#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hvy s PRO 27 N 0.00 2.65 0.06 0.52 0.04 -1.26 -4.95 135.00 132.06 1hvy s PRO 27 Ca 0.00 1.48 -0.31 0.00 0.04 0.00 0.00 61.00 62.21 1hvy s PRO 27 Cb 0.00 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.53 1hvy s PRO 27 CO 0.00 -1.38 1.74 -1.58 0.04 0.00 0.00 177.00 175.82 1hvy s HIS 28 N -2.25 2.14 0.58 0.56 2.46 -1.26 -4.88 115.29 112.63 1hvy s HIS 28 Ca 0.69 0.11 0.28 0.00 0.47 0.00 0.00 55.06 56.61 1hvy s HIS 28 Cb -0.22 -4.05 1.55 0.00 -0.13 0.00 0.00 32.58 29.73 1hvy s HIS 28 CO 0.42 -4.33 2.03 0.78 -2.47 0.00 0.00 174.74 171.17 1hvy h GLY 29 N 9.09 0.00 2.00 1.59 0.00 -1.93 -1.38 103.07 112.44 1hvy h GLY 29 Ca -0.44 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.89 1hvy h GLY 29 CO 0.94 0.00 -0.01 -2.09 0.00 0.00 0.00 176.54 175.38 1hvy h GLU 30 N 0.00 0.00 0.00 4.80 4.81 -1.96 -2.68 114.58 119.54 1hvy h GLU 30 Ca 0.15 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 1hvy h GLU 30 Cb 0.75 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.13 1hvy h GLU 30 CO -0.00 0.01 -0.09 -0.07 -0.73 0.00 0.00 179.01 178.13 1hvy h LEU 31 N 0.00 0.00 -0.32 1.64 3.38 -1.63 -1.98 115.31 116.39 1hvy h LEU 31 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1hvy h LEU 31 Cb 0.39 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1hvy h LEU 31 CO 0.00 0.09 -0.01 1.56 0.09 0.00 0.00 178.44 180.17 1hvy h GLN 32 N 0.00 0.57 -0.34 1.13 4.20 -1.66 0.34 115.11 119.34 1hvy h GLN 32 Ca -0.00 -0.19 -0.06 0.00 0.06 0.00 0.00 58.65 58.46 1hvy h GLN 32 Cb 0.34 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1hvy h GLN 32 CO 0.01 0.71 -0.02 -0.92 -0.67 0.00 0.00 178.83 177.94 1hvy h TYR 33 N 0.37 0.68 -0.50 2.96 5.03 -1.60 -0.92 116.97 122.99 1hvy h TYR 33 Ca 0.09 -0.13 -0.04 0.00 2.58 0.00 0.00 58.73 61.24 1hvy h TYR 33 Cb 0.46 -0.17 -0.02 0.00 1.55 0.00 0.00 36.73 38.54 1hvy h TYR 33 CO 0.04 0.75 0.16 -0.07 -1.32 0.00 0.00 178.16 177.71 1hvy h LEU 34 N 0.42 0.67 -0.95 2.82 3.38 -1.23 -1.68 115.31 118.73 1hvy h LEU 34 Ca 0.09 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1hvy h LEU 34 Cb 0.49 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1hvy h LEU 34 CO 0.02 0.64 -0.29 1.23 0.09 0.00 0.00 178.44 180.13 1hvy h GLY 35 N 0.89 0.46 1.86 0.83 0.00 -0.01 -0.60 103.07 106.50 1hvy h GLY 35 Ca 0.17 -0.38 -0.12 0.00 0.00 0.00 0.00 47.33 46.99 1hvy h GLY 35 CO -0.01 0.35 -0.53 1.46 0.00 0.00 0.00 176.54 177.81 1hvy h GLN 36 N 0.37 0.15 -0.25 4.80 4.20 -0.41 -1.21 115.11 122.76 1hvy h GLN 36 Ca 0.05 -0.09 -0.15 0.00 0.06 0.00 0.00 58.65 58.52 1hvy h GLN 36 Cb 0.69 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.48 1hvy h GLN 36 CO 0.05 0.65 -0.41 0.82 -0.67 0.00 0.00 178.83 179.27 1hvy h ILE 37 N 0.12 1.31 -0.13 2.54 1.08 -0.91 -2.18 117.51 119.34 1hvy h ILE 37 Ca 0.00 -1.62 0.01 0.00 -0.39 0.00 0.00 64.86 62.87 1hvy h ILE 37 Cb 0.98 1.73 -0.01 0.00 -3.07 0.00 0.00 36.82 36.45 1hvy h ILE 37 CO 0.08 0.51 0.04 1.56 -0.69 0.00 0.00 178.15 179.65 1hvy h GLN 38 N 0.44 0.10 0.16 2.37 1.08 -0.89 -1.73 115.11 116.63 1hvy h GLN 38 Ca 0.02 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1hvy h GLN 38 Cb 1.01 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.40 1hvy h GLN 38 CO 0.09 0.07 -0.16 1.25 -0.95 0.00 0.00 178.83 179.14 1hvy h HIS 39 N 0.10 -0.41 -0.94 2.96 2.76 -1.20 -1.03 115.15 117.40 1hvy h HIS 39 Ca 0.06 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.23 1hvy h HIS 39 Cb 0.04 0.16 -0.05 0.00 1.55 0.00 0.00 27.41 29.11 1hvy h HIS 39 CO -0.11 -0.24 0.60 0.82 -1.30 0.00 0.00 177.93 177.70 1hvy h ILE 40 N -0.34 1.25 -0.46 6.26 2.04 -1.31 -2.64 117.51 122.30 1hvy h ILE 40 Ca 0.00 -0.49 -0.11 0.00 1.00 0.00 0.00 64.86 65.26 1hvy h ILE 40 Cb 0.32 -0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.28 1hvy h ILE 40 CO -0.04 0.25 -0.16 -0.07 0.00 0.00 0.00 178.15 178.13 1hvy h LEU 41 N 1.28 0.88 -0.41 1.44 3.38 -1.14 0.44 115.31 121.18 1hvy h LEU 41 Ca 0.34 -0.30 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1hvy h LEU 41 Cb -0.11 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.40 1hvy h LEU 41 CO -0.07 1.03 -0.03 0.54 0.09 0.00 0.00 178.44 180.00 1hvy n ARG 42 N -4.13 1.16 -1.40 1.13 1.74 -0.41 -5.07 116.66 109.68 1hvy n ARG 42 Ca 0.01 -0.41 0.00 0.00 -0.77 0.00 0.00 57.85 56.68 1hvy n ARG 42 Cb 0.41 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.36 1hvy n ARG 42 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1hvy n GLY 44 N 1.13 -2.65 3.83 -0.13 0.00 0.15 -5.09 105.19 102.44 1hvy n GLY 44 Ca 0.20 -0.52 -0.37 0.00 0.00 0.00 0.00 46.02 45.33 1hvy n GLY 44 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hvy s VAL 45 N -4.80 5.37 -0.04 1.61 1.01 -0.30 -4.64 120.40 118.59 1hvy s VAL 45 Ca 0.00 0.39 -0.30 0.00 0.00 0.00 0.00 61.98 62.07 1hvy s VAL 45 Cb 0.00 -3.51 -0.07 0.00 0.00 0.00 0.00 36.38 32.80 1hvy s VAL 45 CO 0.00 0.56 1.92 -0.13 0.00 0.00 0.00 175.10 177.45 1hvy s ARG 46 N -0.68 3.97 -0.09 2.72 1.81 -1.26 -0.77 118.95 124.66 1hvy s ARG 46 Ca 0.16 2.37 -0.01 0.00 -1.72 0.00 0.00 55.73 56.54 1hvy s ARG 46 Cb -0.13 -4.15 0.03 0.00 -0.45 0.00 0.00 34.95 30.24 1hvy s ARG 46 CO 0.05 -1.13 -0.04 0.21 -0.68 0.00 0.00 175.30 173.71 1hvy s LYS 47 N 4.68 1.05 1.02 3.54 2.20 0.49 -4.94 119.74 127.78 1hvy s LYS 47 Ca 0.86 -0.07 -0.11 0.00 -0.36 0.00 0.00 55.97 56.28 1hvy s LYS 47 Cb -0.38 -1.25 0.21 0.00 -1.51 0.00 0.00 37.83 34.89 1hvy s LYS 47 CO 0.37 -0.27 1.09 -0.51 -0.36 0.00 0.00 175.35 175.67 1hvy s ASP 48 N 1.79 2.12 0.24 1.43 -0.00 -1.26 -1.36 116.67 119.63 1hvy s ASP 48 Ca 0.04 1.80 -0.13 0.00 -0.00 0.00 0.00 52.55 54.26 1hvy s ASP 48 Cb -0.13 -2.40 -0.00 0.00 -0.00 0.00 0.00 42.92 40.39 1hvy s ASP 48 CO -0.06 -3.54 0.46 1.51 -0.00 0.00 0.00 175.17 173.54 1hvy s ASP 49 N -2.70 -0.09 0.34 0.27 -4.77 -1.26 -4.79 116.67 103.67 1hvy s ASP 49 Ca 0.67 -0.91 0.12 0.00 -3.30 0.00 0.00 52.55 49.13 1hvy s ASP 49 Cb -0.23 0.57 0.97 0.00 -1.09 0.00 0.00 42.92 43.14 1hvy s ASP 49 CO 0.61 -1.11 1.72 -0.09 0.70 0.00 0.00 175.17 177.00 1hvy h ARG 50 N 2.28 0.48 0.00 2.11 2.43 -2.01 0.82 114.38 120.49 1hvy h ARG 50 Ca -0.27 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 58.87 1hvy h ARG 50 Cb 1.25 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1hvy h ARG 50 CO 0.37 0.32 -0.02 1.79 -1.51 0.00 0.00 179.97 180.92 1hvy h THR 51 N 0.50 0.04 0.00 0.20 1.35 -1.96 -3.47 112.91 109.57 1hvy h THR 51 Ca 0.66 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 1hvy h THR 51 Cb 1.38 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 69.65 1hvy h THR 51 CO -0.47 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 175.43 1hvy n GLY 52 N 0.74 0.81 0.10 5.82 0.00 0.28 -4.67 105.19 108.27 1hvy n GLY 52 Ca 0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.02 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 1.46 0.00 2.61 2.02 -1.91 -3.47 112.91 113.62 1hvy h THR 53 Ca 0.00 -2.70 0.00 0.00 0.77 0.00 0.00 66.41 64.48 1hvy h THR 53 Cb 0.00 2.49 0.00 0.00 -1.74 0.00 0.00 68.15 68.90 1hvy h THR 53 CO 0.00 0.75 0.00 0.61 0.37 0.00 0.00 175.52 177.25 1hvy n GLY 54 N 0.88 -1.05 3.34 2.16 0.00 -1.26 -4.52 105.19 104.73 1hvy n GLY 54 Ca -0.00 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.50 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 -2.58 0.00 -0.18 2.61 -4.23 -0.46 -2.44 115.64 108.35 1hvy s THR 55 Ca 0.00 -1.80 -0.02 0.00 -1.18 0.00 0.00 61.69 58.69 1hvy s THR 55 Cb 0.00 -2.42 -0.01 0.00 1.34 0.00 0.00 72.50 71.41 1hvy s THR 55 CO 0.00 0.00 -0.09 -0.76 -0.54 0.00 0.00 174.62 173.23 1hvy s LEU 56 N -3.14 2.76 0.08 4.79 1.02 -0.58 -0.38 118.68 123.23 1hvy s LEU 56 Ca 0.34 -0.39 0.05 0.00 0.02 0.00 0.00 54.13 54.15 1hvy s LEU 56 Cb 0.04 -1.67 -0.03 0.00 0.02 0.00 0.00 46.19 44.55 1hvy s LEU 56 CO 0.13 0.05 -0.14 -0.55 0.02 0.00 0.00 176.35 175.86 1hvy s SER 57 N 1.06 1.72 -0.01 2.29 0.15 0.05 -1.27 113.70 117.69 1hvy s SER 57 Ca 0.00 -0.66 0.00 0.00 0.70 0.00 0.00 55.95 55.99 1hvy s SER 57 Cb -0.15 -0.05 0.01 0.00 -1.71 0.00 0.00 66.02 64.13 1hvy s SER 57 CO -0.01 -0.10 0.01 -0.69 1.20 0.00 0.00 173.24 173.65 1hvy s VAL 58 N -1.48 -0.00 -0.26 4.45 1.01 -0.51 -1.16 120.40 122.46 1hvy s VAL 58 Ca 0.00 0.08 -0.08 0.00 0.00 0.00 0.00 61.98 61.98 1hvy s VAL 58 Cb -0.09 -0.06 -0.03 0.00 0.00 0.00 0.00 36.38 36.20 1hvy s VAL 58 CO 0.02 0.05 0.10 0.12 0.00 0.00 0.00 175.10 175.39 1hvy s PHE 59 N 0.46 3.12 0.00 5.22 2.19 -1.26 -1.33 117.98 126.38 1hvy s PHE 59 Ca -0.04 -0.27 0.00 0.00 0.33 0.00 0.00 56.93 56.95 1hvy s PHE 59 Cb -0.06 -2.27 0.00 0.00 -1.31 0.00 0.00 43.02 39.38 1hvy s PHE 59 CO -0.01 -0.30 0.00 0.41 1.83 0.00 0.00 175.22 177.15 1hvy n GLY 60 N 4.93 -0.99 3.23 13.12 0.00 -0.32 -5.02 105.19 120.15 1hvy n GLY 60 Ca -0.16 -0.75 -0.10 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.09 0.86 -0.14 1.61 -1.94 -1.04 -4.99 119.30 112.58 1hvy s MET 61 Ca 0.00 -0.80 -0.18 0.00 -1.71 0.00 0.00 55.69 53.00 1hvy s MET 61 Cb 0.00 0.36 0.05 0.00 2.01 0.00 0.00 34.83 37.24 1hvy s MET 61 CO 0.00 -0.28 0.48 -1.14 -0.01 0.00 0.00 175.02 174.07 1hvy s GLN 62 N -3.47 0.65 0.01 2.03 0.74 -1.26 -0.86 119.66 117.51 1hvy s GLN 62 Ca 0.02 0.47 -0.03 0.00 0.05 0.00 0.00 55.36 55.87 1hvy s GLN 62 Cb 0.03 0.31 -0.01 0.00 1.10 0.00 0.00 33.01 34.44 1hvy s GLN 62 CO -0.09 -0.12 0.03 0.00 -0.55 0.00 0.00 175.29 174.56 1hvy s ALA 63 N -0.22 -0.05 -0.22 1.58 0.00 -0.15 -4.98 121.76 117.72 1hvy s ALA 63 Ca -0.04 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.50 1hvy s ALA 63 Cb -0.03 0.14 0.03 0.00 0.00 0.00 0.00 23.12 23.25 1hvy s ALA 63 CO 0.03 -0.18 -0.14 0.50 0.00 0.00 0.00 175.76 175.97 1hvy s ARG 64 N -1.43 2.82 -0.27 0.00 3.52 -1.26 -0.51 118.95 121.81 1hvy s ARG 64 Ca -0.16 -0.96 -0.07 0.00 -0.13 0.00 0.00 55.73 54.42 1hvy s ARG 64 Cb -0.09 -2.77 -0.01 0.00 -1.56 0.00 0.00 34.95 30.52 1hvy s ARG 64 CO -0.00 -0.33 0.07 0.71 -0.81 0.00 0.00 175.30 174.94 1hvy s TYR 65 N 1.27 3.11 0.33 5.12 2.02 0.31 -4.96 117.35 124.55 1hvy s TYR 65 Ca 0.01 -0.73 -0.29 0.00 -0.37 0.00 0.00 57.07 55.69 1hvy s TYR 65 Cb -0.15 -2.25 -0.10 0.00 -0.40 0.00 0.00 41.96 39.06 1hvy s TYR 65 CO -0.09 -0.48 1.28 0.45 -1.57 0.00 0.00 175.55 175.14 1hvy s SER 66 N 1.55 6.82 -0.04 2.29 0.15 -1.26 -0.46 113.70 122.75 1hvy s SER 66 Ca 0.04 2.64 0.08 0.00 0.70 0.00 0.00 55.95 59.41 1hvy s SER 66 Cb -0.16 -2.65 0.19 0.00 -1.71 0.00 0.00 66.02 61.69 1hvy s SER 66 CO 0.03 -0.49 1.14 0.18 1.20 0.00 0.00 173.24 175.29 1hvy n LEU 67 N 0.83 2.51 -4.52 3.45 4.77 0.93 -4.57 117.00 120.41 1hvy n LEU 67 Ca -0.00 -2.29 -0.43 0.00 -0.03 0.00 0.00 56.01 53.27 1hvy n LEU 67 Cb 0.42 -0.19 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 1hvy n LEU 67 CO 0.58 0.62 0.75 -0.13 -1.33 0.00 0.00 177.39 177.88 1hvy s ARG 68 N -1.50 3.32 -1.83 3.23 0.52 -1.23 -4.16 118.95 117.30 1hvy s ARG 68 Ca 0.16 -0.29 0.00 0.00 -0.52 0.00 0.00 55.73 55.08 1hvy s ARG 68 Cb 0.12 -4.06 0.00 0.00 0.52 0.00 0.00 34.95 31.52 1hvy s ARG 68 CO 0.06 -1.50 0.00 -0.25 0.02 0.00 0.00 175.30 173.63 1hvy n ASP 69 N 7.46 -5.68 -3.51 0.23 8.00 -1.26 -4.95 116.55 116.83 1hvy n ASP 69 Ca 0.01 0.11 -0.12 0.00 0.71 0.00 0.00 54.79 55.51 1hvy n ASP 69 Cb 0.47 -4.77 -0.04 0.00 -0.02 0.00 0.00 41.12 36.77 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 -4.68 0.91 -0.14 -1.24 -1.05 -1.26 -4.89 118.70 106.35 1hvy s GLU 70 Ca 0.00 -0.08 0.01 0.00 -0.15 0.00 0.00 54.97 54.75 1hvy s GLU 70 Cb 0.00 0.43 0.02 0.00 -0.44 0.00 0.00 34.13 34.13 1hvy s GLU 70 CO 0.00 -0.35 -0.16 0.12 0.95 0.00 0.00 175.26 175.82 1hvy s PHE 71 N -2.25 2.28 -0.56 4.83 2.19 0.87 -4.45 117.98 120.90 1hvy s PHE 71 Ca -0.02 -1.23 -0.03 0.00 0.33 0.00 0.00 56.93 55.98 1hvy s PHE 71 Cb -0.01 -1.63 -0.03 0.00 -1.31 0.00 0.00 43.02 40.04 1hvy s PHE 71 CO -0.02 -0.64 1.69 -0.35 1.83 0.00 0.00 175.22 177.73 1hvy n PRO 72 N 4.51 1.28 -3.46 10.12 -0.04 -1.26 -3.77 135.00 142.38 1hvy n PRO 72 Ca -0.18 -1.08 -0.43 0.00 -0.04 0.00 0.00 63.50 61.77 1hvy n PRO 72 Cb 0.50 -2.26 -0.09 0.00 -0.04 0.00 0.00 33.50 31.61 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 0.06 5.24 0.37 1.53 2.96 -1.26 -4.32 118.68 123.25 1hvy s LEU 73 Ca 0.25 -1.09 -0.22 0.00 -0.22 0.00 0.00 54.13 52.84 1hvy s LEU 73 Cb 0.06 -2.14 -0.16 0.00 0.50 0.00 0.00 46.19 44.46 1hvy s LEU 73 CO -0.02 -0.51 0.20 0.18 -1.32 0.00 0.00 176.35 174.87 1hvy n LEU 74 N 5.14 -2.38 -0.01 -0.68 4.77 -1.26 -4.67 117.00 117.91 1hvy n LEU 74 Ca -0.12 0.87 0.02 0.00 -0.03 0.00 0.00 56.01 56.75 1hvy n LEU 74 Cb 0.46 -0.91 -0.05 0.00 -2.33 0.00 0.00 43.42 40.58 1hvy n LEU 74 CO 0.42 -3.90 -0.62 0.35 -1.33 0.00 0.00 177.39 172.32 1hvy n THR 75 N -0.83 0.12 0.72 -5.08 -2.24 -1.26 -4.45 114.28 101.26 1hvy n THR 75 Ca 0.12 -0.20 0.06 0.00 -2.27 0.00 0.00 64.05 61.77 1hvy n THR 75 Cb 0.37 0.02 0.35 0.00 -2.10 0.00 0.00 70.33 68.97 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 -1.88 0.12 -3.63 4.28 -2.24 -1.26 -0.19 114.28 109.47 1hvy n THR 76 Ca -0.04 0.03 -0.12 0.00 -2.27 0.00 0.00 64.05 61.65 1hvy n THR 76 Cb 0.33 -0.84 -0.07 0.00 -2.10 0.00 0.00 70.33 67.65 1hvy n THR 76 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1hvy s LYS 77 N -2.09 0.70 -0.24 -0.78 2.20 -1.26 -4.62 119.74 113.64 1hvy s LYS 77 Ca 0.17 0.84 -0.29 0.00 -0.36 0.00 0.00 55.97 56.33 1hvy s LYS 77 Cb 0.08 0.34 -0.02 0.00 -1.51 0.00 0.00 37.83 36.72 1hvy s LYS 77 CO 0.15 -0.08 1.45 0.50 -0.36 0.00 0.00 175.35 177.00 1hvy s ARG 78 N 0.34 3.91 -0.03 4.03 3.52 -1.17 -4.74 118.95 124.81 1hvy s ARG 78 Ca 0.01 1.52 -0.22 0.00 -0.13 0.00 0.00 55.73 56.91 1hvy s ARG 78 Cb -0.05 -3.94 -0.05 0.00 -1.56 0.00 0.00 34.95 29.35 1hvy s ARG 78 CO -0.02 -1.14 0.63 0.08 -0.81 0.00 0.00 175.30 174.04 1hvy s VAL 79 N 4.62 4.97 -0.75 7.11 1.01 -1.26 -4.77 120.40 131.32 1hvy s VAL 79 Ca 0.63 1.32 -0.26 0.00 0.00 0.00 0.00 61.98 63.67 1hvy s VAL 79 Cb -0.22 -3.97 -0.23 0.00 0.00 0.00 0.00 36.38 31.96 1hvy s VAL 79 CO 0.25 0.35 1.89 0.33 0.00 0.00 0.00 175.10 177.92 1hvy n PHE 80 N 3.18 1.25 -0.28 5.22 7.35 -1.26 -4.73 117.46 128.19 1hvy n PHE 80 Ca -0.05 -0.86 0.05 0.00 -0.76 0.00 0.00 57.45 55.84 1hvy n PHE 80 Cb 0.51 -1.93 0.27 0.00 0.35 0.00 0.00 39.48 38.68 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 10.06 0.98 -0.89 -5.13 2.91 -2.00 -1.22 115.95 120.66 1hvy h TRP 81 Ca 0.20 0.03 0.05 0.00 1.13 0.00 0.00 58.89 60.30 1hvy h TRP 81 Cb 0.84 -0.32 -0.06 0.00 -0.51 0.00 0.00 29.16 29.11 1hvy h TRP 81 CO 1.09 0.50 0.57 -0.22 -1.03 0.00 0.00 178.44 179.35 1hvy h LYS 82 N 0.95 1.03 -0.40 2.65 3.64 -2.00 -1.50 116.57 120.94 1hvy h LYS 82 Ca 0.38 -0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.70 1hvy h LYS 82 Cb 0.26 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1hvy h LYS 82 CO -0.15 0.68 0.23 0.78 -2.27 0.00 0.00 179.45 178.73 1hvy h GLY 83 N 1.06 0.59 0.72 5.01 0.00 -1.62 -1.73 103.07 107.10 1hvy h GLY 83 Ca 0.37 -0.25 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1hvy h GLY 83 CO -0.15 0.24 -0.24 -2.08 0.00 0.00 0.00 176.54 174.31 1hvy h VAL 84 N 0.52 0.48 -0.35 4.60 2.07 -0.97 -0.57 116.25 122.03 1hvy h VAL 84 Ca 0.14 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.68 1hvy h VAL 84 Cb 0.02 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.25 1hvy h VAL 84 CO -0.03 0.00 0.20 0.25 0.02 0.00 0.00 177.57 178.01 1hvy h LEU 85 N -0.51 0.32 -0.65 2.57 5.85 -1.24 -1.92 115.31 119.72 1hvy h LEU 85 Ca -0.00 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.61 1hvy h LEU 85 Cb 0.48 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 1hvy h LEU 85 CO -0.05 0.23 -0.19 -0.33 -0.34 0.00 0.00 178.44 177.75 1hvy h GLU 86 N 0.41 0.85 -0.18 1.25 4.39 -1.25 -2.08 114.58 117.97 1hvy h GLU 86 Ca 0.14 -0.33 -0.00 0.00 0.34 0.00 0.00 59.36 59.50 1hvy h GLU 86 Cb 0.01 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.61 1hvy h GLU 86 CO -0.07 0.97 0.10 1.49 -1.16 0.00 0.00 179.01 180.34 1hvy h GLU 87 N 0.74 0.25 -0.33 2.33 4.81 -0.91 0.53 114.58 122.02 1hvy h GLU 87 Ca 0.11 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 1hvy h GLU 87 Cb 0.72 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.03 1hvy h GLU 87 CO 0.06 0.24 0.19 1.25 -0.73 0.00 0.00 179.01 180.02 1hvy h LEU 88 N 0.20 0.40 -0.87 1.64 5.85 -1.27 0.35 115.31 121.62 1hvy h LEU 88 Ca 0.07 -0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.75 1hvy h LEU 88 Cb 0.05 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 40.93 1hvy h LEU 88 CO -0.01 0.34 0.57 -0.07 -0.34 0.00 0.00 178.44 178.92 1hvy h LEU 89 N 0.42 0.95 -0.28 2.25 3.38 -1.22 0.17 115.31 120.98 1hvy h LEU 89 Ca 0.12 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.09 1hvy h LEU 89 Cb 0.02 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 1hvy h LEU 89 CO -0.02 0.67 0.16 -0.25 0.09 0.00 0.00 178.44 179.08 1hvy h TRP 90 N 1.12 0.29 -0.11 1.13 7.01 -0.18 -1.28 115.95 123.94 1hvy h TRP 90 Ca 0.34 0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.36 1hvy h TRP 90 Cb -0.04 -0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 26.91 1hvy h TRP 90 CO -0.02 0.17 0.04 0.74 -2.79 0.00 0.00 178.44 176.58 1hvy h PHE 91 N 0.33 0.06 -0.62 2.65 0.04 0.64 -2.59 116.94 117.44 1hvy h PHE 91 Ca 0.11 0.01 0.13 0.00 2.80 0.00 0.00 57.97 61.02 1hvy h PHE 91 Cb 0.01 -0.01 -0.04 0.00 2.20 0.00 0.00 35.95 38.11 1hvy h PHE 91 CO -0.08 0.03 0.43 0.82 -0.60 0.00 0.00 178.31 178.91 1hvy h ILE 92 N 0.09 0.81 0.00 -0.55 2.04 -0.20 0.30 117.51 120.00 1hvy h ILE 92 Ca 0.05 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.81 1hvy h ILE 92 Cb 0.03 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1hvy h ILE 92 CO -0.05 0.05 0.00 0.29 0.00 0.00 0.00 178.15 178.44 1hvy n LYS 93 N -4.45 0.22 -0.83 2.37 5.02 -0.53 -4.88 118.16 115.08 1hvy n LYS 93 Ca 0.11 0.32 0.00 0.00 -2.02 0.00 0.00 58.31 56.72 1hvy n LYS 93 Cb 0.49 -1.83 0.00 0.00 -0.02 0.00 0.00 35.03 33.67 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 0.63 0.52 3.78 0.72 0.00 0.10 -5.03 105.19 105.91 1hvy n GLY 94 Ca 0.04 -0.57 -0.37 0.00 0.00 0.00 0.00 46.02 45.11 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 -2.52 6.92 -0.04 1.61 0.15 -1.14 -3.77 113.70 114.91 1hvy s SER 95 Ca 0.00 2.08 0.06 0.00 0.70 0.00 0.00 55.95 58.80 1hvy s SER 95 Cb 0.00 -2.60 0.10 0.00 -1.71 0.00 0.00 66.02 61.81 1hvy s SER 95 CO 0.00 -0.38 0.96 0.35 1.20 0.00 0.00 173.24 175.37 1hvy n THR 96 N 0.29 0.88 -3.55 6.45 -2.24 -1.26 -4.32 114.28 110.53 1hvy n THR 96 Ca 0.03 -1.00 -0.41 0.00 -2.27 0.00 0.00 64.05 60.40 1hvy n THR 96 Cb 0.48 0.35 -0.11 0.00 -2.10 0.00 0.00 70.33 68.95 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 -1.44 5.90 0.64 3.42 3.84 -1.26 -1.69 114.94 124.34 1hvy s ASN 97 Ca 0.11 -0.81 0.39 0.00 0.21 0.00 0.00 52.86 52.76 1hvy s ASN 97 Cb 0.09 -2.09 2.18 0.00 -0.55 0.00 0.00 41.25 40.89 1hvy s ASN 97 CO 0.01 -0.36 2.32 0.00 -2.79 0.00 0.00 177.10 176.28 1hvy h ALA 98 N 8.50 1.16 -0.53 1.71 0.00 -1.11 -2.41 119.26 126.59 1hvy h ALA 98 Ca -0.28 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.59 1hvy h ALA 98 Cb 1.12 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1hvy h ALA 98 CO 0.68 0.01 0.17 0.87 0.00 0.00 0.00 179.25 180.97 1hvy h LYS 99 N 0.00 0.82 -0.30 0.00 1.79 -1.92 -0.39 116.57 116.57 1hvy h LYS 99 Ca -0.00 -0.18 -0.05 0.00 -2.18 0.00 0.00 60.65 58.25 1hvy h LYS 99 Cb 0.04 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 30.55 1hvy h LYS 99 CO 0.00 0.75 -0.03 0.93 -1.08 0.00 0.00 179.45 180.03 1hvy h GLU 100 N 0.73 0.47 0.18 3.15 5.08 -1.83 0.39 114.58 122.75 1hvy h GLU 100 Ca 0.17 -0.10 -0.30 0.00 -1.00 0.00 0.00 59.36 58.13 1hvy h GLU 100 Cb 0.27 -0.07 0.02 0.00 0.50 0.00 0.00 28.75 29.48 1hvy h GLU 100 CO -0.01 0.52 -1.33 1.25 -1.00 0.00 0.00 179.01 178.44 1hvy h LEU 101 N 0.45 0.67 -1.93 1.33 5.85 -1.61 -3.21 115.31 116.87 1hvy h LEU 101 Ca 0.10 -0.69 -0.02 0.00 0.84 0.00 0.00 57.88 58.10 1hvy h LEU 101 Cb 0.34 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.15 1hvy h LEU 101 CO 0.01 1.53 -0.12 -1.28 -0.34 0.00 0.00 178.44 178.25 1hvy h SER 102 N 0.14 0.00 0.77 1.25 0.87 -0.60 -0.36 113.55 115.61 1hvy h SER 102 Ca -0.19 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 1hvy h SER 102 Cb 2.03 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.99 1hvy h SER 102 CO 0.24 0.12 0.00 -1.54 -0.53 0.00 0.00 176.83 175.11 1hvy n SER 103 N -3.93 0.18 -0.58 6.23 3.41 0.09 -1.85 113.62 117.17 1hvy n SER 103 Ca -0.02 0.53 0.13 0.00 -0.26 0.00 0.00 58.87 59.25 1hvy n SER 103 Cb 0.21 -0.57 0.31 0.00 -0.26 0.00 0.00 64.21 63.89 1hvy n SER 103 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1hvy n LYS 104 N -1.69 1.65 -0.36 4.33 4.76 -0.15 -4.91 118.16 121.79 1hvy n LYS 104 Ca 0.05 -1.16 0.00 0.00 -2.87 0.00 0.00 58.31 54.32 1hvy n LYS 104 Cb 0.25 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.97 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 1.28 0.81 3.20 0.72 0.00 -0.77 -5.04 105.19 105.40 1hvy n GLY 105 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1hvy n GLY 105 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1hvy s VAL 106 N -2.03 3.42 -1.35 1.61 1.01 -1.18 -4.96 120.40 116.91 1hvy s VAL 106 Ca 0.00 -1.49 0.19 0.00 0.00 0.00 0.00 61.98 60.68 1hvy s VAL 106 Cb 0.00 -3.06 0.70 0.00 0.00 0.00 0.00 36.38 34.02 1hvy s VAL 106 CO 0.00 -0.32 1.60 0.29 0.00 0.00 0.00 175.10 176.67 1hvy n LYS 107 N 4.70 3.48 -0.08 2.72 5.02 -1.26 -2.87 118.16 129.87 1hvy n LYS 107 Ca -0.10 -2.78 0.23 0.00 -2.02 0.00 0.00 58.31 53.64 1hvy n LYS 107 Cb 0.43 -1.82 0.68 0.00 -0.02 0.00 0.00 35.03 34.30 1hvy n LYS 107 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 1hvy h ILE 108 N 4.10 0.68 -0.26 -0.18 3.07 -1.95 -2.25 117.51 120.72 1hvy h ILE 108 Ca 0.00 -0.02 0.00 0.00 1.55 0.00 0.00 64.86 66.39 1hvy h ILE 108 Cb 1.34 0.63 0.00 0.00 -0.27 0.00 0.00 36.82 38.51 1hvy h ILE 108 CO 0.18 0.01 0.00 0.79 -1.05 0.00 0.00 178.15 178.08 1hvy n TRP 109 N -4.35 0.33 -0.22 0.16 7.02 -1.26 -4.63 117.44 114.48 1hvy n TRP 109 Ca 0.13 -0.22 -0.08 0.00 -1.02 0.00 0.00 57.50 56.31 1hvy n TRP 109 Cb 0.73 -0.01 0.05 0.00 -2.42 0.00 0.00 31.31 29.66 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 3.39 1.04 -0.61 -0.99 3.32 -1.70 -3.03 116.42 117.83 1hvy h ASP 110 Ca 0.00 -0.26 0.05 0.00 0.02 0.00 0.00 57.03 56.84 1hvy h ASP 110 Cb 0.80 -0.28 -0.05 0.00 0.22 0.00 0.00 39.33 40.03 1hvy h ASP 110 CO 0.00 1.05 0.34 0.00 -1.72 0.00 0.00 179.24 178.90 1hvy h ALA 111 N 1.07 0.80 0.00 3.45 0.00 -1.82 -1.30 119.26 121.46 1hvy h ALA 111 Ca 0.19 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1hvy h ALA 111 Cb 0.47 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1hvy h ALA 111 CO 0.02 0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.37 1hvy n ASN 112 N -4.81 0.07 -0.65 0.00 3.02 -1.15 -1.81 115.26 109.93 1hvy n ASN 112 Ca 0.07 0.52 0.06 0.00 -0.03 0.00 0.00 54.58 55.19 1hvy n ASN 112 Cb 0.15 -0.53 0.15 0.00 -0.61 0.00 0.00 39.78 38.94 1hvy n ASN 112 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hvy n GLY 113 N -0.28 2.55 3.71 7.41 0.00 -0.52 -4.68 105.19 113.38 1hvy n GLY 113 Ca 0.03 -0.39 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 1hvy n GLY 113 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1hvy s SER 114 N -1.00 3.71 0.06 1.61 0.01 -0.75 -0.18 113.70 117.17 1hvy s SER 114 Ca 0.23 2.20 -0.22 0.00 1.31 0.00 0.00 55.95 59.47 1hvy s SER 114 Cb 0.12 -2.57 -0.13 0.00 0.21 0.00 0.00 66.02 63.65 1hvy s SER 114 CO 0.16 -2.58 1.53 -0.09 0.41 0.00 0.00 173.24 172.68 1hvy h ARG 115 N -1.09 0.18 -0.10 12.44 9.65 -1.92 -0.72 114.38 132.81 1hvy h ARG 115 Ca -0.45 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 58.38 1hvy h ARG 115 Cb 1.27 -0.02 -0.00 0.00 -1.39 0.00 0.00 29.97 29.83 1hvy h ARG 115 CO 0.46 0.37 0.06 -0.44 2.80 0.00 0.00 179.97 183.22 1hvy h ASP 116 N -0.04 0.12 -0.61 -3.80 3.45 -1.94 -2.15 116.42 111.46 1hvy h ASP 116 Ca 0.03 -0.07 -0.04 0.00 0.43 0.00 0.00 57.03 57.39 1hvy h ASP 116 Cb 0.28 -0.03 -0.03 0.00 -0.56 0.00 0.00 39.33 38.99 1hvy h ASP 116 CO 0.00 0.16 0.23 0.15 -1.57 0.00 0.00 179.24 178.21 1hvy h PHE 117 N 0.08 0.93 -0.52 4.55 3.04 -1.82 -1.92 116.94 121.28 1hvy h PHE 117 Ca 0.04 -0.07 -0.04 0.00 3.98 0.00 0.00 57.97 61.88 1hvy h PHE 117 Cb 0.06 -0.28 -0.02 0.00 2.56 0.00 0.00 35.95 38.27 1hvy h PHE 117 CO -0.05 0.75 0.18 -0.07 -2.02 0.00 0.00 178.31 177.10 1hvy h LEU 118 N 0.85 0.70 -0.45 0.59 3.38 -1.07 -2.74 115.31 116.57 1hvy h LEU 118 Ca 0.20 -0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.93 1hvy h LEU 118 Cb 0.22 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1hvy h LEU 118 CO -0.02 0.65 -0.31 0.44 0.09 0.00 0.00 178.44 179.30 1hvy h ASP 119 N 0.75 1.01 0.08 -0.43 3.32 -1.03 0.86 116.42 120.98 1hvy h ASP 119 Ca 0.18 -0.43 0.00 0.00 0.02 0.00 0.00 57.03 56.80 1hvy h ASP 119 Cb 0.20 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.46 1hvy h ASP 119 CO -0.01 1.23 0.00 -1.54 -1.72 0.00 0.00 179.24 177.20 1hvy n SER 120 N -4.08 0.00 -0.17 6.45 3.41 -0.75 -0.58 113.62 117.90 1hvy n SER 120 Ca -0.01 0.29 0.03 0.00 -0.26 0.00 0.00 58.87 58.91 1hvy n SER 120 Cb 0.51 -0.33 0.01 0.00 -0.26 0.00 0.00 64.21 64.14 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 -1.33 1.17 0.00 1.04 4.77 -1.08 -4.99 117.00 116.58 1hvy n LEU 121 Ca 0.02 -0.88 0.00 0.00 -0.03 0.00 0.00 56.01 55.11 1hvy n LEU 121 Cb 0.03 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 1hvy n LEU 121 CO 0.03 0.25 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1hvy n GLY 122 N 0.51 0.73 2.75 -0.72 0.00 0.26 -4.99 105.19 103.73 1hvy n GLY 122 Ca 0.03 -0.49 -0.36 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.44 3.17 0.13 1.61 3.72 0.27 -4.76 117.46 119.17 1hvy n PHE 123 Ca 0.00 -2.86 -0.01 0.00 -0.05 0.00 0.00 57.45 54.53 1hvy n PHE 123 Cb 0.00 -0.91 0.22 0.00 -0.94 0.00 0.00 39.48 37.86 1hvy n PHE 123 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1hvy h SER 124 N 3.43 0.08 0.29 4.37 0.02 -1.85 -2.92 113.55 116.97 1hvy h SER 124 Ca 0.43 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 1hvy h SER 124 Cb 0.36 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.87 1hvy h SER 124 CO 1.13 0.59 -0.11 0.35 -1.14 0.00 0.00 176.83 177.65 1hvy n THR 125 N -3.93 0.00 -3.08 -2.27 -2.24 -1.26 -4.86 114.28 96.65 1hvy n THR 125 Ca -0.02 -0.08 -0.39 0.00 -2.27 0.00 0.00 64.05 61.29 1hvy n THR 125 Cb 0.54 -0.01 -0.05 0.00 -2.10 0.00 0.00 70.33 68.71 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 -2.41 4.42 0.49 -0.78 3.52 -1.10 -5.04 118.95 118.05 1hvy s ARG 126 Ca 0.30 0.86 -0.23 0.00 -0.13 0.00 0.00 55.73 56.54 1hvy s ARG 126 Cb 0.20 -3.41 -0.06 0.00 -1.56 0.00 0.00 34.95 30.12 1hvy s ARG 126 CO 0.46 0.17 1.26 -1.21 -0.81 0.00 0.00 175.30 175.17 1hvy s GLU 127 N 0.44 3.52 0.32 5.12 0.41 -1.26 -4.93 118.70 122.32 1hvy s GLU 127 Ca 0.36 2.01 -0.29 0.00 -0.41 0.00 0.00 54.97 56.64 1hvy s GLU 127 Cb -0.18 -2.38 -0.12 0.00 -1.78 0.00 0.00 34.13 29.66 1hvy s GLU 127 CO 0.18 -0.81 1.37 -1.91 -0.49 0.00 0.00 175.26 173.60 1hvy n GLU 128 N -0.65 2.22 0.00 1.61 2.13 -1.26 -2.15 120.64 122.55 1hvy n GLU 128 Ca 0.08 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.69 1hvy n GLU 128 Cb 0.46 -2.42 0.00 0.00 0.27 0.00 0.00 31.44 29.75 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 1.19 1.78 3.51 8.31 0.00 0.75 -4.92 105.19 115.82 1hvy n GLY 129 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 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 6.19 0.00 1.61 3.68 -0.91 -0.48 116.67 124.84 1hvy s ASP 130 Ca 0.00 -0.72 0.27 0.00 2.13 0.00 0.00 52.55 54.23 1hvy s ASP 130 Cb 0.00 -2.50 1.59 0.00 -1.45 0.00 0.00 42.92 40.55 1hvy s ASP 130 CO 0.00 -1.67 1.98 0.18 0.13 0.00 0.00 175.17 175.79 1hvy n LEU 131 N 8.69 0.00 0.00 -1.34 4.77 -0.68 -4.91 117.00 123.52 1hvy n LEU 131 Ca 0.02 0.06 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1hvy n LEU 131 Cb 0.48 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.51 1hvy n LEU 131 CO 0.68 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 1hvy n GLY 132 N 0.78 -2.55 2.94 -0.72 0.00 -1.26 -2.93 105.19 101.45 1hvy n GLY 132 Ca 0.19 -1.66 -0.39 0.00 0.00 0.00 0.00 46.02 44.16 1hvy n GLY 132 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1hvy n PRO 133 N -0.49 1.82 -0.93 1.61 -0.04 -1.26 -4.83 135.00 130.87 1hvy n PRO 133 Ca 0.00 -1.87 -0.01 0.00 -0.04 0.00 0.00 63.50 61.58 1hvy n PRO 133 Cb 0.00 -2.87 0.01 0.00 -0.04 0.00 0.00 33.50 30.59 1hvy n PRO 133 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1hvy n VAL 134 N 5.50 0.00 0.00 0.52 0.24 -1.26 -4.58 118.33 118.74 1hvy n VAL 134 Ca 0.49 -0.10 0.00 0.00 -2.04 0.00 0.00 64.34 62.69 1hvy n VAL 134 Cb 0.35 -1.16 0.00 0.00 -1.47 0.00 0.00 33.84 31.56 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 -1.26 0.00 -0.25 6.34 4.01 -1.26 -0.30 117.16 124.44 1hvy n TYR 135 Ca 0.01 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.79 1hvy n TYR 135 Cb 0.03 0.00 0.15 0.00 -0.31 0.00 0.00 39.34 39.21 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 0.81 0.99 2.72 0.00 -1.75 0.24 103.07 106.07 1hvy h GLY 136 Ca 0.00 0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.41 1hvy h GLY 136 CO 0.00 -0.28 0.21 -2.75 0.00 0.00 0.00 176.54 173.72 1hvy h PHE 137 N 0.10 0.85 -0.21 5.60 3.57 -0.75 -2.35 116.94 123.76 1hvy h PHE 137 Ca 0.40 -0.07 -0.06 0.00 3.53 0.00 0.00 57.97 61.77 1hvy h PHE 137 Cb 0.70 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 1hvy h PHE 137 CO -0.43 0.70 -0.11 1.96 -2.23 0.00 0.00 178.31 178.20 1hvy h GLN 138 N 0.76 0.44 -0.60 1.11 1.08 -0.50 0.31 115.11 117.72 1hvy h GLN 138 Ca 0.18 -0.20 0.01 0.00 -1.45 0.00 0.00 58.65 57.20 1hvy h GLN 138 Cb 0.21 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 27.60 1hvy h GLN 138 CO -0.01 0.74 0.40 -1.49 -0.95 0.00 0.00 178.83 177.51 1hvy h TRP 139 N 0.14 0.73 0.00 2.96 4.06 -0.55 -2.08 115.95 121.21 1hvy h TRP 139 Ca 0.04 0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.99 1hvy h TRP 139 Cb 0.61 -0.25 -0.00 0.00 -1.00 0.00 0.00 29.16 28.52 1hvy h TRP 139 CO 0.07 0.45 -1.71 0.54 -3.56 0.00 0.00 178.44 174.23 1hvy n ARG 140 N -4.45 0.58 -1.31 0.49 5.12 -0.89 -1.72 116.66 114.48 1hvy n ARG 140 Ca 0.06 -0.12 0.04 0.00 -1.93 0.00 0.00 57.85 55.90 1hvy n ARG 140 Cb 0.07 -1.35 0.05 0.00 -1.16 0.00 0.00 32.46 30.07 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 -2.07 0.00 -1.60 -1.55 8.25 0.11 -3.39 115.22 114.97 1hvy n HIS 141 Ca -0.05 -0.65 -0.59 0.00 -0.26 0.00 0.00 57.72 56.17 1hvy n HIS 141 Cb 0.44 -0.16 -0.08 0.00 1.12 0.00 0.00 29.99 31.31 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 0.20 1.26 -0.07 4.41 7.35 -0.78 -0.83 117.46 129.01 1hvy n PHE 142 Ca 0.08 0.93 0.00 0.00 -0.76 0.00 0.00 57.45 57.70 1hvy n PHE 142 Cb 1.06 -2.22 0.00 0.00 0.35 0.00 0.00 39.48 38.66 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 2.64 1.20 3.80 7.13 0.00 -1.26 -0.70 105.19 118.00 1hvy n GLY 143 Ca 0.23 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.50 2.73 -0.41 4.61 0.00 -0.01 -4.82 121.76 121.37 1hvy s ALA 144 Ca 0.00 0.42 -0.29 0.00 0.00 0.00 0.00 51.96 52.09 1hvy s ALA 144 Cb 0.00 -3.24 0.01 0.00 0.00 0.00 0.00 23.12 19.89 1hvy s ALA 144 CO 0.00 -0.80 1.31 -2.00 0.00 0.00 0.00 175.76 174.26 1hvy s GLU 145 N -4.01 3.69 0.17 0.00 2.56 -1.26 -4.99 118.70 114.86 1hvy s GLU 145 Ca 0.64 0.89 -0.30 0.00 0.00 0.00 0.00 54.97 56.20 1hvy s GLU 145 Cb -0.16 -3.96 -0.07 0.00 2.00 0.00 0.00 34.13 31.93 1hvy s GLU 145 CO 0.36 -1.42 1.07 -0.47 -0.56 0.00 0.00 175.26 174.24 1hvy s TYR 146 N 4.92 3.65 0.00 5.30 5.04 -1.26 -4.96 117.35 130.05 1hvy s TYR 146 Ca 0.56 1.66 0.00 0.00 -2.44 0.00 0.00 57.07 56.85 1hvy s TYR 146 Cb -0.12 -3.22 0.00 0.00 0.35 0.00 0.00 41.96 38.97 1hvy s TYR 146 CO 0.30 -0.40 0.00 0.54 -1.34 0.00 0.00 175.55 174.65 1hvy n ARG 147 N 2.35 0.00 -3.99 4.97 3.00 -1.26 -5.11 116.66 116.62 1hvy n ARG 147 Ca 0.02 0.00 -0.10 0.00 -0.01 0.00 0.00 57.85 57.76 1hvy n ARG 147 Cb 0.47 -0.03 -0.04 0.00 0.00 0.00 0.00 32.46 32.85 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 -0.56 0.11 0.60 0.55 1.47 -1.26 -5.04 116.67 112.54 1hvy s ASP 148 Ca 0.00 -1.04 0.31 0.00 1.18 0.00 0.00 52.55 53.00 1hvy s ASP 148 Cb 0.00 0.64 1.80 0.00 -0.34 0.00 0.00 42.92 45.02 1hvy s ASP 148 CO 0.00 -1.25 2.18 0.00 0.68 0.00 0.00 175.17 176.78 1hvy h MET 149 N 2.18 0.00 0.00 2.11 -0.00 -1.94 -1.79 114.93 115.49 1hvy h MET 149 Ca -0.27 0.00 -0.01 0.00 -0.00 0.00 0.00 59.70 59.43 1hvy h MET 149 Cb 1.25 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.85 1hvy h MET 149 CO 0.36 0.00 -0.29 0.93 -0.00 0.00 0.00 176.91 177.90 1hvy h GLU 150 N 0.00 0.00 -7.15 -0.10 4.39 -1.98 -3.45 114.58 106.30 1hvy h GLU 150 Ca 0.04 0.00 -0.55 0.00 0.34 0.00 0.00 59.36 59.19 1hvy h GLU 150 Cb 0.26 0.00 0.17 0.00 -0.10 0.00 0.00 28.75 29.08 1hvy h GLU 150 CO -0.00 0.02 0.45 0.43 -1.16 0.00 0.00 179.01 178.75 1hvy n SER 151 N -2.99 1.68 -4.41 1.42 7.64 -0.67 -4.98 113.62 111.30 1hvy n SER 151 Ca 0.03 0.73 -0.42 0.00 1.01 0.00 0.00 58.87 60.22 1hvy n SER 151 Cb 0.55 -1.54 -0.10 0.00 -1.01 0.00 0.00 64.21 62.10 1hvy n SER 151 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1hvy s ASP 152 N -1.67 5.93 -0.02 6.43 3.68 -1.26 -4.94 116.67 124.82 1hvy s ASP 152 Ca 0.79 -0.98 0.21 0.00 2.13 0.00 0.00 52.55 54.70 1hvy s ASP 152 Cb -0.35 -2.09 0.64 0.00 -1.45 0.00 0.00 42.92 39.67 1hvy s ASP 152 CO 0.44 -0.43 1.54 -1.22 0.13 0.00 0.00 175.17 175.63 1hvy n TYR 153 N 5.08 1.04 -1.62 -5.34 4.02 -1.26 -4.98 117.16 114.10 1hvy n TYR 153 Ca -0.11 -0.50 -0.52 0.00 -0.01 0.00 0.00 57.90 56.76 1hvy n TYR 153 Cb 0.46 -0.04 -0.06 0.00 -0.02 0.00 0.00 39.34 39.68 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 1.52 1.95 0.00 7.72 7.64 -1.26 -0.22 113.62 130.97 1hvy n SER 154 Ca 0.24 1.10 0.00 0.00 1.01 0.00 0.00 58.87 61.23 1hvy n SER 154 Cb 0.65 -1.21 0.00 0.00 -1.01 0.00 0.00 64.21 62.64 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 2.92 1.36 3.84 0.23 0.00 -1.26 -5.02 105.19 107.27 1hvy n GLY 155 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.01 3.35 0.80 1.61 -0.21 0.69 -5.01 119.66 120.88 1hvy s GLN 156 Ca 0.00 -0.20 0.00 0.00 0.02 0.00 0.00 55.36 55.18 1hvy s GLN 156 Cb 0.00 -3.10 0.00 0.00 1.00 0.00 0.00 33.01 30.91 1hvy s GLN 156 CO 0.00 0.75 0.00 0.41 -2.12 0.00 0.00 175.29 174.33 1hvy n GLY 157 N 1.90 -1.89 3.63 3.09 0.00 -1.26 -4.43 105.19 106.23 1hvy n GLY 157 Ca -0.19 -1.33 -0.39 0.00 0.00 0.00 0.00 46.02 44.11 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 -0.66 5.12 -1.27 1.61 1.01 0.12 -4.79 120.40 121.55 1hvy s VAL 158 Ca 0.00 0.80 -0.15 0.00 0.00 0.00 0.00 61.98 62.63 1hvy s VAL 158 Cb 0.00 -3.79 0.12 0.00 0.00 0.00 0.00 36.38 32.71 1hvy s VAL 158 CO 0.00 0.15 1.63 -0.67 0.00 0.00 0.00 175.10 176.21 1hvy n ASP 159 N 5.17 5.03 -0.34 3.32 -0.08 -1.22 -2.22 116.55 126.21 1hvy n ASP 159 Ca -0.06 -2.95 0.07 0.00 -1.51 0.00 0.00 54.79 50.34 1hvy n ASP 159 Cb 0.50 -1.65 0.23 0.00 2.34 0.00 0.00 41.12 42.55 1hvy n ASP 159 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 1hvy h GLN 160 N 7.19 0.86 -0.36 -0.67 4.20 -1.58 -1.69 115.11 123.07 1hvy h GLN 160 Ca 0.39 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 59.08 1hvy h GLN 160 Cb 0.85 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.40 1hvy h GLN 160 CO 1.39 0.57 0.16 1.25 -0.67 0.00 0.00 178.83 181.53 1hvy h LEU 161 N 0.89 0.21 -0.67 1.46 5.85 -1.76 0.16 115.31 121.45 1hvy h LEU 161 Ca 0.48 0.03 -0.14 0.00 0.84 0.00 0.00 57.88 59.09 1hvy h LEU 161 Cb 0.52 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1hvy h LEU 161 CO -0.28 0.16 -0.52 -0.61 -0.34 0.00 0.00 178.44 176.84 1hvy h GLN 162 N 0.33 0.38 -0.49 1.25 5.75 -1.75 -1.52 115.11 119.05 1hvy h GLN 162 Ca 0.16 -0.23 -0.10 0.00 -0.15 0.00 0.00 58.65 58.33 1hvy h GLN 162 Cb 0.09 0.02 -0.02 0.00 1.07 0.00 0.00 27.48 28.65 1hvy h GLN 162 CO -0.13 0.81 -0.08 -0.09 -2.65 0.00 0.00 178.83 176.69 1hvy h ARG 163 N 0.29 0.89 -0.17 1.69 9.65 -0.85 0.08 114.38 125.96 1hvy h ARG 163 Ca 0.01 -0.30 -0.02 0.00 -1.10 0.00 0.00 59.98 58.57 1hvy h ARG 163 Cb 1.02 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.52 1hvy h ARG 163 CO 0.09 0.93 0.02 0.28 2.80 0.00 0.00 179.97 184.09 1hvy h VAL 164 N 0.80 1.24 -0.29 0.20 2.07 -0.49 -0.72 116.25 119.06 1hvy h VAL 164 Ca 0.14 -0.78 0.01 0.00 0.82 0.00 0.00 66.70 66.89 1hvy h VAL 164 Cb 0.59 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 1hvy h VAL 164 CO 0.04 0.23 0.17 0.40 0.02 0.00 0.00 177.57 178.43 1hvy h ILE 165 N 0.06 1.03 -0.68 4.57 2.04 -1.07 -1.82 117.51 121.65 1hvy h ILE 165 Ca 0.05 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1hvy h ILE 165 Cb 0.34 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 1hvy h ILE 165 CO 0.01 0.06 0.32 0.44 0.00 0.00 0.00 178.15 178.98 1hvy h ASP 166 N 0.35 0.89 -0.71 1.72 3.45 -0.91 -2.73 116.42 118.48 1hvy h ASP 166 Ca 0.11 -0.14 -0.05 0.00 0.43 0.00 0.00 57.03 57.38 1hvy h ASP 166 Cb -0.00 -0.23 -0.03 0.00 -0.56 0.00 0.00 39.33 38.51 1hvy h ASP 166 CO -0.05 0.78 0.24 0.74 -1.57 0.00 0.00 179.24 179.37 1hvy h THR 167 N 0.94 1.25 -0.48 0.35 2.02 -0.91 -1.03 112.91 115.05 1hvy h THR 167 Ca 0.23 -0.87 -0.00 0.00 0.77 0.00 0.00 66.41 66.54 1hvy h THR 167 Cb 0.13 0.45 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1hvy h THR 167 CO -0.03 0.34 0.30 0.40 0.37 0.00 0.00 175.52 176.90 1hvy h ILE 168 N 1.06 1.14 0.01 3.11 2.04 -1.07 0.35 117.51 124.14 1hvy h ILE 168 Ca 0.24 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 1hvy h ILE 168 Cb 0.28 0.45 0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1hvy h ILE 168 CO -0.01 0.14 -0.00 0.11 0.00 0.00 0.00 178.15 178.38 1hvy h LYS 169 N 0.66 -0.01 0.12 2.37 1.57 -1.14 -3.24 116.57 116.90 1hvy h LYS 169 Ca 0.17 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.69 1hvy h LYS 169 Cb -0.04 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.28 1hvy h LYS 169 CO -0.03 0.77 -1.23 1.79 -0.57 0.00 0.00 179.45 180.17 1hvy h THR 170 N -0.81 1.51 -1.96 -0.16 1.35 -1.08 -3.42 112.91 108.34 1hvy h THR 170 Ca -0.00 -3.09 -0.47 0.00 -0.55 0.00 0.00 66.41 62.30 1hvy h THR 170 Cb 0.78 2.94 -0.32 0.00 -1.73 0.00 0.00 68.15 69.82 1hvy h THR 170 CO 0.00 0.90 -0.85 -3.20 -0.25 0.00 0.00 175.52 172.13 1hvy n ASN 171 N -3.52 -1.32 0.15 5.36 5.15 0.12 -4.99 115.26 116.21 1hvy n ASN 171 Ca -0.08 -2.53 0.11 0.00 -0.60 0.00 0.00 54.58 51.48 1hvy n ASN 171 Cb 1.02 0.10 0.54 0.00 -0.53 0.00 0.00 39.78 40.91 1hvy n ASN 171 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1hvy n PRO 172 N 2.83 0.15 0.08 1.20 -0.04 -1.22 -1.88 135.00 136.12 1hvy n PRO 172 Ca 0.26 0.57 0.13 0.00 -0.04 0.00 0.00 63.50 64.43 1hvy n PRO 172 Cb 0.50 -1.92 0.39 0.00 -0.04 0.00 0.00 33.50 32.43 1hvy n PRO 172 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1hvy n ASP 173 N -2.23 0.70 -4.62 3.54 8.00 -1.26 -3.56 116.55 117.13 1hvy n ASP 173 Ca -0.00 0.48 -0.54 0.00 0.71 0.00 0.00 54.79 55.44 1hvy n ASP 173 Cb 0.09 -0.60 -0.06 0.00 -0.02 0.00 0.00 41.12 40.53 1hvy n ASP 173 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1hvy n ASP 174 N -2.14 1.78 -1.73 -2.24 2.03 -0.79 -4.86 116.55 108.60 1hvy n ASP 174 Ca 0.05 1.11 0.09 0.00 0.52 0.00 0.00 54.79 56.56 1hvy n ASP 174 Cb 0.42 -1.17 0.38 0.00 -0.72 0.00 0.00 41.12 40.03 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 3.21 4.20 -0.29 -0.67 1.74 -1.26 -4.23 116.66 119.36 1hvy n ARG 175 Ca 0.20 -3.01 0.08 0.00 -0.77 0.00 0.00 57.85 54.35 1hvy n ARG 175 Cb 0.17 -2.04 0.16 0.00 -1.02 0.00 0.00 32.46 29.72 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 0.99 1.31 -2.57 5.56 1.74 -1.26 -4.95 116.66 117.48 1hvy n ARG 176 Ca 0.27 -2.75 -0.42 0.00 -0.77 0.00 0.00 57.85 54.18 1hvy n ARG 176 Cb 1.01 -1.47 -0.01 0.00 -1.02 0.00 0.00 32.46 30.97 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 -2.83 4.06 -0.03 0.55 1.01 -1.26 -4.93 121.20 117.76 1hvy s ILE 177 Ca 0.33 -1.61 0.05 0.00 0.00 0.00 0.00 60.65 59.42 1hvy s ILE 177 Cb 0.30 -5.16 -0.01 0.00 0.01 0.00 0.00 42.46 37.61 1hvy s ILE 177 CO -0.01 -1.99 -0.19 -0.63 0.00 0.00 0.00 174.94 172.11 1hvy s ILE 178 N 4.50 1.56 -0.22 2.92 1.01 -1.26 -1.19 121.20 128.53 1hvy s ILE 178 Ca 0.52 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 60.37 1hvy s ILE 178 Cb 0.03 -1.32 0.03 0.00 0.01 0.00 0.00 42.46 41.21 1hvy s ILE 178 CO 0.03 0.44 -0.14 -0.32 0.00 0.00 0.00 174.94 174.95 1hvy s MET 179 N -0.21 2.71 -0.18 2.79 -2.45 -0.91 -4.94 119.30 116.11 1hvy s MET 179 Ca 0.01 -1.03 -0.04 0.00 -1.25 0.00 0.00 55.69 53.38 1hvy s MET 179 Cb -0.10 -2.75 -0.02 0.00 1.25 0.00 0.00 34.83 33.21 1hvy s MET 179 CO 0.01 -0.36 -0.03 0.00 1.05 0.00 0.00 175.02 175.68 1hvy n ALA 181 N 3.97 2.45 -2.38 0.00 0.00 0.28 -4.66 120.51 120.18 1hvy n ALA 181 Ca -0.17 -0.52 -0.41 0.00 0.00 0.00 0.00 53.44 52.33 1hvy n ALA 181 Cb 0.52 -0.83 -0.03 0.00 0.00 0.00 0.00 19.45 19.11 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 -3.27 2.25 -0.36 0.00 -0.11 -0.81 -4.84 118.94 111.81 1hvy s TRP 182 Ca -0.05 0.47 0.01 0.00 1.22 0.00 0.00 56.10 57.75 1hvy s TRP 182 Cb 0.11 -4.38 0.10 0.00 -1.50 0.00 0.00 33.47 27.80 1hvy s TRP 182 CO 0.85 -2.01 0.09 1.21 -4.62 0.00 0.00 176.95 172.47 1hvy s ASN 183 N 4.57 4.93 0.29 5.86 3.84 -1.26 -5.01 114.94 128.16 1hvy s ASN 183 Ca 0.53 -2.03 0.04 0.00 0.21 0.00 0.00 52.86 51.61 1hvy s ASN 183 Cb -0.11 -1.70 0.74 0.00 -0.55 0.00 0.00 41.25 39.63 1hvy s ASN 183 CO 0.25 -0.42 1.67 -0.65 -2.79 0.00 0.00 177.10 175.16 1hvy h PRO 184 N 7.79 0.30 0.00 0.43 0.11 -2.01 -0.39 132.00 138.22 1hvy h PRO 184 Ca -0.09 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1hvy h PRO 184 Cb 1.03 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.08 1hvy h PRO 184 CO 0.58 0.20 0.00 0.07 -0.21 0.00 0.00 178.00 178.64 1hvy h ARG 185 N 0.31 0.00 0.00 1.05 0.11 -2.03 -3.22 114.38 110.60 1hvy h ARG 185 Ca 0.56 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.64 1hvy h ARG 185 Cb 1.12 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.20 1hvy h ARG 185 CO -0.59 0.00 -1.48 -0.25 0.10 0.00 0.00 179.97 177.75 1hvy n ASP 186 N -2.48 0.52 -0.34 0.08 10.43 -0.21 -4.54 116.55 120.01 1hvy n ASP 186 Ca 0.03 -0.51 0.19 0.00 2.57 0.00 0.00 54.79 57.07 1hvy n ASP 186 Cb 0.33 1.49 0.41 0.00 1.84 0.00 0.00 41.12 45.19 1hvy n ASP 186 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 1hvy h LEU 187 N 0.00 0.63 -2.09 0.64 3.38 -1.41 0.63 115.31 117.09 1hvy h LEU 187 Ca 0.00 0.15 0.01 0.00 0.09 0.00 0.00 57.88 58.13 1hvy h LEU 187 Cb 0.74 0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.55 1hvy h LEU 187 CO 0.00 0.03 0.02 -0.65 0.09 0.00 0.00 178.44 177.93 1hvy h PRO 188 N 0.51 0.00 -0.01 1.13 0.11 -1.81 -2.25 132.00 129.67 1hvy h PRO 188 Ca 0.67 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.78 1hvy h PRO 188 Cb 1.36 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.47 1hvy h PRO 188 CO -0.52 0.00 -0.20 1.28 -0.21 0.00 0.00 178.00 178.35 1hvy n LEU 189 N -4.40 0.83 -4.78 2.35 4.77 0.21 -4.91 117.00 111.07 1hvy n LEU 189 Ca -0.03 -0.16 -0.39 0.00 -0.03 0.00 0.00 56.01 55.40 1hvy n LEU 189 Cb 0.11 -0.15 -0.06 0.00 -2.33 0.00 0.00 43.42 41.00 1hvy n LEU 189 CO 0.33 0.15 0.27 -0.04 -1.33 0.00 0.00 177.39 176.77 1hvy s MET 190 N -2.49 4.27 0.00 3.23 -1.94 -0.85 -4.35 119.30 117.16 1hvy s MET 190 Ca 0.26 0.70 0.22 0.00 -1.71 0.00 0.00 55.69 55.16 1hvy s MET 190 Cb 0.19 -3.31 1.00 0.00 2.01 0.00 0.00 34.83 34.73 1hvy s MET 190 CO 0.50 0.45 1.71 0.00 -0.01 0.00 0.00 175.02 177.67 1hvy n ALA 191 N 2.44 2.05 -3.15 3.03 0.00 -1.15 -4.57 120.51 119.17 1hvy n ALA 191 Ca -0.08 -0.09 0.06 0.00 0.00 0.00 0.00 53.44 53.33 1hvy n ALA 191 Cb 0.51 -1.36 -0.01 0.00 0.00 0.00 0.00 19.45 18.59 1hvy n ALA 191 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1hvy s LEU 192 N -2.83 -0.23 0.56 0.00 2.96 -1.26 -5.08 118.68 112.80 1hvy s LEU 192 Ca 0.15 0.11 -0.20 0.00 -0.22 0.00 0.00 54.13 53.97 1hvy s LEU 192 Cb 0.14 1.18 -0.06 0.00 0.50 0.00 0.00 46.19 47.95 1hvy s LEU 192 CO 0.37 -0.04 0.94 -2.65 -1.32 0.00 0.00 176.35 173.65 1hvy n PRO 193 N 5.39 0.99 -1.69 0.98 -0.02 -1.26 -4.84 135.00 134.54 1hvy n PRO 193 Ca -0.04 0.37 -0.44 0.00 -2.02 0.00 0.00 63.50 61.37 1hvy n PRO 193 Cb 0.55 -2.10 -0.04 0.00 -0.02 0.00 0.00 33.50 31.89 1hvy n PRO 193 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1hvy n PRO 194 N -0.65 2.44 0.17 0.52 -0.04 -1.26 -4.86 135.00 131.33 1hvy n PRO 194 Ca 0.12 0.88 0.14 0.00 -0.04 0.00 0.00 63.50 64.60 1hvy n PRO 194 Cb 0.45 -2.69 0.48 0.00 -0.04 0.00 0.00 33.50 31.71 1hvy n PRO 194 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1hvy s HIS 196 N -3.35 3.55 0.23 0.00 3.76 -1.26 -1.46 115.29 116.76 1hvy s HIS 196 Ca 0.05 -2.55 -0.05 0.00 -0.15 0.00 0.00 55.06 52.36 1hvy s HIS 196 Cb 0.09 -3.19 0.24 0.00 1.11 0.00 0.00 32.58 30.84 1hvy s HIS 196 CO 0.51 -0.93 1.74 0.00 -0.85 0.00 0.00 174.74 175.20 1hvy h ALA 197 N 7.74 1.04 -1.74 -1.40 0.00 -1.60 -3.39 119.26 119.89 1hvy h ALA 197 Ca -0.10 -0.26 0.26 0.00 0.00 0.00 0.00 54.91 54.82 1hvy h ALA 197 Cb 1.02 -0.22 -0.12 0.00 0.00 0.00 0.00 17.79 18.47 1hvy h ALA 197 CO 0.69 0.61 0.71 -0.48 0.00 0.00 0.00 179.25 180.78 1hvy s LEU 198 N -9.32 -0.12 0.03 0.00 0.05 -1.24 -0.56 118.68 107.53 1hvy s LEU 198 Ca -0.11 -0.19 -0.03 0.00 0.05 0.00 0.00 54.13 53.86 1hvy s LEU 198 Cb 0.15 1.64 -0.02 0.00 -2.05 0.00 0.00 46.19 45.90 1hvy s LEU 198 CO 0.83 -0.48 0.03 0.00 -0.55 0.00 0.00 176.35 176.18 1hvy s GLN 200 N -2.51 1.12 0.14 0.00 0.74 0.16 -2.15 119.66 117.17 1hvy s GLN 200 Ca -0.06 -0.59 0.05 0.00 0.05 0.00 0.00 55.36 54.82 1hvy s GLN 200 Cb -0.02 -1.10 -0.04 0.00 1.10 0.00 0.00 33.01 32.95 1hvy s GLN 200 CO -0.04 0.29 0.07 -0.06 -0.55 0.00 0.00 175.29 175.00 1hvy s PHE 201 N -0.47 3.05 -0.13 1.67 0.08 -0.33 0.28 117.98 122.13 1hvy s PHE 201 Ca 0.05 -0.04 -0.08 0.00 0.12 0.00 0.00 56.93 56.98 1hvy s PHE 201 Cb -0.06 -1.50 0.05 0.00 -0.57 0.00 0.00 43.02 40.94 1hvy s PHE 201 CO -0.00 0.51 0.31 -0.47 -0.10 0.00 0.00 175.22 175.47 1hvy s TYR 202 N -1.62 -0.41 -0.06 0.36 5.04 0.36 -4.52 117.35 116.50 1hvy s TYR 202 Ca 0.29 0.94 0.06 0.00 -2.44 0.00 0.00 57.07 55.91 1hvy s TYR 202 Cb -0.10 0.13 -0.01 0.00 0.35 0.00 0.00 41.96 42.33 1hvy s TYR 202 CO 0.21 -0.25 -0.23 0.08 -1.34 0.00 0.00 175.55 174.02 1hvy s VAL 203 N 1.03 1.92 -0.22 3.14 1.01 -1.23 -0.16 120.40 125.88 1hvy s VAL 203 Ca -0.07 -0.99 -0.12 0.00 0.00 0.00 0.00 61.98 60.80 1hvy s VAL 203 Cb -0.08 -1.63 0.07 0.00 0.00 0.00 0.00 36.38 34.74 1hvy s VAL 203 CO -0.08 0.54 0.55 0.54 0.00 0.00 0.00 175.10 176.65 1hvy s VAL 204 N -0.07 -0.06 -1.19 2.92 0.11 -0.92 -4.59 120.40 116.59 1hvy s VAL 204 Ca -0.05 0.05 -0.20 0.00 -2.93 0.00 0.00 61.98 58.85 1hvy s VAL 204 Cb -0.14 -0.80 0.00 0.00 -1.53 0.00 0.00 36.38 33.91 1hvy s VAL 204 CO 0.04 0.02 0.71 0.59 -3.33 0.00 0.00 175.10 173.13 1hvy n ASN 205 N 4.36 -4.33 -0.57 3.54 3.02 -1.26 -1.34 115.26 118.69 1hvy n ASN 205 Ca -0.21 -1.07 -0.07 0.00 -0.03 0.00 0.00 54.58 53.20 1hvy n ASN 205 Cb 0.57 -3.00 -0.03 0.00 -0.61 0.00 0.00 39.78 36.70 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 -2.62 -4.89 -4.44 6.41 7.64 -1.26 -4.95 113.62 109.50 1hvy n SER 206 Ca -0.13 0.16 -0.33 0.00 1.01 0.00 0.00 58.87 59.58 1hvy n SER 206 Cb 0.60 -3.46 -0.13 0.00 -1.01 0.00 0.00 64.21 60.21 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 -2.36 3.30 -0.24 1.43 2.02 -0.45 -0.67 118.70 121.73 1hvy s GLU 207 Ca 0.00 -0.62 -0.08 0.00 0.02 0.00 0.00 54.97 54.28 1hvy s GLU 207 Cb 0.00 -2.68 -0.04 0.00 0.10 0.00 0.00 34.13 31.51 1hvy s GLU 207 CO 0.00 0.32 0.10 -1.17 0.02 0.00 0.00 175.26 174.53 1hvy s LEU 208 N 0.10 3.74 0.26 1.80 2.96 0.99 -2.17 118.68 126.36 1hvy s LEU 208 Ca -0.04 -0.05 0.10 0.00 -0.22 0.00 0.00 54.13 53.92 1hvy s LEU 208 Cb -0.14 -2.00 -0.05 0.00 0.50 0.00 0.00 46.19 44.51 1hvy s LEU 208 CO 0.04 0.03 -0.09 -0.44 -1.32 0.00 0.00 176.35 174.57 1hvy s SER 209 N 1.24 4.15 -0.07 3.68 0.01 0.78 0.05 113.70 123.54 1hvy s SER 209 Ca 0.06 -0.78 -0.04 0.00 1.31 0.00 0.00 55.95 56.49 1hvy s SER 209 Cb -0.14 -0.62 0.03 0.00 0.21 0.00 0.00 66.02 65.49 1hvy s SER 209 CO 0.05 0.03 0.17 0.00 0.41 0.00 0.00 173.24 173.89 1hvy s GLN 211 N 0.69 2.80 -0.14 0.00 0.74 0.14 -0.54 119.66 123.36 1hvy s GLN 211 Ca -0.05 -0.84 -0.03 0.00 0.05 0.00 0.00 55.36 54.48 1hvy s GLN 211 Cb -0.07 -2.18 -0.03 0.00 1.10 0.00 0.00 33.01 31.84 1hvy s GLN 211 CO -0.04 0.21 -0.02 -1.17 -0.55 0.00 0.00 175.29 173.73 1hvy s LEU 212 N 0.25 3.38 -0.51 3.68 2.96 -0.47 0.40 118.68 128.37 1hvy s LEU 212 Ca -0.15 -0.04 -0.13 0.00 -0.22 0.00 0.00 54.13 53.59 1hvy s LEU 212 Cb -0.17 -1.80 0.13 0.00 0.50 0.00 0.00 46.19 44.84 1hvy s LEU 212 CO 0.07 0.23 0.44 -0.47 -1.32 0.00 0.00 176.35 175.30 1hvy s TYR 213 N 0.01 3.32 -0.55 5.38 6.14 0.02 -1.21 117.35 130.47 1hvy s TYR 213 Ca 0.02 -1.51 -0.18 0.00 0.64 0.00 0.00 57.07 56.03 1hvy s TYR 213 Cb -0.13 -3.68 0.09 0.00 0.42 0.00 0.00 41.96 38.66 1hvy s TYR 213 CO 0.02 -1.01 0.62 -1.14 0.64 0.00 0.00 175.55 174.69 1hvy s GLN 214 N 1.51 3.05 0.48 4.97 0.74 0.47 -2.19 119.66 128.70 1hvy s GLN 214 Ca 0.04 -1.27 0.15 0.00 0.05 0.00 0.00 55.36 54.33 1hvy s GLN 214 Cb -0.29 -4.21 1.16 0.00 1.10 0.00 0.00 33.01 30.77 1hvy s GLN 214 CO 0.02 -1.38 2.07 0.07 -0.55 0.00 0.00 175.29 175.52 1hvy h ARG 215 N 9.05 0.19 -3.17 1.67 0.11 -1.53 0.15 114.38 120.85 1hvy h ARG 215 Ca -0.29 -0.01 -0.25 0.00 0.10 0.00 0.00 59.98 59.53 1hvy h ARG 215 Cb 1.09 -0.04 -0.33 0.00 1.11 0.00 0.00 29.97 31.81 1hvy h ARG 215 CO 1.03 0.12 -0.59 0.45 0.10 0.00 0.00 179.97 181.08 1hvy s SER 216 N -6.68 0.12 -0.12 0.08 0.15 -1.22 -0.90 113.70 105.14 1hvy s SER 216 Ca -0.06 0.35 -0.01 0.00 0.70 0.00 0.00 55.95 56.92 1hvy s SER 216 Cb 0.18 0.26 0.03 0.00 -1.71 0.00 0.00 66.02 64.78 1hvy s SER 216 CO 0.71 -0.18 -0.02 -0.83 1.20 0.00 0.00 173.24 174.12 1hvy s GLY 217 N 1.54 0.67 -0.68 9.45 0.00 -0.67 -4.81 107.32 112.81 1hvy s GLY 217 Ca -0.05 -0.43 -0.27 0.00 0.00 0.00 0.00 44.72 43.96 1hvy s GLY 217 CO -0.06 1.07 1.25 -0.35 0.00 0.00 0.00 173.10 175.01 1hvy s ASP 218 N 1.84 6.26 0.28 1.64 3.68 -1.26 -1.89 116.67 127.21 1hvy s ASP 218 Ca 0.03 -0.26 -0.03 0.00 2.13 0.00 0.00 52.55 54.43 1hvy s ASP 218 Cb -0.14 -2.56 0.41 0.00 -1.45 0.00 0.00 42.92 39.18 1hvy s ASP 218 CO -0.07 -1.71 1.93 0.24 0.13 0.00 0.00 175.17 175.69 1hvy h MET 219 N 9.86 1.15 0.00 4.34 2.86 -1.54 -1.06 114.93 130.53 1hvy h MET 219 Ca -0.27 -0.07 -0.07 0.00 -2.06 0.00 0.00 59.70 57.24 1hvy h MET 219 Cb 1.05 -0.26 -0.01 0.00 0.06 0.00 0.00 31.60 32.44 1hvy h MET 219 CO 1.25 0.76 -0.44 0.78 1.06 0.00 0.00 176.91 180.32 1hvy h GLY 220 N 1.18 0.00 0.00 8.32 0.00 -1.90 -3.39 103.07 107.28 1hvy h GLY 220 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 1hvy h GLY 220 CO -0.11 0.00 0.00 -0.10 0.00 0.00 0.00 176.54 176.33 1hvy n LEU 221 N -3.12 0.00 -0.07 3.11 7.94 -1.16 -4.88 117.00 118.81 1hvy n LEU 221 Ca 0.02 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.82 1hvy n LEU 221 Cb 0.66 -0.08 -0.03 0.00 0.53 0.00 0.00 43.42 44.50 1hvy n LEU 221 CO 0.38 -0.26 0.93 1.23 -1.11 0.00 0.00 177.39 178.57 1hvy h GLY 222 N 0.00 0.38 -0.27 -3.96 0.00 -1.76 -3.35 103.07 94.11 1hvy h GLY 222 Ca 0.00 -0.17 0.07 0.00 0.00 0.00 0.00 47.33 47.23 1hvy h GLY 222 CO 0.00 0.16 -0.43 -2.08 0.00 0.00 0.00 176.54 174.19 1hvy h VAL 223 N 0.30 0.11 -0.99 4.60 2.07 -1.41 0.46 116.25 121.39 1hvy h VAL 223 Ca 0.09 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.76 1hvy h VAL 223 Cb 0.06 0.11 -0.09 0.00 -1.52 0.00 0.00 31.29 29.85 1hvy h VAL 223 CO -0.01 0.00 0.62 -0.65 0.02 0.00 0.00 177.57 177.54 1hvy h PRO 224 N -0.34 0.82 0.27 1.57 0.11 -1.76 0.17 132.00 132.83 1hvy h PRO 224 Ca 0.13 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.18 1hvy h PRO 224 Cb 0.59 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.52 1hvy h PRO 224 CO -0.56 0.54 -0.13 0.35 -0.21 0.00 0.00 178.00 177.99 1hvy h PHE 225 N 0.84 -0.34 -0.68 0.65 3.57 -1.35 -2.72 116.94 116.91 1hvy h PHE 225 Ca 0.52 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 62.09 1hvy h PHE 225 Cb 0.71 0.11 -0.04 0.00 2.79 0.00 0.00 35.95 39.52 1hvy h PHE 225 CO -0.00 -0.04 0.45 -0.91 -2.23 0.00 0.00 178.31 175.58 1hvy h ASN 226 N -0.63 0.56 0.22 0.41 -0.26 0.96 -0.43 115.58 116.41 1hvy h ASN 226 Ca -0.04 0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.70 1hvy h ASN 226 Cb 0.45 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.60 1hvy h ASN 226 CO 0.06 0.35 -0.10 0.40 -1.06 0.00 0.00 177.43 177.08 1hvy h ILE 227 N 0.63 0.86 -0.97 2.81 2.04 -0.65 -2.11 117.51 120.12 1hvy h ILE 227 Ca 0.30 -0.48 0.08 0.00 1.00 0.00 0.00 64.86 65.76 1hvy h ILE 227 Cb 0.36 1.14 -0.07 0.00 -0.74 0.00 0.00 36.82 37.52 1hvy h ILE 227 CO -0.10 0.11 0.62 0.00 0.00 0.00 0.00 178.15 178.78 1hvy h ALA 228 N 0.18 1.38 -0.45 1.87 0.00 -1.11 -1.11 119.26 120.03 1hvy h ALA 228 Ca -0.03 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1hvy h ALA 228 Cb 0.40 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1hvy h ALA 228 CO 0.05 0.34 0.29 1.03 0.00 0.00 0.00 179.25 180.96 1hvy h SER 229 N 1.07 0.50 1.03 0.00 0.87 -0.87 -0.10 113.55 116.05 1hvy h SER 229 Ca 0.44 -0.01 -0.16 0.00 -1.23 0.00 0.00 61.79 60.83 1hvy h SER 229 Cb 0.27 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 62.09 1hvy h SER 229 CO -0.20 0.36 -0.77 1.88 -0.53 0.00 0.00 176.83 177.57 1hvy h TYR 230 N 0.59 0.00 -0.43 2.24 0.05 -1.04 -1.76 116.97 116.62 1hvy h TYR 230 Ca 0.17 0.00 -0.08 0.00 0.05 0.00 0.00 58.73 58.86 1hvy h TYR 230 Cb -0.05 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 37.67 1hvy h TYR 230 CO -0.05 0.77 -0.07 0.00 -1.05 0.00 0.00 178.16 177.76 1hvy h ALA 231 N 1.23 1.07 -0.20 3.88 0.00 -0.92 -1.72 119.26 122.60 1hvy h ALA 231 Ca -0.01 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 1hvy h ALA 231 Cb 1.49 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.10 1hvy h ALA 231 CO 0.10 0.57 -0.11 1.25 0.00 0.00 0.00 179.25 181.07 1hvy h LEU 232 N 0.68 0.45 -1.35 0.00 5.85 -0.86 -2.35 115.31 117.73 1hvy h LEU 232 Ca 0.12 -0.42 0.04 0.00 0.84 0.00 0.00 57.88 58.47 1hvy h LEU 232 Cb 0.52 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.39 1hvy h LEU 232 CO 0.03 0.77 0.47 0.25 -0.34 0.00 0.00 178.44 179.62 1hvy h LEU 233 N 0.13 0.72 -0.46 2.25 5.85 -1.06 -0.12 115.31 122.61 1hvy h LEU 233 Ca 0.04 -0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.62 1hvy h LEU 233 Cb 0.60 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1hvy h LEU 233 CO 0.03 0.49 -0.25 0.74 -0.34 0.00 0.00 178.44 179.11 1hvy h THR 234 N 0.83 1.27 -0.37 1.05 2.02 -1.19 -1.09 112.91 115.42 1hvy h THR 234 Ca 0.30 -1.42 -0.00 0.00 0.77 0.00 0.00 66.41 66.06 1hvy h THR 234 Cb 0.13 1.19 -0.02 0.00 -1.74 0.00 0.00 68.15 67.71 1hvy h THR 234 CO -0.09 0.49 0.22 1.88 0.37 0.00 0.00 175.52 178.38 1hvy h TYR 235 N 0.83 0.50 -0.15 3.16 0.05 -0.75 0.12 116.97 120.73 1hvy h TYR 235 Ca 0.10 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.88 1hvy h TYR 235 Cb 0.83 -0.16 -0.01 0.00 1.01 0.00 0.00 36.73 38.40 1hvy h TYR 235 CO 0.06 0.37 0.10 0.52 -1.05 0.00 0.00 178.16 178.15 1hvy h MET 236 N 0.48 0.19 -0.15 4.88 2.86 -0.87 -0.59 114.93 121.72 1hvy h MET 236 Ca 0.13 -0.01 -0.12 0.00 -2.06 0.00 0.00 59.70 57.64 1hvy h MET 236 Cb 0.02 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 1hvy h MET 236 CO -0.02 0.13 -0.43 0.82 1.06 0.00 0.00 176.91 178.46 1hvy h ILE 237 N 0.20 1.31 -0.46 -1.22 2.04 -1.05 -2.66 117.51 115.66 1hvy h ILE 237 Ca 0.05 -1.59 -0.07 0.00 1.00 0.00 0.00 64.86 64.26 1hvy h ILE 237 Cb -0.02 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 1hvy h ILE 237 CO -0.01 0.48 0.01 0.00 0.00 0.00 0.00 178.15 178.63 1hvy h ALA 238 N 1.25 0.62 0.02 1.87 0.00 -0.56 -2.26 119.26 120.21 1hvy h ALA 238 Ca 0.02 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.69 1hvy h ALA 238 Cb 0.88 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 1hvy h ALA 238 CO 0.07 0.41 -0.24 1.25 0.00 0.00 0.00 179.25 180.75 1hvy h HIS 239 N 0.67 -0.64 0.00 0.00 -0.00 -0.90 0.13 115.15 114.40 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 0.49 0.28 0.00 0.00 -0.00 0.00 0.00 27.41 28.18 1hvy h HIS 239 CO 0.04 -0.33 0.00 0.44 -0.00 0.00 0.00 177.93 178.07 1hvy n ILE 240 N -5.36 0.57 0.82 6.26 -5.35 -1.02 -2.97 119.36 112.31 1hvy n ILE 240 Ca -0.05 -0.04 0.11 0.00 -0.27 0.00 0.00 62.75 62.50 1hvy n ILE 240 Cb 0.28 -0.75 0.11 0.00 -1.74 0.00 0.00 39.64 37.53 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 -2.01 0.07 -2.15 7.28 -2.24 -0.85 -4.96 114.28 109.42 1hvy n THR 241 Ca 0.05 -0.54 -0.08 0.00 -2.27 0.00 0.00 64.05 61.21 1hvy n THR 241 Cb 0.33 1.39 -0.00 0.00 -2.10 0.00 0.00 70.33 69.95 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 1.25 0.04 3.68 3.38 0.00 -0.46 -4.94 105.19 108.14 1hvy n GLY 242 Ca 0.13 -0.55 -0.25 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.28 3.02 -0.13 0.99 1.43 0.32 -5.04 118.68 116.99 1hvy s LEU 243 Ca 0.00 -1.12 -0.05 0.00 -1.03 0.00 0.00 54.13 51.93 1hvy s LEU 243 Cb 0.00 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.90 1hvy s LEU 243 CO 0.00 -0.42 0.06 -0.54 0.23 0.00 0.00 176.35 175.68 1hvy s LYS 244 N -3.80 3.49 0.19 1.70 -0.14 0.15 -4.22 119.74 117.11 1hvy s LYS 244 Ca 0.38 -0.31 -0.31 0.00 -1.36 0.00 0.00 55.97 54.36 1hvy s LYS 244 Cb 0.04 -3.06 -0.11 0.00 -1.68 0.00 0.00 37.83 33.03 1hvy s LYS 244 CO 0.20 0.56 1.59 -2.14 -0.76 0.00 0.00 175.35 174.80 1hvy s PRO 245 N -0.44 4.19 0.00 -1.68 0.02 -1.26 -0.01 135.00 135.83 1hvy s PRO 245 Ca 0.10 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.54 1hvy s PRO 245 Cb -0.12 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.28 1hvy s PRO 245 CO 0.02 -0.62 0.00 0.41 -0.33 0.00 0.00 177.00 176.48 1hvy n GLY 246 N 3.55 -0.15 3.30 0.52 0.00 0.11 -3.82 105.19 108.70 1hvy n GLY 246 Ca 0.13 0.00 -0.23 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 2.58 -0.23 1.61 -0.00 -1.26 -0.05 116.67 118.44 1hvy s ASP 247 Ca 0.00 -0.74 0.00 0.00 -0.00 0.00 0.00 52.55 51.81 1hvy s ASP 247 Cb 0.00 -0.14 0.03 0.00 -0.00 0.00 0.00 42.92 42.81 1hvy s ASP 247 CO 0.00 0.03 -0.11 0.12 -0.00 0.00 0.00 175.17 175.20 1hvy s PHE 248 N -1.45 3.01 -0.26 4.23 5.36 0.39 -1.52 117.98 127.74 1hvy s PHE 248 Ca 0.09 -1.72 -0.10 0.00 -0.96 0.00 0.00 56.93 54.24 1hvy s PHE 248 Cb -0.09 -1.99 -0.04 0.00 -0.34 0.00 0.00 43.02 40.56 1hvy s PHE 248 CO 0.05 -0.78 0.15 0.42 -1.46 0.00 0.00 175.22 173.60 1hvy s ILE 249 N 1.27 5.05 -0.35 3.12 1.09 0.30 -0.53 121.20 131.16 1hvy s ILE 249 Ca -0.00 0.08 -0.14 0.00 -1.10 0.00 0.00 60.65 59.49 1hvy s ILE 249 Cb -0.16 -3.38 -0.01 0.00 -1.06 0.00 0.00 42.46 37.85 1hvy s ILE 249 CO -0.07 0.30 0.28 -2.28 -0.10 0.00 0.00 174.94 173.07 1hvy s HIS 250 N 1.48 3.22 -0.14 3.97 2.46 0.33 -1.37 115.29 125.25 1hvy s HIS 250 Ca 0.07 -0.22 -0.02 0.00 0.47 0.00 0.00 55.06 55.35 1hvy s HIS 250 Cb -0.15 -2.55 -0.02 0.00 -0.13 0.00 0.00 32.58 29.73 1hvy s HIS 250 CO 0.07 -0.41 -0.07 0.99 -2.47 0.00 0.00 174.74 172.85 1hvy s THR 251 N 1.79 3.60 0.03 0.89 2.01 -0.35 -0.98 115.64 122.65 1hvy s THR 251 Ca 0.07 -0.47 0.05 0.00 0.31 0.00 0.00 61.69 61.66 1hvy s THR 251 Cb -0.17 -2.55 -0.03 0.00 0.01 0.00 0.00 72.50 69.75 1hvy s THR 251 CO 0.11 0.51 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.68 1hvy s LEU 252 N 0.29 2.97 0.00 4.42 1.43 -0.04 -0.39 118.68 127.36 1hvy s LEU 252 Ca -0.06 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 52.77 1hvy s LEU 252 Cb -0.15 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.34 1hvy s LEU 252 CO 0.04 0.25 0.00 0.61 0.23 0.00 0.00 176.35 177.48 1hvy n GLY 253 N 1.39 0.21 3.54 -3.19 0.00 0.54 -2.51 105.19 105.17 1hvy n GLY 253 Ca -0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 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 6.42 -0.31 1.61 -1.08 -0.08 -1.17 116.67 121.05 1hvy s ASP 254 Ca 0.00 -1.26 -0.24 0.00 -0.52 0.00 0.00 52.55 50.52 1hvy s ASP 254 Cb 0.00 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.92 1hvy s ASP 254 CO 0.00 -1.53 0.83 0.00 0.52 0.00 0.00 175.17 174.99 1hvy s ALA 255 N 4.84 3.51 0.06 3.66 0.00 -0.44 -1.68 121.76 131.71 1hvy s ALA 255 Ca 0.41 -0.39 0.01 0.00 0.00 0.00 0.00 51.96 51.99 1hvy s ALA 255 Cb -0.03 -3.36 -0.03 0.00 0.00 0.00 0.00 23.12 19.69 1hvy s ALA 255 CO -0.03 -1.27 -0.06 -3.38 0.00 0.00 0.00 175.76 171.01 1hvy s HIS 256 N 3.07 0.70 -0.16 0.00 -3.43 -0.79 -1.42 115.29 113.27 1hvy s HIS 256 Ca 0.34 -0.73 0.01 0.00 -0.80 0.00 0.00 55.06 53.89 1hvy s HIS 256 Cb -0.14 -0.43 0.01 0.00 -1.43 0.00 0.00 32.58 30.60 1hvy s HIS 256 CO 0.13 -0.15 -0.20 0.42 -2.00 0.00 0.00 174.74 172.95 1hvy s ILE 257 N -2.54 2.20 0.50 -5.38 1.01 -0.40 -1.19 121.20 115.41 1hvy s ILE 257 Ca -0.00 -0.92 -0.21 0.00 0.00 0.00 0.00 60.65 59.52 1hvy s ILE 257 Cb -0.02 -1.91 -0.07 0.00 0.01 0.00 0.00 42.46 40.48 1hvy s ILE 257 CO -0.03 0.54 1.15 -0.31 0.00 0.00 0.00 174.94 176.29 1hvy s TYR 258 N 1.01 2.76 0.27 3.97 1.51 -1.26 -1.52 117.35 124.09 1hvy s TYR 258 Ca -0.02 1.54 0.00 0.00 -1.01 0.00 0.00 57.07 57.58 1hvy s TYR 258 Cb -0.15 -3.35 0.55 0.00 -0.11 0.00 0.00 41.96 38.91 1hvy s TYR 258 CO -0.06 -1.58 1.78 -0.07 -1.11 0.00 0.00 175.55 174.52 1hvy h LEU 259 N 1.63 0.67 0.00 -1.29 4.07 -1.71 -0.11 115.31 118.56 1hvy h LEU 259 Ca -0.50 0.08 0.00 0.00 0.08 0.00 0.00 57.88 57.54 1hvy h LEU 259 Cb 1.26 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.96 1hvy h LEU 259 CO 0.59 0.30 0.00 -0.46 -1.08 0.00 0.00 178.44 177.79 1hvy n ASN 260 N -4.79 0.00 -0.04 -0.43 2.04 -1.26 -2.38 115.26 108.40 1hvy n ASN 260 Ca 0.18 -0.25 0.10 0.00 -0.44 0.00 0.00 54.58 54.16 1hvy n ASN 260 Cb 0.42 -0.17 -0.11 0.00 -2.53 0.00 0.00 39.78 37.39 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 -1.17 0.00 -0.01 -2.53 8.25 -0.06 -4.55 115.22 115.15 1hvy n HIS 261 Ca 0.12 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.49 1hvy n HIS 261 Cb 0.12 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.20 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 0.19 0.65 -0.02 1.59 2.04 -1.40 -0.18 117.51 120.39 1hvy h ILE 262 Ca 0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1hvy h ILE 262 Cb 0.50 0.65 -0.00 0.00 -0.74 0.00 0.00 36.82 37.24 1hvy h ILE 262 CO 0.00 0.00 0.01 -0.33 0.00 0.00 0.00 178.15 177.83 1hvy h GLU 263 N -0.14 0.02 -0.50 2.37 4.39 -1.80 -1.13 114.58 117.80 1hvy h GLU 263 Ca 0.09 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.77 1hvy h GLU 263 Cb 0.27 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 1hvy h GLU 263 CO -0.22 0.20 0.25 -1.00 -1.16 0.00 0.00 179.01 177.07 1hvy h PRO 264 N -0.16 0.69 -0.03 2.33 0.13 -1.79 -2.04 132.00 131.13 1hvy h PRO 264 Ca 0.00 -0.08 -0.09 0.00 -0.87 0.00 0.00 66.00 64.97 1hvy h PRO 264 Cb 0.18 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 31.16 1hvy h PRO 264 CO -0.00 0.53 -0.40 -0.07 -0.23 0.00 0.00 178.00 177.83 1hvy h LEU 265 N 0.69 0.06 -1.00 1.56 3.38 -0.82 -1.59 115.31 117.60 1hvy h LEU 265 Ca 0.18 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.02 1hvy h LEU 265 Cb 0.06 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1hvy h LEU 265 CO -0.03 0.46 -0.49 0.11 0.09 0.00 0.00 178.44 178.59 1hvy h LYS 266 N 0.05 0.00 -0.16 1.13 1.57 -0.51 -1.57 116.57 117.09 1hvy h LYS 266 Ca 0.00 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.60 1hvy h LYS 266 Cb 0.74 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.05 1hvy h LYS 266 CO 0.05 0.49 -0.63 0.82 -0.57 0.00 0.00 179.45 179.62 1hvy h ILE 267 N 0.00 1.31 -0.23 1.86 2.04 -0.95 -3.19 117.51 118.35 1hvy h ILE 267 Ca -0.00 -1.86 -0.05 0.00 1.00 0.00 0.00 64.86 63.94 1hvy h ILE 267 Cb 0.89 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.96 1hvy h ILE 267 CO 0.06 0.58 -0.09 -0.61 0.00 0.00 0.00 178.15 178.10 1hvy h GLN 268 N 0.39 0.37 0.00 2.37 4.15 -1.06 -2.63 115.11 118.70 1hvy h GLN 268 Ca -0.03 -0.09 -0.01 0.00 0.77 0.00 0.00 58.65 59.29 1hvy h GLN 268 Cb 1.26 -0.05 -0.00 0.00 0.21 0.00 0.00 27.48 28.90 1hvy h GLN 268 CO 0.13 0.47 -0.07 -0.07 -1.93 0.00 0.00 178.83 177.37 1hvy h LEU 269 N 0.35 0.00 -0.17 -2.39 3.38 -1.28 -2.32 115.31 112.88 1hvy h LEU 269 Ca 0.07 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1hvy h LEU 269 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 1hvy h LEU 269 CO 0.02 0.07 -0.01 0.00 0.09 0.00 0.00 178.44 178.60 1hvy n GLN 270 N -3.26 0.99 -3.59 1.13 6.02 -0.99 -4.82 117.38 112.85 1hvy n GLN 270 Ca -0.01 -0.17 -0.37 0.00 -0.01 0.00 0.00 57.00 56.45 1hvy n GLN 270 Cb 0.27 -1.50 -0.07 0.00 1.02 0.00 0.00 30.24 29.97 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 -2.13 4.05 -0.08 -1.09 0.52 -0.88 -5.07 118.95 114.28 1hvy s ARG 271 Ca 0.42 0.12 -0.28 0.00 -0.52 0.00 0.00 55.73 55.47 1hvy s ARG 271 Cb 0.21 -3.34 -0.02 0.00 0.52 0.00 0.00 34.95 32.32 1hvy s ARG 271 CO 0.39 0.42 0.91 -2.00 0.02 0.00 0.00 175.30 175.04 1hvy s GLU 272 N -0.10 4.44 0.82 3.54 2.56 -1.26 -4.94 118.70 123.76 1hvy s GLU 272 Ca 0.18 1.24 -0.14 0.00 0.00 0.00 0.00 54.97 56.25 1hvy s GLU 272 Cb -0.14 -3.51 0.05 0.00 2.00 0.00 0.00 34.13 32.54 1hvy s GLU 272 CO 0.06 -0.18 0.91 -2.30 -0.56 0.00 0.00 175.26 173.19 1hvy n PRO 273 N 4.52 0.12 -4.40 4.30 -0.02 -1.26 -4.85 135.00 133.40 1hvy n PRO 273 Ca 0.05 0.10 -0.27 0.00 -2.02 0.00 0.00 63.50 61.36 1hvy n PRO 273 Cb 0.50 -2.20 -0.12 0.00 -0.02 0.00 0.00 33.50 31.66 1hvy n PRO 273 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1hvy s ARG 274 N -3.73 1.44 0.09 -0.52 0.52 -1.26 -5.04 118.95 110.45 1hvy s ARG 274 Ca 0.69 -1.44 -0.36 0.00 -0.52 0.00 0.00 55.73 54.10 1hvy s ARG 274 Cb -0.29 -1.82 -0.18 0.00 0.52 0.00 0.00 34.95 33.18 1hvy s ARG 274 CO 0.55 0.41 1.02 -2.30 0.02 0.00 0.00 175.30 175.01 1hvy n PRO 275 N 0.55 0.42 -1.91 3.54 -0.02 -1.26 -4.79 135.00 131.53 1hvy n PRO 275 Ca -0.15 0.15 -0.38 0.00 -2.02 0.00 0.00 63.50 61.10 1hvy n PRO 275 Cb 0.55 -1.57 0.03 0.00 -0.02 0.00 0.00 33.50 32.49 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 -0.17 2.39 0.87 6.00 0.08 -1.26 -4.76 117.98 121.13 1hvy s PHE 276 Ca 0.81 1.44 -0.15 0.00 0.12 0.00 0.00 56.93 59.15 1hvy s PHE 276 Cb -1.07 -3.66 0.21 0.00 -0.57 0.00 0.00 43.02 37.93 1hvy s PHE 276 CO 0.54 -2.53 0.98 -0.35 -0.10 0.00 0.00 175.22 173.76 1hvy n PRO 277 N -1.12 -1.79 -4.43 0.24 -0.04 -1.25 -4.68 135.00 121.94 1hvy n PRO 277 Ca 0.11 -1.54 -0.25 0.00 -0.04 0.00 0.00 63.50 61.78 1hvy n PRO 277 Cb 0.47 -1.19 -0.11 0.00 -0.04 0.00 0.00 33.50 32.63 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 -5.18 1.56 -0.15 0.54 1.02 -0.32 -0.09 119.74 117.12 1hvy s LYS 278 Ca 0.59 -1.63 0.00 0.00 0.02 0.00 0.00 55.97 54.95 1hvy s LYS 278 Cb -0.03 -1.72 -0.00 0.00 -0.52 0.00 0.00 37.83 35.55 1hvy s LYS 278 CO 0.43 0.34 -0.16 -1.17 -0.92 0.00 0.00 175.35 173.88 1hvy s LEU 279 N -3.09 2.46 -0.11 3.17 2.96 -1.26 -1.47 118.68 121.34 1hvy s LEU 279 Ca 0.25 -0.47 -0.00 0.00 -0.22 0.00 0.00 54.13 53.68 1hvy s LEU 279 Cb -0.06 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 45.05 1hvy s LEU 279 CO 0.12 0.09 -0.08 -0.13 -1.32 0.00 0.00 176.35 175.02 1hvy s ARG 280 N 0.79 3.17 -0.41 1.98 1.81 0.10 -4.97 118.95 121.42 1hvy s ARG 280 Ca -0.06 -0.59 -0.12 0.00 -1.72 0.00 0.00 55.73 53.24 1hvy s ARG 280 Cb -0.15 -2.67 0.05 0.00 -0.45 0.00 0.00 34.95 31.72 1hvy s ARG 280 CO 0.00 0.41 0.27 0.42 -0.68 0.00 0.00 175.30 175.73 1hvy s ILE 281 N -0.14 4.76 -0.47 1.52 1.01 -1.26 -0.96 121.20 125.66 1hvy s ILE 281 Ca 0.01 -0.98 0.24 0.00 0.00 0.00 0.00 60.65 59.92 1hvy s ILE 281 Cb -0.13 -3.74 0.25 0.00 0.01 0.00 0.00 42.46 38.84 1hvy s ILE 281 CO 0.03 -0.37 1.71 0.18 0.00 0.00 0.00 174.94 176.49 1hvy n LEU 282 N 5.05 0.67 -4.05 2.97 4.77 -0.04 -4.82 117.00 121.56 1hvy n LEU 282 Ca -0.11 0.67 -0.13 0.00 -0.03 0.00 0.00 56.01 56.41 1hvy n LEU 282 Cb 0.45 -0.58 -0.11 0.00 -2.33 0.00 0.00 43.42 40.84 1hvy n LEU 282 CO 0.40 -0.57 -0.40 -0.60 -1.33 0.00 0.00 177.39 174.89 1hvy s ARG 283 N -3.32 0.50 -0.39 3.23 3.52 -1.26 -5.11 118.95 116.11 1hvy s ARG 283 Ca 0.04 -0.72 -0.29 0.00 -0.13 0.00 0.00 55.73 54.63 1hvy s ARG 283 Cb 0.09 -0.25 0.02 0.00 -1.56 0.00 0.00 34.95 33.25 1hvy s ARG 283 CO 0.39 0.04 1.15 0.21 -0.81 0.00 0.00 175.30 176.28 1hvy s LYS 284 N -1.51 3.86 -0.07 5.12 2.36 -1.26 -5.01 119.74 123.24 1hvy s LYS 284 Ca -0.10 0.86 -0.02 0.00 -2.55 0.00 0.00 55.97 54.16 1hvy s LYS 284 Cb -0.10 -3.85 -0.03 0.00 -1.05 0.00 0.00 37.83 32.80 1hvy s LYS 284 CO 0.00 -1.19 0.03 0.08 1.55 0.00 0.00 175.35 175.82 1hvy s VAL 285 N 4.22 4.49 -0.25 4.02 1.01 -1.26 -5.04 120.40 127.59 1hvy s VAL 285 Ca 0.49 -0.27 -0.04 0.00 0.00 0.00 0.00 61.98 62.16 1hvy s VAL 285 Cb -0.11 -2.94 -0.16 0.00 0.00 0.00 0.00 36.38 33.17 1hvy s VAL 285 CO 0.25 0.54 -0.21 1.21 0.00 0.00 0.00 175.10 176.89 1hvy n GLU 286 N 1.88 0.64 -4.35 2.72 4.07 -1.26 -4.48 120.64 119.86 1hvy n GLU 286 Ca -0.17 0.21 -0.30 0.00 -0.06 0.00 0.00 57.16 56.83 1hvy n GLU 286 Cb 0.54 -1.53 -0.11 0.00 -0.06 0.00 0.00 31.44 30.27 1hvy n GLU 286 CO 0.00 0.00 0.00 0.15 -0.06 0.00 0.00 177.13 177.22 1hvy s LYS 287 N -2.51 1.96 0.38 5.31 1.02 -1.26 -4.89 119.74 119.74 1hvy s LYS 287 Ca -0.35 -1.08 0.06 0.00 0.02 0.00 0.00 55.97 54.62 1hvy s LYS 287 Cb 0.10 -2.19 0.75 0.00 -0.52 0.00 0.00 37.83 35.97 1hvy s LYS 287 CO 0.58 0.50 1.98 0.97 -0.92 0.00 0.00 175.35 178.46 1hvy h ILE 288 N 3.54 1.15 0.00 2.17 6.09 -1.95 -1.45 117.51 127.06 1hvy h ILE 288 Ca -0.49 -0.47 0.00 0.00 -1.37 0.00 0.00 64.86 62.53 1hvy h ILE 288 Cb 1.17 0.72 0.00 0.00 0.47 0.00 0.00 36.82 39.18 1hvy h ILE 288 CO 0.48 0.18 0.00 0.47 -3.07 0.00 0.00 178.15 176.21 1hvy n ASP 289 N -4.38 0.02 0.15 2.19 10.43 -1.26 -3.30 116.55 120.40 1hvy n ASP 289 Ca 0.02 0.50 0.10 0.00 2.57 0.00 0.00 54.79 57.99 1hvy n ASP 289 Cb 0.15 -0.51 0.07 0.00 1.84 0.00 0.00 41.12 42.67 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 -3.84 -2.24 3.45 -1.67 -3.47 116.42 108.64 1hvy h ASP 290 Ca 0.00 0.00 -0.56 0.00 0.43 0.00 0.00 57.03 56.90 1hvy h ASP 290 Cb 0.35 0.00 0.16 0.00 -0.56 0.00 0.00 39.33 39.28 1hvy h ASP 290 CO 0.00 0.07 0.37 0.49 -1.57 0.00 0.00 179.24 178.60 1hvy n PHE 291 N -2.91 1.55 -4.03 4.55 3.72 -1.21 -5.03 117.46 114.11 1hvy n PHE 291 Ca 0.01 0.43 -0.09 0.00 -0.05 0.00 0.00 57.45 57.76 1hvy n PHE 291 Cb 0.57 -2.24 -0.11 0.00 -0.94 0.00 0.00 39.48 36.77 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 -2.97 0.44 0.32 -1.08 1.02 -1.26 -5.05 119.74 111.14 1hvy s LYS 292 Ca 0.77 -0.84 0.09 0.00 0.02 0.00 0.00 55.97 56.01 1hvy s LYS 292 Cb -0.41 0.11 0.85 0.00 -0.52 0.00 0.00 37.83 37.86 1hvy s LYS 292 CO 0.45 -0.06 1.74 0.00 -0.92 0.00 0.00 175.35 176.56 1hvy h ALA 293 N 4.11 1.76 0.00 5.17 0.00 -1.96 0.18 119.26 128.53 1hvy h ALA 293 Ca -0.33 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1hvy h ALA 293 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1hvy h ALA 293 CO 0.50 -0.21 0.00 0.39 0.00 0.00 0.00 179.25 179.92 1hvy n GLU 294 N -4.86 0.13 0.09 0.00 4.71 -1.26 -2.54 120.64 116.91 1hvy n GLU 294 Ca 0.26 0.42 0.12 0.00 -0.01 0.00 0.00 57.16 57.95 1hvy n GLU 294 Cb 0.70 -1.77 0.45 0.00 -1.01 0.00 0.00 31.44 29.82 1hvy n GLU 294 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1hvy n ASP 295 N -2.02 0.57 -4.54 1.62 10.43 0.63 -4.82 116.55 118.43 1hvy n ASP 295 Ca 0.02 0.59 -0.31 0.00 2.57 0.00 0.00 54.79 57.66 1hvy n ASP 295 Cb 0.17 -0.73 -0.11 0.00 1.84 0.00 0.00 41.12 42.29 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 -3.16 2.73 -0.08 1.24 0.40 -1.05 -0.86 117.98 117.20 1hvy s PHE 296 Ca 0.08 -0.15 -0.03 0.00 -0.60 0.00 0.00 56.93 56.23 1hvy s PHE 296 Cb 0.12 -1.51 0.04 0.00 0.51 0.00 0.00 43.02 42.18 1hvy s PHE 296 CO 0.47 0.34 0.15 -1.14 0.70 0.00 0.00 175.22 175.75 1hvy s GLN 297 N -1.64 0.04 -0.28 0.44 0.74 -0.13 -4.96 119.66 113.86 1hvy s GLN 297 Ca 0.17 0.51 -0.15 0.00 0.05 0.00 0.00 55.36 55.94 1hvy s GLN 297 Cb -0.11 -0.27 -0.03 0.00 1.10 0.00 0.00 33.01 33.70 1hvy s GLN 297 CO 0.08 -0.28 0.36 0.42 -0.55 0.00 0.00 175.29 175.33 1hvy s ILE 298 N 2.04 5.18 0.07 -2.34 -1.09 -1.26 0.00 121.20 123.80 1hvy s ILE 298 Ca 0.01 0.48 0.08 0.00 -2.23 0.00 0.00 60.65 58.99 1hvy s ILE 298 Cb -0.12 -3.70 -0.03 0.00 -1.58 0.00 0.00 42.46 37.03 1hvy s ILE 298 CO -0.06 0.13 -0.23 -1.83 -1.23 0.00 0.00 174.94 171.73 1hvy s GLU 299 N 2.05 1.42 0.00 2.79 -1.05 -0.54 -4.68 118.70 118.69 1hvy s GLU 299 Ca 0.14 -1.07 0.00 0.00 -0.15 0.00 0.00 54.97 53.89 1hvy s GLU 299 Cb -0.16 -1.62 0.00 0.00 -0.44 0.00 0.00 34.13 31.91 1hvy s GLU 299 CO 0.10 0.41 0.00 0.41 0.95 0.00 0.00 175.26 177.13 1hvy n GLY 300 N 1.58 0.45 3.55 -3.83 0.00 -1.26 -1.17 105.19 104.50 1hvy n GLY 300 Ca -0.18 -0.62 -0.43 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.00 2.71 -0.64 1.61 5.04 -1.26 -4.29 117.35 118.52 1hvy s TYR 301 Ca 0.00 0.16 0.05 0.00 -2.44 0.00 0.00 57.07 54.84 1hvy s TYR 301 Cb 0.00 -4.26 0.20 0.00 0.35 0.00 0.00 41.96 38.25 1hvy s TYR 301 CO 0.00 -1.46 0.55 -1.71 -1.34 0.00 0.00 175.55 171.60 1hvy n ASN 302 N 7.88 2.69 -4.88 4.32 4.05 -1.26 -5.07 115.26 122.99 1hvy n ASN 302 Ca 0.04 -3.16 -0.30 0.00 0.45 0.00 0.00 54.58 51.62 1hvy n ASN 302 Cb 0.48 -0.70 -0.01 0.00 1.23 0.00 0.00 39.78 40.78 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 -1.58 3.65 1.03 1.20 0.04 -1.26 -4.86 135.00 133.21 1hvy s PRO 303 Ca 0.31 0.54 -0.14 0.00 0.04 0.00 0.00 61.00 61.75 1hvy s PRO 303 Cb 0.03 -2.24 0.20 0.00 0.04 0.00 0.00 34.50 32.54 1hvy s PRO 303 CO -0.13 -0.33 1.11 -1.01 0.04 0.00 0.00 177.00 176.69 1hvy s HIS 304 N -2.84 1.82 0.63 0.56 3.76 0.74 -4.84 115.29 115.12 1hvy s HIS 304 Ca 0.52 0.83 -0.18 0.00 -0.15 0.00 0.00 55.06 56.08 1hvy s HIS 304 Cb -0.11 -3.36 -0.04 0.00 1.11 0.00 0.00 32.58 30.19 1hvy s HIS 304 CO 0.45 -3.03 0.94 -2.30 -0.85 0.00 0.00 174.74 169.95 1hvy n PRO 305 N -4.23 0.78 -1.80 8.40 -0.02 -1.26 -3.05 135.00 133.83 1hvy n PRO 305 Ca 0.07 0.31 -0.38 0.00 -2.02 0.00 0.00 63.50 61.48 1hvy n PRO 305 Cb 0.58 -2.16 0.04 0.00 -0.02 0.00 0.00 33.50 31.94 1hvy n PRO 305 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1hvy s THR 306 N -1.58 2.11 -0.12 3.45 2.01 -1.26 -4.06 115.64 116.19 1hvy s THR 306 Ca 0.76 0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.84 1hvy s THR 306 Cb -0.40 -3.04 0.02 0.00 0.01 0.00 0.00 72.50 69.09 1hvy s THR 306 CO 0.47 -0.00 -0.11 -0.63 -0.69 0.00 0.00 174.62 173.66 1hvy s ILE 307 N -1.32 1.28 -0.08 1.82 1.01 -1.26 -4.93 121.20 117.71 1hvy s ILE 307 Ca 0.72 -0.47 -0.28 0.00 0.00 0.00 0.00 60.65 60.63 1hvy s ILE 307 Cb -0.40 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 40.83 1hvy s ILE 307 CO 0.46 0.41 0.92 -0.54 0.00 0.00 0.00 174.94 176.19 1hvy s LYS 308 N 1.40 4.45 -0.29 2.79 -0.14 -1.26 -5.02 119.74 121.67 1hvy s LYS 308 Ca 0.01 1.26 -0.01 0.00 -1.36 0.00 0.00 55.97 55.87 1hvy s LYS 308 Cb -0.13 -3.51 0.05 0.00 -1.68 0.00 0.00 37.83 32.56 1hvy s LYS 308 CO -0.06 -0.17 -0.02 -1.64 -0.76 0.00 0.00 175.35 172.70 1hvy s MET 309 N 1.52 2.38 0.29 1.68 -1.94 -1.26 -4.92 119.30 117.04 1hvy s MET 309 Ca 0.46 -1.30 -0.29 0.00 -1.71 0.00 0.00 55.69 52.85 1hvy s MET 309 Cb -0.19 -3.13 -0.11 0.00 2.01 0.00 0.00 34.83 33.42 1hvy s MET 309 CO 0.20 -0.62 1.46 -1.21 -0.01 0.00 0.00 175.02 174.84 1hvy s GLU 310 N 1.22 4.23 0.52 2.03 8.01 -1.26 -4.97 118.70 128.48 1hvy s GLU 310 Ca -0.06 2.39 -0.21 0.00 0.01 0.00 0.00 54.97 57.11 1hvy s GLU 310 Cb -0.20 -3.06 -0.06 0.00 -4.31 0.00 0.00 34.13 26.50 1hvy s GLU 310 CO -0.02 -0.44 1.17 1.41 0.01 0.00 0.00 175.26 177.39 1hvy s MET 311 N -0.93 3.41 -0.10 1.61 -2.45 -1.26 -4.95 119.30 114.63 1hvy s MET 311 Ca 0.57 1.75 -0.10 0.00 -1.25 0.00 0.00 55.69 56.66 1hvy s MET 311 Cb -0.43 -2.14 -0.05 0.00 1.25 0.00 0.00 34.83 33.46 1hvy s MET 311 CO 0.49 -0.83 0.22 0.00 1.05 0.00 0.00 175.02 175.94 1hvy s ALA 312 N -1.63 3.79 0.00 4.11 0.00 -1.26 -5.18 121.76 121.59 1hvy s ALA 312 Ca 0.70 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 52.13 1hvy s ALA 312 Cb -0.28 -2.13 0.00 0.00 0.00 0.00 0.00 23.12 20.72 1hvy s ALA 312 CO 0.32 0.49 0.00 1.55 0.00 0.00 0.00 175.76 178.12