#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hmx s ILE 2 N 0.00 4.83 -0.34 0.53 1.01 -1.26 -5.00 121.20 120.97 3hmx s ILE 2 Ca 0.00 1.65 -0.29 0.00 0.00 0.00 0.00 60.65 62.01 3hmx s ILE 2 Cb 0.00 -4.15 0.02 0.00 0.01 0.00 0.00 42.46 38.34 3hmx s ILE 2 CO 0.00 -0.05 1.08 -1.10 0.00 0.00 0.00 174.94 174.86 3hmx s GLN 3 N 2.67 4.01 -0.15 2.79 -1.52 -1.26 -4.73 119.66 121.47 3hmx s GLN 3 Ca 0.37 0.99 -0.16 0.00 -1.95 0.00 0.00 55.36 54.61 3hmx s GLN 3 Cb -0.16 -3.76 -0.04 0.00 -0.22 0.00 0.00 33.01 28.83 3hmx s GLN 3 CO 0.09 -0.97 0.39 -1.64 -0.25 0.00 0.00 175.29 172.90 3hmx s MET 4 N 3.76 4.29 -0.27 2.91 -1.94 -1.26 -1.15 119.30 125.64 3hmx s MET 4 Ca 0.46 0.26 -0.01 0.00 -1.71 0.00 0.00 55.69 54.69 3hmx s MET 4 Cb -0.11 -3.44 0.08 0.00 2.01 0.00 0.00 34.83 33.37 3hmx s MET 4 CO 0.18 0.18 0.06 0.99 -0.01 0.00 0.00 175.02 176.41 3hmx s THR 5 N 0.62 1.00 0.30 2.05 2.01 -0.65 -4.47 115.64 116.50 3hmx s THR 5 Ca 0.21 -1.25 -0.12 0.00 0.31 0.00 0.00 61.69 60.84 3hmx s THR 5 Cb -0.14 -1.62 -0.08 0.00 0.01 0.00 0.00 72.50 70.67 3hmx s THR 5 CO 0.07 -0.48 0.67 -1.10 -0.69 0.00 0.00 174.62 173.10 3hmx s GLN 6 N 1.59 3.88 -0.16 4.92 -0.21 -1.26 -2.74 119.66 125.68 3hmx s GLN 6 Ca 0.05 0.48 -0.21 0.00 0.02 0.00 0.00 55.36 55.70 3hmx s GLN 6 Cb -0.18 -2.50 0.05 0.00 1.00 0.00 0.00 33.01 31.38 3hmx s GLN 6 CO -0.17 0.18 0.55 -1.54 -2.12 0.00 0.00 175.29 172.19 3hmx s SER 7 N -2.48 -0.55 0.53 5.90 1.04 -1.18 -4.41 113.70 112.55 3hmx s SER 7 Ca 0.51 0.92 -0.17 0.00 0.48 0.00 0.00 55.95 57.70 3hmx s SER 7 Cb -0.11 0.93 -0.07 0.00 0.10 0.00 0.00 66.02 66.88 3hmx s SER 7 CO 0.21 -0.30 1.01 -2.84 0.98 0.00 0.00 173.24 172.30 3hmx s PRO 8 N -0.18 3.78 0.38 4.02 0.02 -1.26 -2.41 135.00 139.35 3hmx s PRO 8 Ca -0.04 1.04 0.20 0.00 0.02 0.00 0.00 61.00 62.22 3hmx s PRO 8 Cb -0.03 -2.11 1.09 0.00 0.02 0.00 0.00 34.50 33.47 3hmx s PRO 8 CO 0.03 -0.41 1.57 0.77 -0.33 0.00 0.00 177.00 178.62 3hmx h SER 9 N 0.84 0.00 -3.75 2.53 0.02 -1.82 -3.43 113.55 107.94 3hmx h SER 9 Ca -0.47 0.00 0.21 0.00 -0.84 0.00 0.00 61.79 60.69 3hmx h SER 9 Cb 1.20 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.50 3hmx h SER 9 CO 0.60 0.00 0.82 -0.55 -1.14 0.00 0.00 176.83 176.56 3hmx s SER 10 N -3.86 -0.14 0.36 3.07 0.15 -1.26 -3.25 113.70 108.75 3hmx s SER 10 Ca -0.02 0.10 -0.09 0.00 0.70 0.00 0.00 55.95 56.64 3hmx s SER 10 Cb 0.06 0.13 0.03 0.00 -1.71 0.00 0.00 66.02 64.52 3hmx s SER 10 CO 0.18 -0.17 0.62 -1.48 1.20 0.00 0.00 173.24 173.59 3hmx s LEU 11 N -1.47 0.53 -0.04 3.45 0.05 -0.64 -4.92 118.68 115.64 3hmx s LEU 11 Ca 0.07 -1.30 0.01 0.00 0.05 0.00 0.00 54.13 52.96 3hmx s LEU 11 Cb -0.01 2.10 0.02 0.00 -2.05 0.00 0.00 46.19 46.26 3hmx s LEU 11 CO -0.05 -1.47 -0.04 -0.94 -0.55 0.00 0.00 176.35 173.31 3hmx s SER 12 N -3.15 0.85 0.16 1.48 1.04 -1.26 -1.41 113.70 111.41 3hmx s SER 12 Ca 0.23 -0.12 -0.05 0.00 0.48 0.00 0.00 55.95 56.50 3hmx s SER 12 Cb -0.03 -0.40 -0.02 0.00 0.10 0.00 0.00 66.02 65.67 3hmx s SER 12 CO 0.16 -0.05 0.18 0.00 0.98 0.00 0.00 173.24 174.52 3hmx s ALA 13 N 0.82 0.48 0.32 5.32 0.00 -0.56 -4.72 121.76 123.42 3hmx s ALA 13 Ca -0.11 -1.22 0.07 0.00 0.00 0.00 0.00 51.96 50.70 3hmx s ALA 13 Cb -0.14 0.94 -0.02 0.00 0.00 0.00 0.00 23.12 23.90 3hmx s ALA 13 CO 0.00 -0.59 0.39 -1.12 0.00 0.00 0.00 175.76 174.45 3hmx s SER 14 N -3.03 5.78 0.04 0.00 0.01 -1.26 -0.89 113.70 114.36 3hmx s SER 14 Ca 0.23 -0.26 -0.30 0.00 1.31 0.00 0.00 55.95 56.93 3hmx s SER 14 Cb 0.05 -1.22 -0.08 0.00 0.21 0.00 0.00 66.02 64.98 3hmx s SER 14 CO 0.03 -0.35 1.69 -0.69 0.41 0.00 0.00 173.24 174.32 3hmx s VAL 15 N -2.19 3.15 0.00 3.43 1.01 -1.26 -2.85 120.40 121.68 3hmx s VAL 15 Ca 0.42 0.48 0.00 0.00 0.00 0.00 0.00 61.98 62.88 3hmx s VAL 15 Cb -0.08 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.99 3hmx s VAL 15 CO 0.29 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.99 3hmx n GLY 16 N 4.08 0.75 3.89 4.51 0.00 -0.95 -4.90 105.19 112.57 3hmx n GLY 16 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 3hmx n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3hmx s ASP 17 N -2.34 6.35 -0.35 1.61 -0.00 -1.13 -4.19 116.67 116.62 3hmx s ASP 17 Ca 0.00 1.01 -0.19 0.00 -0.00 0.00 0.00 52.55 53.37 3hmx s ASP 17 Cb 0.00 -2.28 -0.00 0.00 -0.00 0.00 0.00 42.92 40.64 3hmx s ASP 17 CO 0.00 -0.53 0.56 -0.60 -0.00 0.00 0.00 175.17 174.60 3hmx s ARG 18 N -4.46 3.68 0.14 8.23 3.52 -1.24 -1.90 118.95 126.92 3hmx s ARG 18 Ca 0.49 -0.04 0.11 0.00 -0.13 0.00 0.00 55.73 56.16 3hmx s ARG 18 Cb -0.10 -3.80 -0.04 0.00 -1.56 0.00 0.00 34.95 29.45 3hmx s ARG 18 CO 0.41 -0.66 -0.24 0.14 -0.81 0.00 0.00 175.30 174.14 3hmx s VAL 19 N 2.51 2.42 -0.16 7.11 -7.23 -1.16 -4.98 120.40 118.91 3hmx s VAL 19 Ca 0.21 -1.77 -0.04 0.00 -1.81 0.00 0.00 61.98 58.57 3hmx s VAL 19 Cb -0.15 -2.10 0.07 0.00 0.56 0.00 0.00 36.38 34.76 3hmx s VAL 19 CO 0.14 0.04 0.19 -0.89 -0.31 0.00 0.00 175.10 174.26 3hmx s THR 20 N -1.23 -0.28 0.30 5.32 2.01 -1.26 -1.89 115.64 118.61 3hmx s THR 20 Ca 0.17 0.03 -0.14 0.00 0.31 0.00 0.00 61.69 62.06 3hmx s THR 20 Cb -0.10 -0.54 -0.09 0.00 0.01 0.00 0.00 72.50 71.79 3hmx s THR 20 CO 0.08 -0.10 0.69 -0.63 -0.69 0.00 0.00 174.62 173.97 3hmx s ILE 21 N 2.29 4.74 0.34 1.82 1.01 -0.69 -4.91 121.20 125.82 3hmx s ILE 21 Ca 0.05 0.83 0.09 0.00 0.00 0.00 0.00 60.65 61.62 3hmx s ILE 21 Cb -0.15 -3.62 -0.06 0.00 0.01 0.00 0.00 42.46 38.65 3hmx s ILE 21 CO -0.10 -0.15 -0.02 0.42 0.00 0.00 0.00 174.94 175.10 3hmx s THR 22 N -1.93 2.50 -0.09 2.92 -4.23 -1.01 -1.38 115.64 112.42 3hmx s THR 22 Ca 0.52 -2.04 -0.14 0.00 -1.18 0.00 0.00 61.69 58.86 3hmx s THR 22 Cb -0.11 -2.76 0.03 0.00 1.34 0.00 0.00 72.50 71.01 3hmx s THR 22 CO 0.18 -0.20 0.35 0.00 -0.54 0.00 0.00 174.62 174.42 3hmx s ARG 24 N -0.41 0.47 0.00 0.00 1.70 -1.11 -1.32 118.95 118.28 3hmx s ARG 24 Ca -0.05 0.14 -0.00 0.00 -0.47 0.00 0.00 55.73 55.34 3hmx s ARG 24 Cb -0.03 0.21 -0.04 0.00 -0.57 0.00 0.00 34.95 34.52 3hmx s ARG 24 CO 0.02 -0.10 0.10 0.00 -1.08 0.00 0.00 175.30 174.24 3hmx s ALA 25 N -0.48 3.65 0.35 7.88 0.00 -0.88 -1.64 121.76 130.64 3hmx s ALA 25 Ca -0.06 -0.87 0.39 0.00 0.00 0.00 0.00 51.96 51.42 3hmx s ALA 25 Cb -0.04 -1.62 1.85 0.00 0.00 0.00 0.00 23.12 23.31 3hmx s ALA 25 CO 0.02 0.71 2.16 0.66 0.00 0.00 0.00 175.76 179.30 3hmx h SER 26 N 3.98 0.00 -0.30 0.00 4.64 -1.45 -3.45 113.55 116.97 3hmx h SER 26 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 3hmx h SER 26 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3hmx h SER 26 CO 0.64 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.60 3hmx n GLN 27 N -3.08 1.52 -3.58 4.77 6.02 -1.26 -4.93 117.38 116.85 3hmx n GLN 27 Ca -0.01 0.00 -0.37 0.00 -0.01 0.00 0.00 57.00 56.61 3hmx n GLN 27 Cb 0.20 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.40 3hmx n GLN 27 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 3hmx s GLY 28 N 0.00 2.33 -0.03 1.08 0.00 -1.26 -4.60 107.32 104.83 3hmx s GLY 28 Ca 0.00 -0.38 0.05 0.00 0.00 0.00 0.00 44.72 44.39 3hmx s GLY 28 CO 0.00 0.16 0.94 0.29 0.00 0.00 0.00 173.10 174.49 3hmx n ILE 29 N 2.49 0.59 0.00 0.90 -5.35 -0.05 -4.99 119.36 112.95 3hmx n ILE 29 Ca -0.14 -0.68 0.00 0.00 -0.27 0.00 0.00 62.75 61.65 3hmx n ILE 29 Cb 0.53 0.41 0.00 0.00 -1.74 0.00 0.00 39.64 38.84 3hmx n ILE 29 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 3hmx n SER 30 N -0.42 0.00 -0.25 7.28 2.88 -1.25 -0.99 113.62 120.87 3hmx n SER 30 Ca 0.04 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.66 3hmx n SER 30 Cb 0.59 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 64.20 3hmx n SER 30 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 3hmx n SER 31 N 8.07 2.64 -3.76 -3.46 7.64 -1.26 0.15 113.62 123.64 3hmx n SER 31 Ca 0.00 -2.89 -0.42 0.00 1.01 0.00 0.00 58.87 56.57 3hmx n SER 31 Cb 0.00 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.81 3hmx n SER 31 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 3hmx n TRP 32 N -1.06 3.27 -4.41 1.43 5.03 -0.16 -2.71 117.44 118.84 3hmx n TRP 32 Ca 0.15 -2.91 -0.21 0.00 3.03 0.00 0.00 57.50 57.56 3hmx n TRP 32 Cb 0.63 -2.33 -0.16 0.00 -1.03 0.00 0.00 31.31 28.43 3hmx n TRP 32 CO 0.00 0.00 0.00 -1.17 -0.03 0.00 0.00 177.69 176.49 3hmx s LEU 33 N 1.24 1.76 0.18 -0.99 2.96 -1.26 -1.60 118.68 120.97 3hmx s LEU 33 Ca 0.45 -0.20 0.10 0.00 -0.22 0.00 0.00 54.13 54.26 3hmx s LEU 33 Cb 0.13 -0.58 -0.04 0.00 0.50 0.00 0.00 46.19 46.20 3hmx s LEU 33 CO -0.06 0.06 -0.17 0.00 -1.32 0.00 0.00 176.35 174.86 3hmx s ALA 34 N 0.25 2.72 -0.09 5.97 0.00 -0.43 -1.88 121.76 128.31 3hmx s ALA 34 Ca -0.04 -1.54 0.03 0.00 0.00 0.00 0.00 51.96 50.41 3hmx s ALA 34 Cb -0.09 -0.54 -0.01 0.00 0.00 0.00 0.00 23.12 22.48 3hmx s ALA 34 CO 0.01 0.46 -0.19 -1.58 0.00 0.00 0.00 175.76 174.46 3hmx s TRP 35 N -1.62 2.64 0.19 0.00 0.52 0.11 -0.19 118.94 120.58 3hmx s TRP 35 Ca 0.22 -0.69 0.11 0.00 0.02 0.00 0.00 56.10 55.76 3hmx s TRP 35 Cb -0.09 -1.71 -0.04 0.00 -1.15 0.00 0.00 33.47 30.48 3hmx s TRP 35 CO 0.12 -0.21 -0.23 0.71 0.02 0.00 0.00 176.95 177.37 3hmx s TYR 36 N 0.05 2.34 -0.09 -1.98 2.02 0.20 -1.87 117.35 118.03 3hmx s TYR 36 Ca -0.08 -0.34 0.03 0.00 -0.37 0.00 0.00 57.07 56.31 3hmx s TYR 36 Cb -0.15 -1.16 -0.01 0.00 -0.40 0.00 0.00 41.96 40.23 3hmx s TYR 36 CO 0.05 0.49 -0.19 -1.14 -1.57 0.00 0.00 175.55 173.19 3hmx s GLN 37 N -2.66 2.88 0.01 -0.62 0.74 -0.64 -0.38 119.66 118.99 3hmx s GLN 37 Ca 0.21 -0.79 0.04 0.00 0.05 0.00 0.00 55.36 54.87 3hmx s GLN 37 Cb -0.08 -2.37 -0.01 0.00 1.10 0.00 0.00 33.01 31.64 3hmx s GLN 37 CO 0.10 0.34 -0.14 -1.14 -0.55 0.00 0.00 175.29 173.91 3hmx s GLN 38 N -0.03 1.06 0.26 1.67 0.74 -0.20 -0.21 119.66 122.95 3hmx s GLN 38 Ca -0.06 -0.59 0.10 0.00 0.05 0.00 0.00 55.36 54.86 3hmx s GLN 38 Cb -0.15 -1.04 -0.04 0.00 1.10 0.00 0.00 33.01 32.88 3hmx s GLN 38 CO 0.05 0.28 -0.01 0.15 -0.55 0.00 0.00 175.29 175.20 3hmx s LYS 39 N -0.60 2.27 0.00 1.67 1.02 -1.26 -1.96 119.74 120.88 3hmx s LYS 39 Ca 0.04 -1.42 0.00 0.00 0.02 0.00 0.00 55.97 54.61 3hmx s LYS 39 Cb -0.06 -2.15 0.00 0.00 -0.52 0.00 0.00 37.83 35.10 3hmx s LYS 39 CO 0.00 0.37 0.18 -2.30 -0.92 0.00 0.00 175.35 172.67 3hmx n PRO 40 N -0.87 0.00 0.00 -1.68 -0.02 -1.26 -1.75 135.00 129.42 3hmx n PRO 40 Ca -0.06 0.18 0.12 0.00 -2.02 0.00 0.00 63.50 61.71 3hmx n PRO 40 Cb 0.59 -0.33 0.07 0.00 -0.02 0.00 0.00 33.50 33.81 3hmx n PRO 40 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3hmx n GLU 41 N -0.89 1.75 -2.09 -0.52 1.02 -1.26 -4.95 120.64 113.70 3hmx n GLU 41 Ca 0.00 -1.43 -0.29 0.00 -0.02 0.00 0.00 57.16 55.42 3hmx n GLU 41 Cb 0.00 -1.47 0.04 0.00 -0.02 0.00 0.00 31.44 29.99 3hmx n GLU 41 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3hmx s LYS 42 N -2.24 2.93 0.74 3.49 3.01 -0.72 -5.08 119.74 121.88 3hmx s LYS 42 Ca 0.24 0.30 -0.12 0.00 -1.01 0.00 0.00 55.97 55.38 3hmx s LYS 42 Cb 0.19 -2.12 0.04 0.00 -1.01 0.00 0.00 37.83 34.93 3hmx s LYS 42 CO 0.43 -0.87 1.13 0.00 0.51 0.00 0.00 175.35 176.55 3hmx s ALA 43 N -3.20 2.81 0.40 5.17 0.00 -1.26 -4.43 121.76 121.25 3hmx s ALA 43 Ca 0.56 -0.46 -0.25 0.00 0.00 0.00 0.00 51.96 51.82 3hmx s ALA 43 Cb -0.11 -3.00 -0.08 0.00 0.00 0.00 0.00 23.12 19.93 3hmx s ALA 43 CO 0.49 -1.33 1.12 -2.14 0.00 0.00 0.00 175.76 173.90 3hmx s PRO 44 N -5.44 4.08 -0.10 0.00 0.02 -1.26 -4.43 135.00 127.88 3hmx s PRO 44 Ca 0.60 1.71 -0.03 0.00 0.02 0.00 0.00 61.00 63.30 3hmx s PRO 44 Cb -0.11 -2.62 -0.03 0.00 0.02 0.00 0.00 34.50 31.76 3hmx s PRO 44 CO 0.51 -0.26 0.01 0.21 -0.33 0.00 0.00 177.00 177.14 3hmx s LYS 45 N -2.38 3.11 -0.30 5.54 2.20 0.70 -4.94 119.74 123.66 3hmx s LYS 45 Ca 0.58 -0.39 -0.22 0.00 -0.36 0.00 0.00 55.97 55.57 3hmx s LYS 45 Cb -0.27 -2.85 -0.00 0.00 -1.51 0.00 0.00 37.83 33.20 3hmx s LYS 45 CO 0.34 0.66 0.73 -1.12 -0.36 0.00 0.00 175.35 175.60 3hmx s SER 46 N -0.75 6.61 -0.14 1.43 0.01 -1.26 -1.62 113.70 117.98 3hmx s SER 46 Ca 0.12 0.59 -0.15 0.00 1.31 0.00 0.00 55.95 57.82 3hmx s SER 46 Cb -0.12 -2.38 -0.05 0.00 0.21 0.00 0.00 66.02 63.69 3hmx s SER 46 CO 0.02 -0.56 -0.29 0.18 0.41 0.00 0.00 173.24 173.01 3hmx n LEU 47 N 6.07 1.67 -4.17 2.44 4.77 -0.78 -4.77 117.00 122.22 3hmx n LEU 47 Ca 0.02 0.28 -0.24 0.00 -0.03 0.00 0.00 56.01 56.04 3hmx n LEU 47 Cb 0.48 -0.68 -0.15 0.00 -2.33 0.00 0.00 43.42 40.75 3hmx n LEU 47 CO 0.48 -0.33 -0.50 -0.63 -1.33 0.00 0.00 177.39 175.08 3hmx s ILE 48 N -2.63 1.37 0.35 -0.08 1.01 -1.10 -0.98 121.20 119.14 3hmx s ILE 48 Ca -0.24 -0.83 0.04 0.00 0.00 0.00 0.00 60.65 59.62 3hmx s ILE 48 Cb 0.03 -1.16 -0.04 0.00 0.01 0.00 0.00 42.46 41.31 3hmx s ILE 48 CO 0.35 0.32 0.13 -0.72 0.00 0.00 0.00 174.94 175.02 3hmx s TYR 49 N -0.51 1.74 -0.85 3.97 1.13 -0.20 0.05 117.35 122.68 3hmx s TYR 49 Ca 0.06 -1.27 0.00 0.00 -1.41 0.00 0.00 57.07 54.45 3hmx s TYR 49 Cb -0.07 -1.05 0.00 0.00 -1.10 0.00 0.00 41.96 39.74 3hmx s TYR 49 CO -0.00 -0.35 0.00 0.00 -2.51 0.00 0.00 175.55 172.69 3hmx n ALA 50 N -0.73 -0.55 0.00 9.51 0.00 -1.11 -1.27 120.51 126.36 3hmx n ALA 50 Ca -0.02 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3hmx n ALA 50 Cb 0.65 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.95 3hmx n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hmx n ALA 51 N -1.33 0.00 -0.62 0.00 0.00 -0.78 -4.31 120.51 113.47 3hmx n ALA 51 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 3hmx n ALA 51 Cb 0.46 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.91 3hmx n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3hmx n SER 52 N 2.11 0.61 -4.53 0.00 3.41 -1.14 -3.02 113.62 111.06 3hmx n SER 52 Ca 0.00 -1.23 -0.34 0.00 -0.26 0.00 0.00 58.87 57.04 3hmx n SER 52 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 3hmx n SER 52 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3hmx s SER 53 N -0.23 4.92 -0.00 4.04 1.04 -0.40 -4.50 113.70 118.57 3hmx s SER 53 Ca 0.00 -0.08 -0.30 0.00 0.48 0.00 0.00 55.95 56.05 3hmx s SER 53 Cb 0.00 -1.76 -0.04 0.00 0.10 0.00 0.00 66.02 64.33 3hmx s SER 53 CO 0.00 0.19 1.10 -0.76 0.98 0.00 0.00 173.24 174.75 3hmx s LEU 54 N 0.22 4.34 0.30 2.42 1.02 -1.26 -1.03 118.68 124.67 3hmx s LEU 54 Ca -0.01 1.79 -0.29 0.00 0.02 0.00 0.00 54.13 55.64 3hmx s LEU 54 Cb -0.14 -3.57 -0.10 0.00 0.02 0.00 0.00 46.19 42.40 3hmx s LEU 54 CO 0.03 -0.42 1.44 -1.58 0.02 0.00 0.00 176.35 175.83 3hmx s GLN 55 N 1.39 4.24 -0.45 1.70 0.74 -0.15 -4.83 119.66 122.30 3hmx s GLN 55 Ca 0.55 2.37 -0.43 0.00 0.05 0.00 0.00 55.36 57.89 3hmx s GLN 55 Cb -0.24 -3.06 -0.18 0.00 1.10 0.00 0.00 33.01 30.63 3hmx s GLN 55 CO 0.26 -0.41 1.97 0.45 -0.55 0.00 0.00 175.29 177.01 3hmx n SER 56 N 1.58 1.27 0.00 6.67 2.88 -1.26 -1.74 113.62 123.02 3hmx n SER 56 Ca 0.04 0.81 0.00 0.00 -1.33 0.00 0.00 58.87 58.39 3hmx n SER 56 Cb 0.40 -0.98 0.00 0.00 -0.75 0.00 0.00 64.21 62.88 3hmx n SER 56 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hmx n GLY 57 N 6.12 1.57 3.78 0.46 0.00 -1.26 -5.11 105.19 110.76 3hmx n GLY 57 Ca 0.44 -0.41 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 3hmx n GLY 57 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hmx s VAL 58 N -0.54 3.42 0.86 1.61 -7.23 -0.71 -4.99 120.40 112.82 3hmx s VAL 58 Ca 0.00 0.94 -0.13 0.00 -1.81 0.00 0.00 61.98 60.99 3hmx s VAL 58 Cb 0.00 -3.42 0.07 0.00 0.56 0.00 0.00 36.38 33.60 3hmx s VAL 58 CO 0.00 -0.14 0.93 -2.65 -0.31 0.00 0.00 175.10 172.93 3hmx n PRO 59 N -0.88 -0.07 0.08 4.82 -0.02 -1.26 -4.91 135.00 132.76 3hmx n PRO 59 Ca 0.09 0.05 0.01 0.00 -2.02 0.00 0.00 63.50 61.63 3hmx n PRO 59 Cb 0.51 -2.22 0.35 0.00 -0.02 0.00 0.00 33.50 32.12 3hmx n PRO 59 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 3hmx h SER 60 N -1.23 0.31 0.22 2.55 0.02 -2.02 -3.14 113.55 110.26 3hmx h SER 60 Ca -0.45 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.44 3hmx h SER 60 Cb 1.29 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.75 3hmx h SER 60 CO 0.42 0.46 0.00 -2.11 -1.14 0.00 0.00 176.83 174.46 3hmx n ARG 61 N -4.25 0.07 -2.89 3.45 1.85 -1.26 -4.66 116.66 108.97 3hmx n ARG 61 Ca -0.00 0.47 -0.25 0.00 -1.00 0.00 0.00 57.85 57.07 3hmx n ARG 61 Cb 0.28 -1.68 0.01 0.00 -1.05 0.00 0.00 32.46 30.02 3hmx n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3hmx s PHE 62 N -3.20 3.36 0.00 2.89 0.08 -1.19 -1.87 117.98 118.06 3hmx s PHE 62 Ca 0.02 0.45 0.00 0.00 0.12 0.00 0.00 56.93 57.52 3hmx s PHE 62 Cb 0.05 -2.30 0.00 0.00 -0.57 0.00 0.00 43.02 40.20 3hmx s PHE 62 CO 0.17 -0.32 0.00 -1.13 -0.10 0.00 0.00 175.22 173.84 3hmx n SER 63 N -2.15 0.00 -3.86 1.36 3.41 -1.05 -4.97 113.62 106.37 3hmx n SER 63 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.53 3hmx n SER 63 Cb 0.57 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.45 3hmx n SER 63 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3hmx s GLY 64 N 0.00 0.10 0.26 5.00 0.00 -1.26 -0.95 107.32 110.47 3hmx s GLY 64 Ca 0.00 -0.62 -0.15 0.00 0.00 0.00 0.00 44.72 43.95 3hmx s GLY 64 CO 0.00 -0.79 0.54 -1.35 0.00 0.00 0.00 173.10 171.50 3hmx s SER 65 N -2.86 -0.14 0.00 1.64 1.04 -1.17 -4.08 113.70 108.13 3hmx s SER 65 Ca 0.05 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.64 3hmx s SER 65 Cb 0.05 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.79 3hmx s SER 65 CO -0.11 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 173.53 3hmx n GLY 66 N -0.40 2.99 3.47 7.32 0.00 -1.26 -0.95 105.19 116.35 3hmx n GLY 66 Ca -0.02 -1.83 -0.15 0.00 0.00 0.00 0.00 46.02 44.02 3hmx n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hmx s SER 67 N 0.00 -0.58 0.00 1.61 1.04 -1.25 -4.85 113.70 109.68 3hmx s SER 67 Ca 0.00 0.86 0.00 0.00 0.48 0.00 0.00 55.95 57.29 3hmx s SER 67 Cb 0.00 0.84 0.00 0.00 0.10 0.00 0.00 66.02 66.96 3hmx s SER 67 CO 0.00 -0.39 0.00 0.61 0.98 0.00 0.00 173.24 174.44 3hmx n GLY 68 N 1.85 2.06 0.00 7.32 0.00 0.40 -4.30 105.19 112.53 3hmx n GLY 68 Ca -0.17 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.44 3hmx n GLY 68 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 3hmx n THR 69 N 0.00 0.00 -3.96 2.61 5.66 -1.26 -0.87 114.28 116.47 3hmx n THR 69 Ca 0.00 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.70 3hmx n THR 69 Cb 0.00 0.00 -0.16 0.00 -1.55 0.00 0.00 70.33 68.62 3hmx n THR 69 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 3hmx s ASP 70 N -0.38 3.63 0.21 1.09 -0.00 -1.26 -2.06 116.67 117.89 3hmx s ASP 70 Ca 0.00 -1.04 0.09 0.00 -0.00 0.00 0.00 52.55 51.60 3hmx s ASP 70 Cb 0.00 -1.18 -0.05 0.00 -0.00 0.00 0.00 42.92 41.69 3hmx s ASP 70 CO 0.00 -0.20 -0.18 -0.36 -0.00 0.00 0.00 175.17 174.43 3hmx s PHE 71 N 1.41 1.95 0.32 4.23 0.40 -0.44 -3.79 117.98 122.07 3hmx s PHE 71 Ca -0.04 -0.45 0.05 0.00 -0.60 0.00 0.00 56.93 55.89 3hmx s PHE 71 Cb -0.18 -0.92 -0.03 0.00 0.51 0.00 0.00 43.02 42.40 3hmx s PHE 71 CO -0.07 0.45 0.23 0.95 0.70 0.00 0.00 175.22 177.48 3hmx s THR 72 N -2.40 0.10 -0.08 0.64 -4.23 -0.13 -0.69 115.64 108.85 3hmx s THR 72 Ca 0.22 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.67 3hmx s THR 72 Cb -0.04 -2.48 0.03 0.00 1.34 0.00 0.00 72.50 71.35 3hmx s THR 72 CO 0.09 0.00 0.21 -0.22 -0.54 0.00 0.00 174.62 174.16 3hmx s LEU 73 N -3.37 0.93 -0.01 4.79 2.96 -0.48 -3.04 118.68 120.46 3hmx s LEU 73 Ca 0.38 0.42 -0.00 0.00 -0.22 0.00 0.00 54.13 54.71 3hmx s LEU 73 Cb 0.03 0.65 0.01 0.00 0.50 0.00 0.00 46.19 47.38 3hmx s LEU 73 CO 0.23 -0.11 0.02 -0.89 -1.32 0.00 0.00 176.35 174.28 3hmx s THR 74 N 0.59 -0.01 -0.35 3.68 2.01 -0.12 -1.70 115.64 119.74 3hmx s THR 74 Ca -0.04 0.04 -0.04 0.00 0.31 0.00 0.00 61.69 61.96 3hmx s THR 74 Cb -0.05 -0.04 0.07 0.00 0.01 0.00 0.00 72.50 72.48 3hmx s THR 74 CO -0.03 0.02 0.10 -0.63 -0.69 0.00 0.00 174.62 173.39 3hmx s ILE 75 N 0.20 3.38 0.15 1.82 1.01 -0.79 -2.53 121.20 124.44 3hmx s ILE 75 Ca -0.02 -1.50 -0.21 0.00 0.00 0.00 0.00 60.65 58.92 3hmx s ILE 75 Cb -0.02 -3.05 0.03 0.00 0.01 0.00 0.00 42.46 39.43 3hmx s ILE 75 CO -0.01 -0.32 1.66 0.77 0.00 0.00 0.00 174.94 177.04 3hmx h SER 76 N 8.10 -0.54 -2.99 3.58 4.64 -1.65 -3.08 113.55 121.62 3hmx h SER 76 Ca -0.20 0.11 -0.58 0.00 -0.47 0.00 0.00 61.79 60.66 3hmx h SER 76 Cb 1.06 0.28 -0.40 0.00 -0.31 0.00 0.00 62.40 63.03 3hmx h SER 76 CO 0.61 -0.20 -0.78 -0.55 -0.87 0.00 0.00 176.83 175.04 3hmx s SER 77 N -5.10 3.54 0.99 4.97 0.15 -1.26 -3.62 113.70 113.37 3hmx s SER 77 Ca -0.14 -1.93 -0.13 0.00 0.70 0.00 0.00 55.95 54.45 3hmx s SER 77 Cb 0.12 -0.66 0.11 0.00 -1.71 0.00 0.00 66.02 63.88 3hmx s SER 77 CO 0.69 -0.36 0.66 -0.11 1.20 0.00 0.00 173.24 175.32 3hmx n LEU 78 N 4.43 0.52 -3.58 3.45 7.94 -0.80 -4.70 117.00 124.26 3hmx n LEU 78 Ca 0.03 0.25 -0.11 0.00 -1.11 0.00 0.00 56.01 55.07 3hmx n LEU 78 Cb 0.39 -1.27 -0.04 0.00 0.53 0.00 0.00 43.42 43.03 3hmx n LEU 78 CO 0.13 -3.06 0.23 -1.10 -1.11 0.00 0.00 177.39 172.49 3hmx s GLN 79 N -4.02 1.14 0.18 1.96 -0.21 -1.26 -2.24 119.66 115.22 3hmx s GLN 79 Ca 0.61 -0.65 -0.22 0.00 0.02 0.00 0.00 55.36 55.12 3hmx s GLN 79 Cb -0.21 0.51 0.09 0.00 1.00 0.00 0.00 33.01 34.40 3hmx s GLN 79 CO 0.64 -0.46 1.58 -1.35 -2.12 0.00 0.00 175.29 173.58 3hmx h PRO 80 N 2.25 -0.19 0.00 2.91 0.11 -1.99 -0.05 132.00 135.05 3hmx h PRO 80 Ca -0.34 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.78 3hmx h PRO 80 Cb 1.27 0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.42 3hmx h PRO 80 CO 0.44 -0.12 0.02 0.39 -0.21 0.00 0.00 178.00 178.51 3hmx n GLU 81 N -5.43 0.07 -0.08 1.05 4.71 -1.26 -1.81 120.64 117.90 3hmx n GLU 81 Ca 0.03 0.57 0.10 0.00 -0.01 0.00 0.00 57.16 57.85 3hmx n GLU 81 Cb 0.35 -1.76 0.37 0.00 -1.01 0.00 0.00 31.44 29.39 3hmx n GLU 81 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 3hmx n ASP 82 N -1.89 1.56 -4.57 1.62 10.43 -0.03 -4.81 116.55 118.85 3hmx n ASP 82 Ca -0.01 -1.71 -0.42 0.00 2.57 0.00 0.00 54.79 55.22 3hmx n ASP 82 Cb 0.03 -0.11 -0.05 0.00 1.84 0.00 0.00 41.12 42.83 3hmx n ASP 82 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 3hmx s PHE 83 N -1.79 3.07 0.03 1.24 0.08 -0.75 -4.95 117.98 114.92 3hmx s PHE 83 Ca 0.31 0.45 -0.13 0.00 0.12 0.00 0.00 56.93 57.68 3hmx s PHE 83 Cb 0.17 -3.50 0.04 0.00 -0.57 0.00 0.00 43.02 39.16 3hmx s PHE 83 CO 0.25 -0.82 0.61 0.00 -0.10 0.00 0.00 175.22 175.17 3hmx n ALA 84 N 6.54 -1.68 -2.89 5.36 0.00 -1.25 -4.94 120.51 121.65 3hmx n ALA 84 Ca 0.03 -0.47 -0.33 0.00 0.00 0.00 0.00 53.44 52.68 3hmx n ALA 84 Cb 0.48 0.17 -0.05 0.00 0.00 0.00 0.00 19.45 20.06 3hmx n ALA 84 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3hmx s THR 85 N -2.17 5.39 -0.06 0.00 -4.23 -0.83 -1.14 115.64 112.60 3hmx s THR 85 Ca 0.14 -0.20 0.04 0.00 -1.18 0.00 0.00 61.69 60.49 3hmx s THR 85 Cb -0.01 -3.58 -0.00 0.00 1.34 0.00 0.00 72.50 70.25 3hmx s THR 85 CO 0.01 0.25 -0.20 -0.31 -0.54 0.00 0.00 174.62 173.83 3hmx s TYR 86 N -1.40 2.00 -0.04 3.99 1.51 -0.56 -1.03 117.35 121.82 3hmx s TYR 86 Ca 0.31 -0.65 0.06 0.00 -1.01 0.00 0.00 57.07 55.78 3hmx s TYR 86 Cb -0.13 -1.35 -0.02 0.00 -0.11 0.00 0.00 41.96 40.35 3hmx s TYR 86 CO 0.22 -0.23 -0.20 0.71 -1.11 0.00 0.00 175.55 174.93 3hmx s TYR 87 N 0.12 2.52 0.18 2.71 2.02 0.49 -1.87 117.35 123.52 3hmx s TYR 87 Ca -0.08 -0.32 0.04 0.00 -0.37 0.00 0.00 57.07 56.34 3hmx s TYR 87 Cb -0.14 -1.57 -0.03 0.00 -0.40 0.00 0.00 41.96 39.82 3hmx s TYR 87 CO 0.04 0.06 0.27 0.00 -1.57 0.00 0.00 175.55 174.35 3hmx s GLN 89 N -3.45 0.03 -0.25 0.00 0.74 0.74 -1.04 119.66 116.43 3hmx s GLN 89 Ca 0.34 0.19 -0.20 0.00 0.05 0.00 0.00 55.36 55.73 3hmx s GLN 89 Cb -0.10 -0.13 -0.02 0.00 1.10 0.00 0.00 33.01 33.85 3hmx s GLN 89 CO 0.27 -0.11 0.63 -1.14 -0.55 0.00 0.00 175.29 174.39 3hmx s GLN 90 N 0.73 4.12 -0.40 1.67 -0.44 -0.48 -1.31 119.66 123.54 3hmx s GLN 90 Ca -0.06 0.56 0.05 0.00 -2.50 0.00 0.00 55.36 53.41 3hmx s GLN 90 Cb -0.08 -3.64 0.43 0.00 -1.64 0.00 0.00 33.01 28.08 3hmx s GLN 90 CO -0.03 -0.39 1.21 2.48 0.50 0.00 0.00 175.29 179.06 3hmx n TYR 91 N 5.64 3.13 -0.12 1.67 4.11 -0.63 -3.02 117.16 127.94 3hmx n TYR 91 Ca -0.01 -2.72 -0.24 0.00 -0.00 0.00 0.00 57.90 54.93 3hmx n TYR 91 Cb 0.49 -0.27 -0.08 0.00 -0.00 0.00 0.00 39.34 39.47 3hmx n TYR 91 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.86 175.15 3hmx n ASN 92 N -0.59 1.67 -4.04 9.48 5.15 -1.26 -4.96 115.26 120.72 3hmx n ASN 92 Ca 0.42 0.26 -0.25 0.00 -0.60 0.00 0.00 54.58 54.42 3hmx n ASN 92 Cb 0.77 -0.66 -0.16 0.00 -0.53 0.00 0.00 39.78 39.19 3hmx n ASN 92 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3hmx s ILE 93 N -2.43 1.17 0.30 -1.44 1.01 -1.26 -5.10 121.20 113.45 3hmx s ILE 93 Ca -0.32 -0.51 -0.29 0.00 0.00 0.00 0.00 60.65 59.53 3hmx s ILE 93 Cb 0.12 -1.06 -0.10 0.00 0.01 0.00 0.00 42.46 41.43 3hmx s ILE 93 CO 0.41 0.36 1.39 -0.31 0.00 0.00 0.00 174.94 176.80 3hmx s TYR 94 N 0.59 2.96 0.30 3.97 4.12 -1.26 -3.60 117.35 124.43 3hmx s TYR 94 Ca -0.13 1.20 -0.16 0.00 0.02 0.00 0.00 57.07 58.00 3hmx s TYR 94 Cb -0.15 -3.80 -0.09 0.00 -1.52 0.00 0.00 41.96 36.40 3hmx s TYR 94 CO 0.04 -2.40 0.73 -1.25 0.02 0.00 0.00 175.55 172.69 3hmx s PRO 95 N -1.20 4.04 0.14 -1.71 0.05 -1.26 -4.96 135.00 130.09 3hmx s PRO 95 Ca 0.54 0.69 -0.30 0.00 0.05 0.00 0.00 61.00 61.98 3hmx s PRO 95 Cb -0.42 -2.51 -0.08 0.00 0.05 0.00 0.00 34.50 31.55 3hmx s PRO 95 CO 0.50 0.20 1.27 0.71 0.05 0.00 0.00 177.00 179.73 3hmx s TYR 96 N -1.90 3.35 0.11 0.56 4.12 -1.24 -4.61 117.35 117.74 3hmx s TYR 96 Ca 0.52 1.23 0.07 0.00 0.02 0.00 0.00 57.07 58.91 3hmx s TYR 96 Cb -0.11 -3.53 -0.04 0.00 -1.52 0.00 0.00 41.96 36.76 3hmx s TYR 96 CO 0.18 -1.67 -0.17 0.95 0.02 0.00 0.00 175.55 174.85 3hmx s THR 97 N 0.56 1.51 0.37 -0.71 -4.23 -1.17 -4.93 115.64 107.04 3hmx s THR 97 Ca 0.58 -1.61 0.07 0.00 -1.18 0.00 0.00 61.69 59.56 3hmx s THR 97 Cb -0.34 -1.50 -0.02 0.00 1.34 0.00 0.00 72.50 71.98 3hmx s THR 97 CO 0.33 -0.23 0.35 -0.36 -0.54 0.00 0.00 174.62 174.17 3hmx s PHE 98 N -1.60 2.85 0.67 3.99 0.40 -1.26 -1.39 117.98 121.64 3hmx s PHE 98 Ca 0.07 -0.36 -0.10 0.00 -0.60 0.00 0.00 56.93 55.94 3hmx s PHE 98 Cb -0.08 -1.97 0.01 0.00 0.51 0.00 0.00 43.02 41.49 3hmx s PHE 98 CO 0.04 0.03 1.04 0.20 0.70 0.00 0.00 175.22 177.23 3hmx s GLY 99 N -4.08 1.62 0.00 4.36 0.00 -0.20 -4.36 107.32 104.66 3hmx s GLY 99 Ca 0.45 -0.44 0.31 0.00 0.00 0.00 0.00 44.72 45.03 3hmx s GLY 99 CO 0.28 -0.10 2.07 0.61 0.00 0.00 0.00 173.10 175.97 3hmx n GLN 100 N -2.88 1.08 0.00 2.90 -0.00 -1.26 -4.71 117.38 112.51 3hmx n GLN 100 Ca 0.06 -0.24 0.00 0.00 -0.00 0.00 0.00 57.00 56.82 3hmx n GLN 100 Cb 0.57 -1.50 0.00 0.00 -0.00 0.00 0.00 30.24 29.32 3hmx n GLN 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3hmx n GLY 101 N 1.09 1.90 2.74 2.61 0.00 -1.26 -5.02 105.19 107.24 3hmx n GLY 101 Ca 0.21 -1.96 -0.19 0.00 0.00 0.00 0.00 46.02 44.08 3hmx n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hmx s THR 102 N -2.49 -0.31 0.26 2.61 2.01 -0.78 -4.65 115.64 112.29 3hmx s THR 102 Ca 0.00 -0.16 -0.29 0.00 0.31 0.00 0.00 61.69 61.55 3hmx s THR 102 Cb 0.00 -0.70 -0.09 0.00 0.01 0.00 0.00 72.50 71.72 3hmx s THR 102 CO 0.00 -0.24 0.94 -0.75 -0.69 0.00 0.00 174.62 173.88 3hmx s LYS 103 N 2.31 4.81 -0.44 4.92 2.20 -1.20 -1.50 119.74 130.84 3hmx s LYS 103 Ca 0.07 1.47 -0.04 0.00 -0.36 0.00 0.00 55.97 57.10 3hmx s LYS 103 Cb -0.16 -3.19 0.12 0.00 -1.51 0.00 0.00 37.83 33.09 3hmx s LYS 103 CO -0.14 0.47 0.25 -0.51 -0.36 0.00 0.00 175.35 175.06 3hmx s LEU 104 N -1.34 5.34 0.24 5.43 1.02 -0.29 -1.62 118.68 127.45 3hmx s LEU 104 Ca 0.43 -2.08 -0.11 0.00 0.02 0.00 0.00 54.13 52.40 3hmx s LEU 104 Cb -0.25 -1.86 -0.08 0.00 0.02 0.00 0.00 46.19 44.02 3hmx s LEU 104 CO 0.31 -0.56 0.58 -0.70 0.02 0.00 0.00 176.35 176.00 3hmx s GLU 105 N 1.09 3.84 0.47 1.70 2.12 -0.50 -3.92 118.70 123.49 3hmx s GLU 105 Ca 0.08 0.35 -0.22 0.00 0.36 0.00 0.00 54.97 55.54 3hmx s GLU 105 Cb -0.23 -2.61 -0.07 0.00 0.26 0.00 0.00 34.13 31.47 3hmx s GLU 105 CO -0.04 0.29 1.13 0.42 -0.54 0.00 0.00 175.26 176.53 3hmx s ILE 106 N -1.84 3.25 -0.23 -3.70 1.09 -1.26 -1.50 121.20 117.01 3hmx s ILE 106 Ca 0.48 0.90 -0.14 0.00 -1.10 0.00 0.00 60.65 60.79 3hmx s ILE 106 Cb -0.11 -3.44 -0.04 0.00 -1.06 0.00 0.00 42.46 37.81 3hmx s ILE 106 CO 0.20 -0.05 0.31 -0.75 -0.10 0.00 0.00 174.94 174.56 3hmx s LYS 107 N -2.81 4.10 0.11 2.79 2.20 -0.06 -4.61 119.74 121.46 3hmx s LYS 107 Ca 0.65 0.00 -0.09 0.00 -0.36 0.00 0.00 55.97 56.17 3hmx s LYS 107 Cb -0.26 -3.57 -0.00 0.00 -1.51 0.00 0.00 37.83 32.49 3hmx s LYS 107 CO 0.31 -0.07 0.23 0.50 -0.36 0.00 0.00 175.35 175.96 3hmx s ARG 108 N 1.43 0.95 0.37 4.03 3.00 -1.26 -4.70 118.95 122.78 3hmx s ARG 108 Ca 0.14 -1.01 -0.27 0.00 -1.00 0.00 0.00 55.73 53.59 3hmx s ARG 108 Cb -0.15 0.36 -0.09 0.00 0.00 0.00 0.00 34.95 35.07 3hmx s ARG 108 CO 0.08 -0.32 1.25 -0.08 0.00 0.00 0.00 175.30 176.22 3hmx s THR 109 N -3.89 2.86 0.32 4.11 -1.32 -1.26 -4.93 115.64 111.53 3hmx s THR 109 Ca 0.09 0.80 -0.28 0.00 -1.21 0.00 0.00 61.69 61.09 3hmx s THR 109 Cb 0.04 -3.48 -0.13 0.00 -1.51 0.00 0.00 72.50 67.42 3hmx s THR 109 CO -0.08 0.14 1.07 0.52 -2.21 0.00 0.00 174.62 174.06 3hmx n VAL 110 N 0.43 2.04 -3.73 5.08 0.31 -1.26 -4.91 118.33 116.28 3hmx n VAL 110 Ca 0.02 -0.50 -0.12 0.00 -0.01 0.00 0.00 64.34 63.73 3hmx n VAL 110 Cb 0.44 -1.14 -0.11 0.00 -0.91 0.00 0.00 33.84 32.11 3hmx n VAL 110 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3hmx s ALA 111 N -1.09 -0.82 0.40 3.52 0.00 -1.06 -4.98 121.76 117.72 3hmx s ALA 111 Ca 0.58 1.12 -0.11 0.00 0.00 0.00 0.00 51.96 53.55 3hmx s ALA 111 Cb -0.65 -0.67 -0.07 0.00 0.00 0.00 0.00 23.12 21.73 3hmx s ALA 111 CO 0.60 -0.20 0.76 0.00 0.00 0.00 0.00 175.76 176.93 3hmx s ALA 112 N 0.79 3.35 0.13 0.00 0.00 -1.26 -1.59 121.76 123.18 3hmx s ALA 112 Ca -0.05 -0.19 -0.29 0.00 0.00 0.00 0.00 51.96 51.43 3hmx s ALA 112 Cb -0.06 -2.70 -0.07 0.00 0.00 0.00 0.00 23.12 20.29 3hmx s ALA 112 CO -0.05 0.02 0.93 -2.14 0.00 0.00 0.00 175.76 174.52 3hmx s PRO 113 N -3.77 4.71 -0.00 0.00 0.02 -1.26 -4.57 135.00 130.12 3hmx s PRO 113 Ca 0.51 1.41 -0.30 0.00 0.02 0.00 0.00 61.00 62.64 3hmx s PRO 113 Cb -0.10 -3.35 -0.04 0.00 0.02 0.00 0.00 34.50 31.02 3hmx s PRO 113 CO 0.30 0.30 1.21 -1.12 -0.33 0.00 0.00 177.00 177.36 3hmx s SER 114 N -0.30 7.06 -0.03 2.53 0.01 0.13 -4.71 113.70 118.38 3hmx s SER 114 Ca 0.44 1.92 -0.01 0.00 1.31 0.00 0.00 55.95 59.62 3hmx s SER 114 Cb -0.24 -2.57 -0.04 0.00 0.21 0.00 0.00 66.02 63.39 3hmx s SER 114 CO 0.29 -0.54 0.04 -0.69 0.41 0.00 0.00 173.24 172.76 3hmx s VAL 115 N 1.72 4.49 -0.08 3.43 1.01 -1.26 0.92 120.40 130.63 3hmx s VAL 115 Ca 0.58 -0.40 -0.08 0.00 0.00 0.00 0.00 61.98 62.08 3hmx s VAL 115 Cb -0.27 -2.99 0.02 0.00 0.00 0.00 0.00 36.38 33.14 3hmx s VAL 115 CO 0.25 0.44 0.22 -0.36 0.00 0.00 0.00 175.10 175.65 3hmx s PHE 116 N -1.08 -0.23 -0.04 5.22 0.08 -0.60 -4.98 117.98 116.36 3hmx s PHE 116 Ca 0.19 0.55 0.07 0.00 0.12 0.00 0.00 56.93 57.86 3hmx s PHE 116 Cb -0.12 0.08 -0.02 0.00 -0.57 0.00 0.00 43.02 42.39 3hmx s PHE 116 CO 0.09 -0.13 -0.25 -1.50 -0.10 0.00 0.00 175.22 173.34 3hmx s ILE 117 N 0.03 2.12 -0.12 0.64 2.07 -1.26 0.41 121.20 125.09 3hmx s ILE 117 Ca -0.01 -1.06 0.02 0.00 -1.41 0.00 0.00 60.65 58.19 3hmx s ILE 117 Cb -0.02 -1.75 -0.01 0.00 0.13 0.00 0.00 42.46 40.81 3hmx s ILE 117 CO 0.00 0.58 -0.19 -0.36 -1.91 0.00 0.00 174.94 173.06 3hmx s PHE 118 N -0.40 2.68 0.68 3.50 0.08 0.16 -4.99 117.98 119.69 3hmx s PHE 118 Ca 0.04 -0.88 -0.15 0.00 0.12 0.00 0.00 56.93 56.06 3hmx s PHE 118 Cb -0.12 -1.77 0.01 0.00 -0.57 0.00 0.00 43.02 40.57 3hmx s PHE 118 CO 0.01 -0.33 1.14 -1.25 -0.10 0.00 0.00 175.22 174.69 3hmx s PRO 119 N 0.36 2.60 0.72 0.24 0.04 -1.26 -2.74 135.00 134.95 3hmx s PRO 119 Ca -0.15 1.52 -0.13 0.00 0.04 0.00 0.00 61.00 62.28 3hmx s PRO 119 Cb -0.17 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.49 3hmx s PRO 119 CO 0.07 -1.43 1.11 -2.14 0.04 0.00 0.00 177.00 174.65 3hmx s PRO 120 N -3.99 2.48 0.33 0.56 0.02 -1.25 -4.85 135.00 128.29 3hmx s PRO 120 Ca 0.70 1.35 -0.26 0.00 0.02 0.00 0.00 61.00 62.80 3hmx s PRO 120 Cb -0.23 -1.91 -0.10 0.00 0.02 0.00 0.00 34.50 32.28 3hmx s PRO 120 CO 0.42 -1.49 0.99 -1.54 -0.33 0.00 0.00 177.00 175.05 3hmx s SER 121 N -2.83 7.21 0.63 2.53 1.04 -1.26 -4.89 113.70 116.13 3hmx s SER 121 Ca 0.65 1.95 0.39 0.00 0.48 0.00 0.00 55.95 59.43 3hmx s SER 121 Cb -0.20 -2.59 2.14 0.00 0.10 0.00 0.00 66.02 65.47 3hmx s SER 121 CO 0.48 -0.17 2.30 0.44 0.98 0.00 0.00 173.24 177.27 3hmx h ASP 122 N 3.17 0.00 0.86 7.02 3.45 -2.01 -0.70 116.42 128.20 3hmx h ASP 122 Ca -0.47 0.00 -0.12 0.00 0.43 0.00 0.00 57.03 56.87 3hmx h ASP 122 Cb 1.20 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.95 3hmx h ASP 122 CO 0.65 0.01 -0.56 -0.08 -1.57 0.00 0.00 179.24 177.68 3hmx h GLU 123 N 0.00 0.00 0.07 3.56 4.81 -1.94 -3.21 114.58 117.86 3hmx h GLU 123 Ca -0.00 0.00 -0.32 0.00 -0.13 0.00 0.00 59.36 58.91 3hmx h GLU 123 Cb 0.06 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.41 3hmx h GLU 123 CO 0.00 0.56 -1.75 0.37 -0.73 0.00 0.00 179.01 177.46 3hmx h GLN 124 N 0.00 0.14 -0.10 1.92 4.15 -1.46 -3.37 115.11 116.38 3hmx h GLN 124 Ca -0.01 -0.24 -0.00 0.00 0.77 0.00 0.00 58.65 59.18 3hmx h GLN 124 Cb 1.14 0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.92 3hmx h GLN 124 CO 0.07 0.87 0.06 -0.07 -1.93 0.00 0.00 178.83 177.83 3hmx h LEU 125 N 0.04 0.13 -4.67 -2.39 4.07 -1.54 -2.00 115.31 108.95 3hmx h LEU 125 Ca -0.32 -0.09 -0.17 0.00 0.08 0.00 0.00 57.88 57.39 3hmx h LEU 125 Cb 2.01 -0.03 -0.03 0.00 1.08 0.00 0.00 40.66 43.70 3hmx h LEU 125 CO 0.10 0.18 0.62 2.29 -1.08 0.00 0.00 178.44 180.55 3hmx n LYS 126 N -4.97 1.37 0.00 1.13 2.85 -1.21 -1.29 118.16 116.04 3hmx n LYS 126 Ca -0.05 -0.78 0.00 0.00 -1.05 0.00 0.00 58.31 56.42 3hmx n LYS 126 Cb 0.07 -1.94 0.00 0.00 -0.65 0.00 0.00 35.03 32.51 3hmx n LYS 126 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 3hmx n SER 127 N 3.06 0.00 0.00 -5.58 2.88 -0.76 -5.00 113.62 108.22 3hmx n SER 127 Ca 0.29 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.83 3hmx n SER 127 Cb 0.43 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 3hmx n SER 127 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hmx n GLY 128 N -0.11 4.08 3.60 0.46 0.00 -0.41 -5.10 105.19 107.70 3hmx n GLY 128 Ca 0.00 -0.67 -0.27 0.00 0.00 0.00 0.00 46.02 45.08 3hmx n GLY 128 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hmx s THR 129 N -0.01 1.90 -0.03 2.61 -4.23 -1.25 0.20 115.64 114.81 3hmx s THR 129 Ca 0.00 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.52 3hmx s THR 129 Cb 0.00 -2.97 0.01 0.00 1.34 0.00 0.00 72.50 70.88 3hmx s THR 129 CO 0.00 0.00 -0.06 0.00 -0.54 0.00 0.00 174.62 174.02 3hmx s ALA 130 N -2.78 0.69 -0.32 3.99 0.00 0.34 -3.67 121.76 120.00 3hmx s ALA 130 Ca 0.35 -0.13 -0.00 0.00 0.00 0.00 0.00 51.96 52.18 3hmx s ALA 130 Cb 0.10 -0.36 0.07 0.00 0.00 0.00 0.00 23.12 22.94 3hmx s ALA 130 CO 0.18 0.04 0.04 -1.12 0.00 0.00 0.00 175.76 174.90 3hmx s SER 131 N 0.61 4.87 -0.25 0.00 0.01 -1.26 -0.95 113.70 116.73 3hmx s SER 131 Ca -0.08 -1.63 -0.17 0.00 1.31 0.00 0.00 55.95 55.37 3hmx s SER 131 Cb -0.12 -1.69 -0.03 0.00 0.21 0.00 0.00 66.02 64.39 3hmx s SER 131 CO 0.00 -0.33 0.48 0.54 0.41 0.00 0.00 173.24 174.34 3hmx s VAL 132 N 1.13 5.10 -0.01 3.43 0.11 -0.10 -3.90 120.40 126.16 3hmx s VAL 132 Ca 0.00 0.83 0.07 0.00 -2.93 0.00 0.00 61.98 59.96 3hmx s VAL 132 Cb -0.20 -3.80 -0.02 0.00 -1.53 0.00 0.00 36.38 30.82 3hmx s VAL 132 CO -0.04 0.13 -0.23 0.54 -3.33 0.00 0.00 175.10 172.17 3hmx s VAL 133 N 2.07 2.31 -0.08 2.04 0.11 -1.11 -1.25 120.40 124.48 3hmx s VAL 133 Ca 0.20 -1.09 0.04 0.00 -2.93 0.00 0.00 61.98 58.21 3hmx s VAL 133 Cb -0.16 -1.85 0.00 0.00 -1.53 0.00 0.00 36.38 32.85 3hmx s VAL 133 CO 0.09 0.53 -0.22 0.00 -3.33 0.00 0.00 175.10 172.18 3hmx s LEU 135 N 0.29 3.84 -0.17 0.00 2.96 0.17 -0.57 118.68 125.20 3hmx s LEU 135 Ca -0.15 -1.35 -0.24 0.00 -0.22 0.00 0.00 54.13 52.18 3hmx s LEU 135 Cb -0.16 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 44.83 3hmx s LEU 135 CO 0.07 -0.25 0.77 -0.76 -1.32 0.00 0.00 176.35 174.85 3hmx s LEU 136 N 1.20 4.18 -0.10 -0.68 1.02 -0.61 -1.56 118.68 122.13 3hmx s LEU 136 Ca -0.05 1.09 0.01 0.00 0.02 0.00 0.00 54.13 55.20 3hmx s LEU 136 Cb -0.20 -3.13 -0.02 0.00 0.02 0.00 0.00 46.19 42.86 3hmx s LEU 136 CO -0.02 -0.34 -0.15 0.21 0.02 0.00 0.00 176.35 176.07 3hmx s ASN 137 N 1.14 3.91 -0.01 2.29 2.47 0.26 -1.72 114.94 123.29 3hmx s ASN 137 Ca 0.36 -0.31 -0.00 0.00 0.42 0.00 0.00 52.86 53.32 3hmx s ASN 137 Cb -0.16 -1.34 0.00 0.00 -1.45 0.00 0.00 41.25 38.29 3hmx s ASN 137 CO 0.12 0.22 0.01 0.59 -3.72 0.00 0.00 177.10 174.32 3hmx n ASN 138 N 3.15 -7.00 -2.18 -4.21 3.02 -1.12 -0.70 115.26 106.21 3hmx n ASN 138 Ca -0.18 0.98 -0.08 0.00 -0.03 0.00 0.00 54.58 55.27 3hmx n ASN 138 Cb 0.53 -1.66 -0.01 0.00 -0.61 0.00 0.00 39.78 38.02 3hmx n ASN 138 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 3hmx n PHE 139 N 2.48 -1.21 -3.53 3.10 1.16 -0.82 -4.25 117.46 114.38 3hmx n PHE 139 Ca -0.01 -1.36 0.02 0.00 -1.87 0.00 0.00 57.45 54.22 3hmx n PHE 139 Cb 0.02 0.38 -0.06 0.00 -1.61 0.00 0.00 39.48 38.22 3hmx n PHE 139 CO 0.00 0.00 0.00 -0.47 -1.87 0.00 0.00 176.76 174.42 3hmx s TYR 140 N -3.99 -0.17 0.93 2.97 6.14 -0.62 -2.18 117.35 120.42 3hmx s TYR 140 Ca 0.16 0.33 -0.14 0.00 0.64 0.00 0.00 57.07 58.06 3hmx s TYR 140 Cb -0.01 0.10 0.16 0.00 0.42 0.00 0.00 41.96 42.63 3hmx s TYR 140 CO 0.11 -0.09 1.23 -2.14 0.64 0.00 0.00 175.55 175.30 3hmx s PRO 141 N 1.38 0.93 0.00 4.97 0.02 -1.26 -2.56 135.00 138.47 3hmx s PRO 141 Ca -0.06 -0.09 0.11 0.00 0.02 0.00 0.00 61.00 60.98 3hmx s PRO 141 Cb -0.02 -1.85 0.67 0.00 0.02 0.00 0.00 34.50 33.32 3hmx s PRO 141 CO -0.12 -2.27 1.21 2.89 -0.33 0.00 0.00 177.00 178.37 3hmx n ARG 142 N -3.74 0.70 -2.25 5.54 1.85 -1.26 -4.62 116.66 112.89 3hmx n ARG 142 Ca 0.11 0.00 -0.41 0.00 -1.00 0.00 0.00 57.85 56.56 3hmx n ARG 142 Cb 0.60 -1.25 -0.03 0.00 -1.05 0.00 0.00 32.46 30.73 3hmx n ARG 142 CO 0.00 0.00 0.00 -2.00 -0.01 0.00 0.00 177.63 175.62 3hmx s GLU 143 N -2.00 3.06 -0.06 2.89 2.56 -1.26 -4.96 118.70 118.94 3hmx s GLU 143 Ca 0.17 0.53 -0.10 0.00 0.00 0.00 0.00 54.97 55.57 3hmx s GLU 143 Cb 0.08 -4.23 0.02 0.00 2.00 0.00 0.00 34.13 32.00 3hmx s GLU 143 CO 0.13 -2.23 0.25 0.00 -0.56 0.00 0.00 175.26 172.85 3hmx s ALA 144 N 7.15 -0.61 -0.16 6.30 0.00 -1.26 -4.55 121.76 128.63 3hmx s ALA 144 Ca 0.58 0.45 -0.02 0.00 0.00 0.00 0.00 51.96 52.98 3hmx s ALA 144 Cb -0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 23.12 22.79 3hmx s ALA 144 CO 0.23 -0.18 -0.09 0.21 0.00 0.00 0.00 175.76 175.94 3hmx s LYS 145 N -0.55 3.44 -0.13 0.00 2.20 -0.93 -5.03 119.74 118.75 3hmx s LYS 145 Ca -0.06 -0.64 0.03 0.00 -0.36 0.00 0.00 55.97 54.94 3hmx s LYS 145 Cb -0.04 -2.79 0.01 0.00 -1.51 0.00 0.00 37.83 33.49 3hmx s LYS 145 CO 0.02 0.10 -0.22 0.08 -0.36 0.00 0.00 175.35 174.97 3hmx s VAL 146 N 0.69 1.99 -0.06 4.02 1.01 -1.26 -1.76 120.40 125.02 3hmx s VAL 146 Ca -0.05 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.03 3hmx s VAL 146 Cb -0.15 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.48 3hmx s VAL 146 CO 0.02 0.54 -0.18 -1.10 0.00 0.00 0.00 175.10 174.38 3hmx s GLN 147 N 0.72 2.08 0.20 2.72 -0.21 -0.92 -5.00 119.66 119.25 3hmx s GLN 147 Ca -0.10 -0.65 -0.11 0.00 0.02 0.00 0.00 55.36 54.52 3hmx s GLN 147 Cb -0.16 -1.72 -0.07 0.00 1.00 0.00 0.00 33.01 32.06 3hmx s GLN 147 CO 0.01 0.20 0.55 -1.58 -2.12 0.00 0.00 175.29 172.35 3hmx s TRP 148 N 0.20 3.48 -0.25 0.91 0.52 -1.26 -0.67 118.94 121.87 3hmx s TRP 148 Ca -0.09 0.93 -0.03 0.00 0.02 0.00 0.00 56.10 56.94 3hmx s TRP 148 Cb -0.14 -2.30 0.11 0.00 -1.15 0.00 0.00 33.47 29.99 3hmx s TRP 148 CO 0.04 0.32 0.20 0.15 0.02 0.00 0.00 176.95 177.68 3hmx s LYS 149 N -2.54 0.22 -0.31 4.98 1.02 0.03 -2.92 119.74 120.22 3hmx s LYS 149 Ca 0.44 -0.16 -0.16 0.00 0.02 0.00 0.00 55.97 56.11 3hmx s LYS 149 Cb -0.12 -1.09 -0.02 0.00 -0.52 0.00 0.00 37.83 36.08 3hmx s LYS 149 CO 0.20 -0.89 0.43 0.14 -0.92 0.00 0.00 175.35 174.32 3hmx s VAL 150 N 2.25 5.11 -1.18 3.17 -7.23 0.39 -3.19 120.40 119.71 3hmx s VAL 150 Ca 0.08 0.41 -0.08 0.00 -1.81 0.00 0.00 61.98 60.57 3hmx s VAL 150 Cb -0.15 -3.83 -0.02 0.00 0.56 0.00 0.00 36.38 32.93 3hmx s VAL 150 CO -0.26 -0.04 0.79 0.47 -0.31 0.00 0.00 175.10 175.76 3hmx n ASP 151 N 5.51 -3.94 0.00 4.85 8.00 0.10 -1.74 116.55 129.34 3hmx n ASP 151 Ca -0.07 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.58 3hmx n ASP 151 Cb 0.50 -4.15 0.00 0.00 -0.02 0.00 0.00 41.12 37.45 3hmx n ASP 151 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3hmx n ASN 152 N -2.97 0.00 -4.74 -2.24 5.15 -1.26 -4.91 115.26 104.29 3hmx n ASN 152 Ca -0.17 0.00 -0.40 0.00 -0.60 0.00 0.00 54.58 53.41 3hmx n ASN 152 Cb 0.63 -1.47 -0.05 0.00 -0.53 0.00 0.00 39.78 38.36 3hmx n ASN 152 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3hmx s ALA 153 N -1.29 3.36 0.68 5.20 0.00 -0.71 -4.97 121.76 124.03 3hmx s ALA 153 Ca 0.00 0.25 -0.13 0.00 0.00 0.00 0.00 51.96 52.08 3hmx s ALA 153 Cb 0.00 -2.99 0.01 0.00 0.00 0.00 0.00 23.12 20.14 3hmx s ALA 153 CO 0.00 0.03 1.09 -1.17 0.00 0.00 0.00 175.76 175.70 3hmx s LEU 154 N 0.15 3.27 -0.02 0.00 1.98 -1.26 -0.46 118.68 122.34 3hmx s LEU 154 Ca 0.39 1.86 0.05 0.00 -2.89 0.00 0.00 54.13 53.53 3hmx s LEU 154 Cb -0.20 -4.53 -0.01 0.00 0.66 0.00 0.00 46.19 42.11 3hmx s LEU 154 CO 0.22 -1.62 -0.17 -1.10 -1.89 0.00 0.00 176.35 171.79 3hmx s GLN 155 N -4.46 1.53 0.06 1.98 -1.52 -1.15 -4.81 119.66 111.29 3hmx s GLN 155 Ca 0.63 -0.61 0.05 0.00 -1.95 0.00 0.00 55.36 53.48 3hmx s GLN 155 Cb -0.18 -1.42 -0.03 0.00 -0.22 0.00 0.00 33.01 31.17 3hmx s GLN 155 CO 0.47 0.32 -0.13 -1.12 -0.25 0.00 0.00 175.29 174.57 3hmx s SER 156 N -0.23 1.51 -1.49 5.90 0.01 -1.26 -4.71 113.70 113.44 3hmx s SER 156 Ca 0.03 -0.58 -0.08 0.00 1.31 0.00 0.00 55.95 56.63 3hmx s SER 156 Cb -0.08 -0.04 0.06 0.00 0.21 0.00 0.00 66.02 66.16 3hmx s SER 156 CO 0.00 -0.09 0.69 0.61 0.41 0.00 0.00 173.24 174.87 3hmx n GLY 157 N 1.40 -0.35 0.00 3.44 0.00 -1.26 -4.82 105.19 103.60 3hmx n GLY 157 Ca -0.21 0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.96 3hmx n GLY 157 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hmx n ASN 158 N -2.89 1.54 -4.98 1.61 2.85 -1.26 -5.10 115.26 107.03 3hmx n ASN 158 Ca -0.14 0.00 -0.20 0.00 -0.11 0.00 0.00 54.58 54.14 3hmx n ASN 158 Cb 0.60 0.25 -0.00 0.00 1.24 0.00 0.00 39.78 41.87 3hmx n ASN 158 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 3hmx s SER 159 N -1.01 5.96 -0.06 1.20 1.04 -1.26 -3.33 113.70 116.25 3hmx s SER 159 Ca 0.00 -0.09 -0.00 0.00 0.48 0.00 0.00 55.95 56.34 3hmx s SER 159 Cb 0.00 -1.31 0.03 0.00 0.10 0.00 0.00 66.02 64.83 3hmx s SER 159 CO 0.00 -0.47 -0.02 -1.10 0.98 0.00 0.00 173.24 172.63 3hmx s GLN 160 N -4.24 0.72 0.70 4.02 -0.21 -0.34 -4.92 119.66 115.40 3hmx s GLN 160 Ca 0.45 0.00 -0.04 0.00 0.02 0.00 0.00 55.36 55.79 3hmx s GLN 160 Cb -0.10 -0.91 0.09 0.00 1.00 0.00 0.00 33.01 33.09 3hmx s GLN 160 CO 0.32 -0.20 0.98 -2.00 -2.12 0.00 0.00 175.29 172.28 3hmx s GLU 161 N 1.45 1.97 -0.30 2.91 2.12 -1.26 -1.55 118.70 124.04 3hmx s GLU 161 Ca -0.03 -0.66 -0.18 0.00 0.36 0.00 0.00 54.97 54.46 3hmx s GLU 161 Cb -0.13 -2.26 0.19 0.00 0.26 0.00 0.00 34.13 32.18 3hmx s GLU 161 CO -0.03 -1.29 1.21 0.45 -0.54 0.00 0.00 175.26 175.06 3hmx s SER 162 N -4.60 -0.20 0.06 -1.70 0.15 -1.04 -4.96 113.70 101.41 3hmx s SER 162 Ca 0.63 0.28 0.07 0.00 0.70 0.00 0.00 55.95 57.62 3hmx s SER 162 Cb -0.08 1.23 -0.03 0.00 -1.71 0.00 0.00 66.02 65.43 3hmx s SER 162 CO 0.44 -0.04 -0.18 0.54 1.20 0.00 0.00 173.24 175.20 3hmx s VAL 163 N 2.13 1.48 0.79 4.45 0.11 -1.26 -1.41 120.40 126.70 3hmx s VAL 163 Ca -0.00 -1.25 -0.10 0.00 -2.93 0.00 0.00 61.98 57.70 3hmx s VAL 163 Cb -0.02 -1.33 0.11 0.00 -1.53 0.00 0.00 36.38 33.61 3hmx s VAL 163 CO -0.16 0.04 1.13 0.42 -3.33 0.00 0.00 175.10 173.19 3hmx s THR 164 N -0.96 2.12 -0.19 5.04 -4.23 -0.86 -5.00 115.64 111.57 3hmx s THR 164 Ca 0.05 -0.17 -0.16 0.00 -1.18 0.00 0.00 61.69 60.22 3hmx s THR 164 Cb -0.09 -2.95 -0.04 0.00 1.34 0.00 0.00 72.50 70.76 3hmx s THR 164 CO 0.02 0.00 0.41 -1.61 -0.54 0.00 0.00 174.62 172.90 3hmx s GLU 165 N -5.47 4.19 -0.04 3.99 0.41 -1.26 -4.65 118.70 115.86 3hmx s GLU 165 Ca 0.65 0.23 -0.04 0.00 -0.41 0.00 0.00 54.97 55.40 3hmx s GLU 165 Cb -0.09 -3.53 -0.02 0.00 -1.78 0.00 0.00 34.13 28.72 3hmx s GLU 165 CO 0.48 -0.02 0.16 1.04 -0.49 0.00 0.00 175.26 176.43 3hmx n GLN 166 N 4.39 0.00 -1.56 1.61 6.02 -1.25 -4.68 117.38 121.91 3hmx n GLN 166 Ca -0.08 0.00 -0.46 0.00 -0.01 0.00 0.00 57.00 56.45 3hmx n GLN 166 Cb 0.51 -0.13 -0.02 0.00 1.02 0.00 0.00 30.24 31.62 3hmx n GLN 166 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 3hmx n ASP 167 N 0.47 0.88 0.17 1.08 2.03 0.35 -4.69 116.55 116.84 3hmx n ASP 167 Ca 0.04 1.17 0.13 0.00 0.52 0.00 0.00 54.79 56.65 3hmx n ASP 167 Cb -0.00 -1.22 0.49 0.00 -0.72 0.00 0.00 41.12 39.66 3hmx n ASP 167 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3hmx h SER 168 N 1.98 0.00 0.00 1.67 4.64 -1.90 -2.39 113.55 117.55 3hmx h SER 168 Ca -0.38 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.81 3hmx h SER 168 Cb 1.36 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.43 3hmx h SER 168 CO 0.61 0.00 -1.44 0.29 -0.87 0.00 0.00 176.83 175.42 3hmx n LYS 169 N -2.53 0.18 -0.15 4.77 5.02 -1.26 -4.69 118.16 119.50 3hmx n LYS 169 Ca 0.03 0.06 0.10 0.00 -2.02 0.00 0.00 58.31 56.47 3hmx n LYS 169 Cb 0.32 -0.99 0.17 0.00 -0.02 0.00 0.00 35.03 34.51 3hmx n LYS 169 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3hmx n ASP 170 N -3.01 3.12 -3.58 4.39 3.85 -1.26 -5.00 116.55 115.06 3hmx n ASP 170 Ca -0.15 -1.91 -0.25 0.00 -0.71 0.00 0.00 54.79 51.77 3hmx n ASP 170 Cb 0.63 -0.19 0.05 0.00 -1.35 0.00 0.00 41.12 40.25 3hmx n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.01 0.00 0.00 177.20 174.99 3hmx n SER 171 N 1.20 -4.85 -4.10 -1.12 7.64 -0.90 -4.95 113.62 106.53 3hmx n SER 171 Ca 0.16 -0.90 -0.08 0.00 1.01 0.00 0.00 58.87 59.06 3hmx n SER 171 Cb 0.53 -3.97 -0.10 0.00 -1.01 0.00 0.00 64.21 59.65 3hmx n SER 171 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 3hmx s THR 172 N -3.49 0.22 0.48 0.44 -1.32 -1.25 -4.78 115.64 105.94 3hmx s THR 172 Ca 0.38 -1.83 0.07 0.00 -1.21 0.00 0.00 61.69 59.10 3hmx s THR 172 Cb -0.11 -1.63 0.01 0.00 -1.51 0.00 0.00 72.50 69.26 3hmx s THR 172 CO 0.82 -0.89 0.43 -0.31 -2.21 0.00 0.00 174.62 172.46 3hmx s TYR 173 N -3.93 2.21 -0.28 9.09 2.02 -0.93 0.13 117.35 125.66 3hmx s TYR 173 Ca 0.10 -0.63 -0.17 0.00 -0.37 0.00 0.00 57.07 56.00 3hmx s TYR 173 Cb 0.08 -2.09 0.11 0.00 -0.40 0.00 0.00 41.96 39.66 3hmx s TYR 173 CO -0.08 -0.34 0.86 -1.12 -1.57 0.00 0.00 175.55 173.30 3hmx s SER 174 N -4.23 -0.69 0.33 2.29 0.01 -1.26 -1.95 113.70 108.20 3hmx s SER 174 Ca 0.45 1.12 0.07 0.00 1.31 0.00 0.00 55.95 58.90 3hmx s SER 174 Cb -0.03 1.26 -0.07 0.00 0.21 0.00 0.00 66.02 67.40 3hmx s SER 174 CO 0.27 -0.18 -0.03 -1.48 0.41 0.00 0.00 173.24 172.23 3hmx s LEU 175 N 1.30 2.56 -0.06 2.44 0.05 -0.70 -2.02 118.68 122.25 3hmx s LEU 175 Ca -0.08 -1.27 -0.01 0.00 0.05 0.00 0.00 54.13 52.82 3hmx s LEU 175 Cb -0.04 -0.72 0.03 0.00 -2.05 0.00 0.00 46.19 43.41 3hmx s LEU 175 CO -0.15 -0.39 0.01 -0.94 -0.55 0.00 0.00 176.35 174.33 3hmx s SER 176 N -3.55 1.27 -0.05 1.48 1.04 -0.50 -1.58 113.70 111.82 3hmx s SER 176 Ca 0.33 -0.03 -0.07 0.00 0.48 0.00 0.00 55.95 56.65 3hmx s SER 176 Cb 0.06 -0.33 -0.04 0.00 0.10 0.00 0.00 66.02 65.80 3hmx s SER 176 CO 0.15 -0.19 0.22 -0.55 0.98 0.00 0.00 173.24 173.85 3hmx s SER 177 N 1.83 6.47 -0.28 7.02 0.15 0.27 -2.50 113.70 126.67 3hmx s SER 177 Ca 0.02 0.54 -0.02 0.00 0.70 0.00 0.00 55.95 57.19 3hmx s SER 177 Cb -0.12 -2.09 0.09 0.00 -1.71 0.00 0.00 66.02 62.19 3hmx s SER 177 CO -0.04 0.32 0.09 -0.89 1.20 0.00 0.00 173.24 173.92 3hmx s THR 178 N -1.17 0.59 -0.00 6.45 2.01 -0.59 -0.76 115.64 122.16 3hmx s THR 178 Ca 0.22 -1.06 -0.23 0.00 0.31 0.00 0.00 61.69 60.93 3hmx s THR 178 Cb -0.13 -1.37 -0.05 0.00 0.01 0.00 0.00 72.50 70.96 3hmx s THR 178 CO 0.11 -0.57 0.68 -0.22 -0.69 0.00 0.00 174.62 173.93 3hmx s LEU 179 N 1.78 4.40 -0.06 4.42 2.96 -0.38 -1.19 118.68 130.60 3hmx s LEU 179 Ca 0.07 1.26 0.01 0.00 -0.22 0.00 0.00 54.13 55.25 3hmx s LEU 179 Cb -0.17 -3.07 0.02 0.00 0.50 0.00 0.00 46.19 43.47 3hmx s LEU 179 CO -0.24 0.01 -0.07 0.28 -1.32 0.00 0.00 176.35 175.02 3hmx s THR 180 N 0.12 0.75 0.08 3.68 -1.32 -1.21 -0.93 115.64 116.81 3hmx s THR 180 Ca 0.35 -0.23 0.01 0.00 -1.21 0.00 0.00 61.69 60.62 3hmx s THR 180 Cb -0.19 -0.75 -0.04 0.00 -1.51 0.00 0.00 72.50 70.01 3hmx s THR 180 CO 0.19 0.28 -0.06 -0.76 -2.21 0.00 0.00 174.62 172.07 3hmx s LEU 181 N 1.00 2.48 0.63 9.08 1.43 -0.13 -4.97 118.68 128.19 3hmx s LEU 181 Ca -0.09 -0.95 -0.15 0.00 -1.03 0.00 0.00 54.13 51.91 3hmx s LEU 181 Cb -0.14 -0.01 -0.02 0.00 0.03 0.00 0.00 46.19 46.04 3hmx s LEU 181 CO -0.00 -0.47 1.08 -0.94 0.23 0.00 0.00 176.35 176.25 3hmx s SER 182 N -2.84 5.49 0.27 2.29 1.04 -1.26 0.13 113.70 118.82 3hmx s SER 182 Ca 0.08 1.87 0.00 0.00 0.48 0.00 0.00 55.95 58.38 3hmx s SER 182 Cb 0.04 -2.54 0.63 0.00 0.10 0.00 0.00 66.02 64.25 3hmx s SER 182 CO -0.05 -1.37 1.68 0.50 0.98 0.00 0.00 173.24 174.98 3hmx h LYS 183 N 0.20 0.30 0.06 4.02 3.64 -0.51 -1.51 116.57 122.76 3hmx h LYS 183 Ca -0.47 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 58.89 3hmx h LYS 183 Cb 1.23 -0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.98 3hmx h LYS 183 CO 0.56 0.20 -0.06 0.00 -2.27 0.00 0.00 179.45 177.88 3hmx h ALA 184 N 1.69 -0.80 -0.06 5.00 0.00 -1.91 -1.41 119.26 121.77 3hmx h ALA 184 Ca 0.51 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.41 3hmx h ALA 184 Cb 0.95 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 3hmx h ALA 184 CO -0.56 -0.81 0.25 -0.44 0.00 0.00 0.00 179.25 177.70 3hmx h ASP 185 N -0.11 0.00 -0.03 0.00 5.19 -1.88 -1.03 116.42 118.56 3hmx h ASP 185 Ca -0.01 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.37 3hmx h ASP 185 Cb 0.10 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.61 3hmx h ASP 185 CO -0.01 0.00 -0.11 0.22 -3.12 0.00 0.00 179.24 176.23 3hmx h TYR 186 N 0.00 0.17 -0.03 4.55 3.20 -0.74 -3.17 116.97 120.95 3hmx h TYR 186 Ca 0.03 -0.07 0.01 0.00 3.14 0.00 0.00 58.73 61.84 3hmx h TYR 186 Cb 0.53 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.77 3hmx h TYR 186 CO 0.00 0.74 0.03 0.93 -1.64 0.00 0.00 178.16 178.22 3hmx h GLU 187 N -0.46 0.00 -1.00 1.82 4.39 -0.11 -2.80 114.58 116.43 3hmx h GLU 187 Ca -0.01 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 3hmx h GLU 187 Cb 0.75 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.39 3hmx h GLU 187 CO 0.02 0.00 0.01 1.63 -1.16 0.00 0.00 179.01 179.51 3hmx n LYS 188 N -4.08 1.04 -3.65 2.33 5.02 -1.10 -4.82 118.16 112.90 3hmx n LYS 188 Ca -0.02 -0.05 -0.10 0.00 -2.02 0.00 0.00 58.31 56.11 3hmx n LYS 188 Cb 0.12 -1.19 -0.03 0.00 -0.02 0.00 0.00 35.03 33.90 3hmx n LYS 188 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 3hmx s HIS 189 N -0.39 -0.24 0.01 2.13 3.76 -1.06 -5.07 115.29 114.44 3hmx s HIS 189 Ca 0.01 -0.08 -0.02 0.00 -0.15 0.00 0.00 55.06 54.82 3hmx s HIS 189 Cb 0.01 0.43 -0.01 0.00 1.11 0.00 0.00 32.58 34.11 3hmx s HIS 189 CO 0.00 -0.88 -0.05 1.17 -0.85 0.00 0.00 174.74 174.13 3hmx n LYS 190 N -0.34 0.08 -3.00 1.40 4.81 -1.26 -4.99 118.16 114.86 3hmx n LYS 190 Ca -0.12 0.03 -0.43 0.00 -0.87 0.00 0.00 58.31 56.92 3hmx n LYS 190 Cb 0.63 -0.63 -0.05 0.00 0.02 0.00 0.00 35.03 35.00 3hmx n LYS 190 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 3hmx s VAL 191 N -2.10 4.62 -0.20 3.15 1.01 -1.26 -4.26 120.40 121.36 3hmx s VAL 191 Ca -0.05 -0.23 -0.08 0.00 0.00 0.00 0.00 61.98 61.62 3hmx s VAL 191 Cb 0.01 -4.45 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 3hmx s VAL 191 CO 0.06 -1.02 0.07 -0.31 0.00 0.00 0.00 175.10 173.90 3hmx s TYR 192 N 3.29 3.23 -0.12 5.22 2.02 -1.11 -0.72 117.35 129.17 3hmx s TYR 192 Ca 0.21 0.03 -0.21 0.00 -0.37 0.00 0.00 57.07 56.73 3hmx s TYR 192 Cb -0.17 -2.12 0.05 0.00 -0.40 0.00 0.00 41.96 39.32 3hmx s TYR 192 CO 0.14 0.07 0.52 0.00 -1.57 0.00 0.00 175.55 174.71 3hmx s ALA 193 N 0.62 -1.31 -0.13 3.71 0.00 -1.19 -1.34 121.76 122.11 3hmx s ALA 193 Ca 0.04 1.18 0.02 0.00 0.00 0.00 0.00 51.96 53.20 3hmx s ALA 193 Cb -0.13 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.58 3hmx s ALA 193 CO 0.01 -0.29 -0.19 0.00 0.00 0.00 0.00 175.76 175.30 3hmx s GLU 195 N 0.98 4.17 -0.24 0.00 2.12 0.16 -2.47 118.70 123.43 3hmx s GLU 195 Ca -0.04 -0.15 -0.03 0.00 0.36 0.00 0.00 54.97 55.11 3hmx s GLU 195 Cb -0.15 -3.46 0.01 0.00 0.26 0.00 0.00 34.13 30.79 3hmx s GLU 195 CO -0.04 0.20 -0.04 0.08 -0.54 0.00 0.00 175.26 174.91 3hmx s VAL 196 N 0.65 3.19 -0.03 3.70 1.01 0.22 -2.16 120.40 126.99 3hmx s VAL 196 Ca 0.10 -0.72 -0.03 0.00 0.00 0.00 0.00 61.98 61.33 3hmx s VAL 196 Cb -0.12 -2.52 -0.04 0.00 0.00 0.00 0.00 36.38 33.69 3hmx s VAL 196 CO 0.02 0.32 0.17 -0.89 0.00 0.00 0.00 175.10 174.71 3hmx s THR 197 N 1.42 5.42 -0.20 3.92 2.01 -0.72 -2.55 115.64 124.93 3hmx s THR 197 Ca 0.04 -0.11 -0.29 0.00 0.31 0.00 0.00 61.69 61.63 3hmx s THR 197 Cb -0.15 -3.51 0.14 0.00 0.01 0.00 0.00 72.50 68.99 3hmx s THR 197 CO -0.04 0.37 1.08 -2.28 -0.69 0.00 0.00 174.62 173.06 3hmx s HIS 198 N -1.28 -0.32 -0.66 4.92 5.04 -1.26 -2.18 115.29 119.55 3hmx s HIS 198 Ca 0.25 0.60 0.18 0.00 -1.54 0.00 0.00 55.06 54.55 3hmx s HIS 198 Cb -0.13 0.45 0.78 0.00 0.04 0.00 0.00 32.58 33.72 3hmx s HIS 198 CO 0.16 -0.26 1.55 0.00 -2.34 0.00 0.00 174.74 173.85 3hmx n GLN 199 N 0.95 0.10 -0.08 2.88 10.64 -1.26 -1.02 117.38 129.59 3hmx n GLN 199 Ca -0.09 0.41 0.10 0.00 -1.83 0.00 0.00 57.00 55.59 3hmx n GLN 199 Cb 0.58 -1.73 0.36 0.00 -0.86 0.00 0.00 30.24 28.59 3hmx n GLN 199 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3hmx n GLY 200 N -0.36 0.21 3.10 2.61 0.00 -1.26 -4.78 105.19 104.71 3hmx n GLY 200 Ca 0.02 -0.38 -0.32 0.00 0.00 0.00 0.00 46.02 45.33 3hmx n GLY 200 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hmx s LEU 201 N -1.49 2.02 0.00 0.99 1.43 -0.19 -4.46 118.68 116.98 3hmx s LEU 201 Ca 0.30 -0.60 0.10 0.00 -1.03 0.00 0.00 54.13 52.90 3hmx s LEU 201 Cb 0.16 -1.40 0.58 0.00 0.03 0.00 0.00 46.19 45.56 3hmx s LEU 201 CO 0.24 -0.00 1.06 -1.54 0.23 0.00 0.00 176.35 176.34 3hmx n SER 202 N 4.56 0.00 0.00 2.29 3.41 -1.26 -4.70 113.62 117.92 3hmx n SER 202 Ca -0.20 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.57 3hmx n SER 202 Cb 0.50 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.45 3hmx n SER 202 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3hmx n SER 203 N -0.77 0.00 -4.38 4.04 3.41 -1.26 -5.12 113.62 109.55 3hmx n SER 203 Ca 0.07 0.00 -0.52 0.00 -0.26 0.00 0.00 58.87 58.16 3hmx n SER 203 Cb 0.03 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.88 3hmx n SER 203 CO 0.00 0.00 0.00 -2.65 -0.16 0.00 0.00 175.04 172.23 3hmx n PRO 204 N -0.16 0.42 -3.06 4.33 -0.02 -1.26 -4.93 135.00 130.31 3hmx n PRO 204 Ca 0.00 0.10 -0.40 0.00 -2.02 0.00 0.00 63.50 61.18 3hmx n PRO 204 Cb 0.00 -1.93 -0.05 0.00 -0.02 0.00 0.00 33.50 31.50 3hmx n PRO 204 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3hmx s VAL 205 N 7.33 5.02 -0.16 -1.45 0.11 -1.06 -4.82 120.40 125.38 3hmx s VAL 205 Ca 1.18 1.36 0.02 0.00 -2.93 0.00 0.00 61.98 61.61 3hmx s VAL 205 Cb -1.17 -4.01 0.01 0.00 -1.53 0.00 0.00 36.38 29.69 3hmx s VAL 205 CO 0.55 0.17 -0.20 0.28 -3.33 0.00 0.00 175.10 172.57 3hmx s THR 206 N 1.37 2.14 -0.14 5.04 -1.32 -1.26 -0.61 115.64 120.87 3hmx s THR 206 Ca 0.34 -0.94 -0.05 0.00 -1.21 0.00 0.00 61.69 59.83 3hmx s THR 206 Cb -0.17 -1.88 -0.04 0.00 -1.51 0.00 0.00 72.50 68.91 3hmx s THR 206 CO 0.14 0.54 0.06 -0.54 -2.21 0.00 0.00 174.62 172.61 3hmx s LYS 207 N 1.03 3.54 0.30 7.08 -0.14 -1.03 -4.97 119.74 125.55 3hmx s LYS 207 Ca -0.02 -0.32 0.03 0.00 -1.36 0.00 0.00 55.97 54.31 3hmx s LYS 207 Cb -0.14 -3.07 -0.04 0.00 -1.68 0.00 0.00 37.83 32.90 3hmx s LYS 207 CO -0.06 0.52 0.18 -1.54 -0.76 0.00 0.00 175.35 173.68 3hmx s SER 208 N -0.32 1.40 -0.28 2.83 1.04 -1.26 -1.88 113.70 115.23 3hmx s SER 208 Ca 0.08 -1.58 -0.21 0.00 0.48 0.00 0.00 55.95 54.72 3hmx s SER 208 Cb -0.12 0.43 0.09 0.00 0.10 0.00 0.00 66.02 66.52 3hmx s SER 208 CO 0.02 -0.92 0.80 0.72 0.98 0.00 0.00 173.24 174.83 3hmx s PHE 209 N -3.64 -0.79 0.00 5.02 -0.12 -0.45 -4.99 117.98 113.01 3hmx s PHE 209 Ca 0.37 1.76 0.00 0.00 -0.05 0.00 0.00 56.93 59.00 3hmx s PHE 209 Cb 0.05 0.40 0.00 0.00 -0.63 0.00 0.00 43.02 42.84 3hmx s PHE 209 CO 0.19 -0.38 0.00 0.09 -0.05 0.00 0.00 175.22 175.06 3hmx n ASN 210 N 3.19 0.00 0.00 1.98 5.03 -1.26 -2.74 115.26 121.46 3hmx n ASN 210 Ca -0.16 0.08 0.00 0.00 0.87 0.00 0.00 54.58 55.37 3hmx n ASN 210 Cb 0.57 -0.14 0.00 0.00 -1.02 0.00 0.00 39.78 39.18 3hmx n ASN 210 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 3hmx n ARG 211 N -1.33 0.00 0.00 3.52 1.74 -1.26 -4.74 116.66 114.60 3hmx n ARG 211 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3hmx n ARG 211 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 3hmx n ARG 211 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hmx n GLY 212 N 0.00 2.58 1.71 -0.13 0.00 -1.26 -5.10 105.19 102.99 3hmx n GLY 212 Ca 0.00 -1.02 -0.01 0.00 0.00 0.00 0.00 46.02 44.99 3hmx n GLY 212 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3hmx n GLU 213 N 0.00 -1.27 0.00 1.61 4.07 -1.26 -5.25 120.64 118.54 3hmx n GLU 213 Ca 0.00 1.32 0.11 0.00 -0.06 0.00 0.00 57.16 58.53 3hmx n GLU 213 Cb 0.00 -2.01 0.09 0.00 -0.06 0.00 0.00 31.44 29.47 3hmx n GLU 213 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07