.00 56.93 56.06 1hvy s PHE 296 Cb 0.10 -1.38 0.05 0.00 0.51 0.00 0.00 43.02 42.30 1hvy s PHE 296 CO 0.32 0.29 0.19 -1.14 0.70 0.00 0.00 175.22 175.58 1hvy s GLN 297 N -1.74 0.07 -0.13 0.44 0.74 -0.50 -4.97 119.66 113.57 1hvy s GLN 297 Ca 0.15 0.57 -0.22 0.00 0.05 0.00 0.00 55.36 55.91 1hvy s GLN 297 Cb -0.10 -0.31 -0.03 0.00 1.10 0.00 0.00 33.01 33.66 1hvy s GLN 297 CO 0.07 -0.34 0.68 0.42 -0.55 0.00 0.00 175.29 175.57 1hvy s ILE 298 N 2.32 5.02 0.05 -2.34 -1.09 -1.26 -0.68 121.20 123.22 1hvy s ILE 298 Ca 0.03 1.36 0.07 0.00 -2.23 0.00 0.00 60.65 59.87 1hvy s ILE 298 Cb -0.12 -4.01 -0.02 0.00 -1.58 0.00 0.00 42.46 36.72 1hvy s ILE 298 CO -0.07 0.18 -0.19 -1.83 -1.23 0.00 0.00 174.94 171.80 1hvy s GLU 299 N 1.36 1.24 -0.13 2.79 -1.05 0.12 -4.70 118.70 118.33 1hvy s GLU 299 Ca 0.34 -0.90 0.00 0.00 -0.15 0.00 0.00 54.97 54.26 1hvy s GLU 299 Cb -0.17 -1.34 0.00 0.00 -0.44 0.00 0.00 34.13 32.19 1hvy s GLU 299 CO 0.14 0.34 0.00 0.41 0.95 0.00 0.00 175.26 177.10 1hvy n GLY 300 N 1.81 0.50 3.62 -3.83 0.00 -1.26 -1.35 105.19 104.68 1hvy n GLY 300 Ca -0.18 -0.63 -0.43 0.00 0.00 0.00 0.00 46.02 44.78 1hvy n GLY 300 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1hvy s TYR 301 N -2.01 2.97 -0.54 1.61 5.04 -1.26 -4.48 117.35 118.67 1hvy s TYR 301 Ca 0.00 0.93 0.06 0.00 -2.44 0.00 0.00 57.07 55.62 1hvy s TYR 301 Cb 0.00 -4.09 0.22 0.00 0.35 0.00 0.00 41.96 38.44 1hvy s TYR 301 CO 0.00 -1.04 0.57 -1.71 -1.34 0.00 0.00 175.55 172.03 1hvy n ASN 302 N 7.39 1.89 -4.86 4.32 4.05 -1.26 -5.09 115.26 121.70 1hvy n ASN 302 Ca 0.12 -3.01 -0.31 0.00 0.45 0.00 0.00 54.58 51.83 1hvy n ASN 302 Cb 0.48 -0.66 0.01 0.00 1.23 0.00 0.00 39.78 40.85 1hvy n ASN 302 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1hvy s PRO 303 N -1.53 3.50 0.87 1.20 0.04 -1.26 -4.84 135.00 132.97 1hvy s PRO 303 Ca 0.35 0.81 -0.12 0.00 0.04 0.00 0.00 61.00 62.08 1hvy s PRO 303 Cb 0.11 -2.07 0.11 0.00 0.04 0.00 0.00 34.50 32.69 1hvy s PRO 303 CO -0.10 -0.65 1.12 -1.01 0.04 0.00 0.00 177.00 176.40 1hvy s HIS 304 N -3.10 2.63 0.72 0.56 3.76 0.75 -4.88 115.29 115.73 1hvy s HIS 304 Ca 0.56 0.97 -0.16 0.00 -0.15 0.00 0.00 55.06 56.28 1hvy s HIS 304 Cb -0.12 -3.28 -0.06 0.00 1.11 0.00 0.00 32.58 30.23 1hvy s HIS 304 CO 0.52 -2.14 0.37 -2.30 -0.85 0.00 0.00 174.74 170.34 1hvy n PRO 305 N -3.64 0.24 -1.81 8.40 -0.02 -1.26 -2.87 135.00 134.04 1hvy n PRO 305 Ca 0.07 0.11 -0.38 0.00 -2.02 0.00 0.00 63.50 61.28 1hvy n PRO 305 Cb 0.58 -1.68 0.04 0.00 -0.02 0.00 0.00 33.50 32.42 1hvy n PRO 305 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1hvy s THR 306 N -1.93 2.15 -0.16 3.45 -1.32 -1.26 -3.66 115.64 112.91 1hvy s THR 306 Ca 0.63 0.11 -0.01 0.00 -1.21 0.00 0.00 61.69 61.20 1hvy s THR 306 Cb -0.35 -3.05 0.04 0.00 -1.51 0.00 0.00 72.50 67.63 1hvy s THR 306 CO 0.61 -0.01 -0.03 -0.63 -2.21 0.00 0.00 174.62 172.35 1hvy s ILE 307 N -1.34 0.91 -0.19 5.08 1.01 -1.26 -4.88 121.20 120.53 1hvy s ILE 307 Ca 0.73 -0.51 -0.29 0.00 0.00 0.00 0.00 60.65 60.58 1hvy s ILE 307 Cb -0.39 -1.14 0.00 0.00 0.01 0.00 0.00 42.46 40.95 1hvy s ILE 307 CO 0.45 0.09 1.04 -0.54 0.00 0.00 0.00 174.94 175.99 1hvy s LYS 308 N 1.72 4.30 -0.64 2.79 1.02 -1.26 -4.98 119.74 122.69 1hvy s LYS 308 Ca 0.01 1.38 -0.06 0.00 0.02 0.00 0.00 55.97 57.33 1hvy s LYS 308 Cb -0.15 -3.62 0.17 0.00 -0.52 0.00 0.00 37.83 33.71 1hvy s LYS 308 CO -0.07 -0.55 0.48 -1.64 -0.92 0.00 0.00 175.35 172.66 1hvy s MET 309 N 2.88 2.74 0.04 1.68 -1.94 -1.26 -4.98 119.30 118.45 1hvy s MET 309 Ca 0.46 -2.41 -0.36 0.00 -1.71 0.00 0.00 55.69 51.68 1hvy s MET 309 Cb -0.16 -3.88 -0.15 0.00 2.01 0.00 0.00 34.83 32.65 1hvy s MET 309 CO 0.10 -1.19 1.58 -1.91 -0.01 0.00 0.00 175.02 173.58 1hvy n GLU 310 N 3.78 1.72 -2.45 2.03 4.07 -1.26 -4.82 120.64 123.71 1hvy n GLU 310 Ca 0.07 0.62 -0.41 0.00 -0.06 0.00 0.00 57.16 57.38 1hvy n GLU 310 Cb 0.40 -2.36 -0.04 0.00 -0.06 0.00 0.00 31.44 29.39 1hvy n GLU 310 CO 0.00 0.00 0.00 1.41 -0.06 0.00 0.00 177.13 178.48 1hvy s MET 311 N 1.66 4.56 0.35 5.31 -2.45 -1.26 -4.96 119.30 122.50 1hvy s MET 311 Ca 0.85 1.79 -0.27 0.00 -1.25 0.00 0.00 55.69 56.82 1hvy s MET 311 Cb -0.82 -3.25 -0.09 0.00 1.25 0.00 0.00 34.83 31.93 1hvy s MET 311 CO 0.46 0.03 1.10 0.00 1.05 0.00 0.00 175.02 177.66 1hvy s ALA 312 N -0.32 3.24 0.00 4.11 0.00 -1.26 -5.20 121.76 122.34 1hvy s ALA 312 Ca 0.50 0.84 0.00 0.00 0.00 0.00 0.00 51.96 53.30 1hvy s ALA 312 Cb -0.31 -3.32 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1hvy s ALA 312 CO 0.37 -0.26 0.00 1.55 0.00 0.00 0.00 175.76 177.42