#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hdi s ASN 3 N 0.00 6.42 -0.17 7.28 0.01 -0.00 -4.92 114.94 123.56 3hdi s ASN 3 Ca 0.00 0.49 0.01 0.00 -0.71 0.00 0.00 52.86 52.65 3hdi s ASN 3 Cb 0.00 -2.19 0.01 0.00 0.41 0.00 0.00 41.25 39.48 3hdi s ASN 3 CO 0.00 0.06 -0.18 0.28 -1.51 0.00 0.00 177.10 175.74 3hdi s THR 4 N 0.69 2.27 0.10 1.60 -1.32 -1.26 -1.27 115.64 116.46 3hdi s THR 4 Ca 0.17 -0.88 0.05 0.00 -1.21 0.00 0.00 61.69 59.81 3hdi s THR 4 Cb -0.13 -1.95 -0.03 0.00 -1.51 0.00 0.00 72.50 68.87 3hdi s THR 4 CO 0.05 0.53 -0.12 0.00 -2.21 0.00 0.00 174.62 172.87 3hdi s MET 5 N 1.11 0.89 -0.02 7.08 0.23 -0.00 -4.98 119.30 123.60 3hdi s MET 5 Ca 0.00 -1.14 0.06 0.00 -1.03 0.00 0.00 55.69 53.58 3hdi s MET 5 Cb -0.14 -0.70 -0.01 0.00 -1.53 0.00 0.00 34.83 32.45 3hdi s MET 5 CO -0.07 0.13 -0.21 0.99 -2.03 0.00 0.00 175.02 173.83 3hdi s THR 6 N -2.12 1.66 0.62 3.16 2.01 -1.26 0.11 115.64 119.83 3hdi s THR 6 Ca 0.05 -0.89 0.02 0.00 0.31 0.00 0.00 61.69 61.18 3hdi s THR 6 Cb -0.05 -1.39 0.08 0.00 0.01 0.00 0.00 72.50 71.16 3hdi s THR 6 CO 0.01 0.47 0.86 -0.76 -0.69 0.00 0.00 174.62 174.52 3hdi s LEU 7 N -0.41 3.14 0.17 4.42 1.43 -0.58 -5.00 118.68 121.85 3hdi s LEU 7 Ca 0.06 -0.33 -0.11 0.00 -1.03 0.00 0.00 54.13 52.72 3hdi s LEU 7 Cb -0.09 -2.26 0.07 0.00 0.03 0.00 0.00 46.19 43.94 3hdi s LEU 7 CO -0.00 -1.48 1.68 0.44 0.23 0.00 0.00 176.35 177.22 3hdi h ASP 8 N -0.15 0.91 0.14 2.29 5.19 -1.95 -2.39 116.42 120.46 3hdi h ASP 8 Ca -0.37 -0.24 0.00 0.00 -0.62 0.00 0.00 57.03 55.80 3hdi h ASP 8 Cb 1.28 -0.24 0.00 0.00 0.18 0.00 0.00 39.33 40.55 3hdi h ASP 8 CO 0.44 0.91 0.00 -0.55 -3.12 0.00 0.00 179.24 176.93 3hdi h ASN 9 N 0.86 0.00 0.00 6.45 7.08 -1.87 -3.46 115.58 124.65 3hdi h ASN 9 Ca 0.18 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.40 3hdi h ASN 9 Cb 0.36 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.60 3hdi h ASN 9 CO 0.00 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 175.96 3hdi n GLY 10 N -1.03 2.49 3.77 9.14 0.00 -0.90 -4.10 105.19 114.56 3hdi n GLY 10 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 3hdi n GLY 10 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hdi s VAL 11 N -2.28 2.44 -0.06 1.61 -7.23 -0.96 -4.42 120.40 109.49 3hdi s VAL 11 Ca 0.00 0.43 -0.02 0.00 -1.81 0.00 0.00 61.98 60.58 3hdi s VAL 11 Cb 0.00 -3.27 -0.04 0.00 0.56 0.00 0.00 36.38 33.63 3hdi s VAL 11 CO 0.00 0.10 0.06 -0.13 -0.31 0.00 0.00 175.10 174.81 3hdi s ARG 12 N -1.70 3.09 -0.28 4.82 0.52 -1.12 -1.53 118.95 122.73 3hdi s ARG 12 Ca 0.52 -0.39 -0.02 0.00 -0.52 0.00 0.00 55.73 55.32 3hdi s ARG 12 Cb -0.43 -2.88 0.04 0.00 0.52 0.00 0.00 34.95 32.20 3hdi s ARG 12 CO 0.56 0.69 -0.01 0.42 0.02 0.00 0.00 175.30 176.98 3hdi s ILE 13 N -1.03 3.02 -0.20 1.52 -1.09 0.31 -1.64 121.20 122.09 3hdi s ILE 13 Ca 0.17 -1.23 -0.04 0.00 -2.23 0.00 0.00 60.65 57.33 3hdi s ILE 13 Cb -0.12 -2.66 -0.01 0.00 -1.58 0.00 0.00 42.46 38.09 3hdi s ILE 13 CO 0.07 -0.00 -0.04 -0.51 -1.23 0.00 0.00 174.94 173.23 3hdi s ILE 14 N 1.29 3.47 0.17 2.92 -1.16 -0.60 -0.82 121.20 126.47 3hdi s ILE 14 Ca -0.03 -0.47 0.04 0.00 -0.51 0.00 0.00 60.65 59.68 3hdi s ILE 14 Cb -0.19 -2.56 -0.05 0.00 0.61 0.00 0.00 42.46 40.28 3hdi s ILE 14 CO -0.02 0.44 -0.06 0.42 -2.81 0.00 0.00 174.94 172.91 3hdi s THR 15 N 1.22 1.04 -0.27 4.00 -4.23 -0.39 -1.22 115.64 115.79 3hdi s THR 15 Ca 0.03 -2.04 -0.03 0.00 -1.18 0.00 0.00 61.69 58.47 3hdi s THR 15 Cb -0.14 -2.00 0.15 0.00 1.34 0.00 0.00 72.50 71.85 3hdi s THR 15 CO -0.01 -0.61 0.50 -0.70 -0.54 0.00 0.00 174.62 173.25 3hdi s GLU 16 N -3.80 0.46 0.14 3.99 2.12 -0.04 -0.82 118.70 120.73 3hdi s GLU 16 Ca 0.20 0.86 -0.30 0.00 0.36 0.00 0.00 54.97 56.09 3hdi s GLU 16 Cb 0.04 0.14 -0.06 0.00 0.26 0.00 0.00 34.13 34.51 3hdi s GLU 16 CO 0.03 -0.56 0.96 0.21 -0.54 0.00 0.00 175.26 175.36 3hdi s LYS 17 N 2.71 4.73 0.28 4.30 2.36 -1.26 -1.59 119.74 131.27 3hdi s LYS 17 Ca 0.13 1.46 0.11 0.00 -2.55 0.00 0.00 55.97 55.13 3hdi s LYS 17 Cb -0.15 -3.36 -0.05 0.00 -1.05 0.00 0.00 37.83 33.23 3hdi s LYS 17 CO -0.18 0.27 -0.13 -1.64 1.55 0.00 0.00 175.35 175.22 3hdi s MET 18 N -0.24 1.87 0.00 4.03 -1.94 -0.27 -4.84 119.30 117.91 3hdi s MET 18 Ca 0.46 -1.68 0.04 0.00 -1.71 0.00 0.00 55.69 52.80 3hdi s MET 18 Cb -0.24 -1.88 0.03 0.00 2.01 0.00 0.00 34.83 34.76 3hdi s MET 18 CO 0.30 0.32 0.64 0.45 -0.01 0.00 0.00 175.02 176.73 3hdi n SER 19 N -0.72 1.36 -0.38 3.03 2.88 -1.26 -4.52 113.62 114.02 3hdi n SER 19 Ca -0.05 -1.19 0.08 0.00 -1.33 0.00 0.00 58.87 56.37 3hdi n SER 19 Cb 0.60 -0.00 0.18 0.00 -0.75 0.00 0.00 64.21 64.24 3hdi n SER 19 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 3hdi n THR 20 N 0.22 2.07 -4.26 2.46 -2.24 -1.26 -5.03 114.28 106.24 3hdi n THR 20 Ca 0.02 -2.78 -0.20 0.00 -2.27 0.00 0.00 64.05 58.82 3hdi n THR 20 Cb 0.11 -0.24 -0.11 0.00 -2.10 0.00 0.00 70.33 67.98 3hdi n THR 20 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3hdi s VAL 21 N -3.07 1.47 -0.24 2.28 -7.23 -1.26 -5.04 120.40 107.30 3hdi s VAL 21 Ca 0.35 -1.69 0.02 0.00 -1.81 0.00 0.00 61.98 58.85 3hdi s VAL 21 Cb 0.33 -1.56 -0.18 0.00 0.56 0.00 0.00 36.38 35.53 3hdi s VAL 21 CO -0.02 -0.32 -0.15 0.54 -0.31 0.00 0.00 175.10 174.84 3hdi n ARG 22 N 0.63 0.66 -0.90 4.82 1.74 -1.26 -4.45 116.66 117.91 3hdi n ARG 22 Ca -0.16 0.15 -0.30 0.00 -0.77 0.00 0.00 57.85 56.77 3hdi n ARG 22 Cb 0.56 -1.54 0.25 0.00 -1.02 0.00 0.00 32.46 30.71 3hdi n ARG 22 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3hdi s SER 23 N -6.51 0.44 -0.08 0.55 1.04 -1.26 -2.67 113.70 105.20 3hdi s SER 23 Ca -0.32 0.70 -0.18 0.00 0.48 0.00 0.00 55.95 56.64 3hdi s SER 23 Cb 0.09 -0.99 0.04 0.00 0.10 0.00 0.00 66.02 65.26 3hdi s SER 23 CO 0.63 -4.43 0.43 0.54 0.98 0.00 0.00 173.24 171.39 3hdi s VAL 24 N -2.82 0.02 -0.20 5.02 0.11 -0.19 -0.49 120.40 121.86 3hdi s VAL 24 Ca 0.70 -0.20 0.01 0.00 -2.93 0.00 0.00 61.98 59.56 3hdi s VAL 24 Cb -0.11 -0.68 0.03 0.00 -1.53 0.00 0.00 36.38 34.09 3hdi s VAL 24 CO 0.57 -0.11 -0.17 -0.44 -3.33 0.00 0.00 175.10 171.61 3hdi s SER 25 N -0.67 3.51 -0.15 3.54 0.01 0.68 -1.51 113.70 119.12 3hdi s SER 25 Ca -0.08 -0.84 -0.07 0.00 1.31 0.00 0.00 55.95 56.28 3hdi s SER 25 Cb -0.04 -1.51 -0.04 0.00 0.21 0.00 0.00 66.02 64.65 3hdi s SER 25 CO 0.04 -0.05 0.09 -0.63 0.41 0.00 0.00 173.24 173.09 3hdi s ILE 26 N 1.25 5.03 -0.06 1.44 -1.09 -0.44 -1.88 121.20 125.44 3hdi s ILE 26 Ca 0.01 0.04 -0.03 0.00 -2.23 0.00 0.00 60.65 58.45 3hdi s ILE 26 Cb -0.15 -3.22 0.04 0.00 -1.58 0.00 0.00 42.46 37.55 3hdi s ILE 26 CO -0.11 0.54 0.13 -0.83 -1.23 0.00 0.00 174.94 173.44 3hdi s GLY 27 N -0.35 0.05 -0.50 6.18 0.00 0.55 -1.22 107.32 112.03 3hdi s GLY 27 Ca 0.10 0.53 -0.15 0.00 0.00 0.00 0.00 44.72 45.19 3hdi s GLY 27 CO 0.01 1.26 0.44 -0.42 0.00 0.00 0.00 173.10 174.40 3hdi s ILE 28 N 1.71 5.18 0.03 0.90 1.01 0.11 0.34 121.20 130.47 3hdi s ILE 28 Ca -0.03 -1.28 -0.08 0.00 0.00 0.00 0.00 60.65 59.26 3hdi s ILE 28 Cb -0.12 -4.20 -0.05 0.00 0.01 0.00 0.00 42.46 38.10 3hdi s ILE 28 CO -0.05 -0.71 0.32 0.26 0.00 0.00 0.00 174.94 174.76 3hdi s TRP 29 N 1.61 3.59 -0.13 3.97 0.52 0.46 -2.26 118.94 126.70 3hdi s TRP 29 Ca 0.04 0.68 -0.04 0.00 0.02 0.00 0.00 56.10 56.80 3hdi s TRP 29 Cb -0.27 -2.07 0.05 0.00 -1.15 0.00 0.00 33.47 30.04 3hdi s TRP 29 CO 0.05 0.59 0.10 0.08 0.02 0.00 0.00 176.95 177.78 3hdi s VAL 30 N -1.30 -0.13 0.00 4.03 1.01 -1.06 -0.76 120.40 122.19 3hdi s VAL 30 Ca 0.29 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.29 3hdi s VAL 30 Cb -0.14 -0.46 0.00 0.00 0.00 0.00 0.00 36.38 35.79 3hdi s VAL 30 CO 0.16 -0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.74 3hdi n GLY 31 N 5.29 0.07 3.06 4.51 0.00 -0.35 -1.81 105.19 115.96 3hdi n GLY 31 Ca -0.06 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.80 3hdi n GLY 31 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3hdi s THR 32 N 0.97 0.72 0.00 2.61 -1.32 -1.25 -4.65 115.64 112.72 3hdi s THR 32 Ca 0.00 -0.79 0.00 0.00 -1.21 0.00 0.00 61.69 59.69 3hdi s THR 32 Cb 0.00 -0.68 0.00 0.00 -1.51 0.00 0.00 72.50 70.31 3hdi s THR 32 CO 0.00 -0.08 0.00 0.61 -2.21 0.00 0.00 174.62 172.94 3hdi n GLY 33 N 2.08 3.19 0.36 6.08 0.00 -1.26 -2.39 105.19 113.26 3hdi n GLY 33 Ca -0.18 -0.66 0.18 0.00 0.00 0.00 0.00 46.02 45.35 3hdi n GLY 33 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hdi h SER 34 N 0.00 0.05 -0.60 1.61 4.64 -1.19 -1.95 113.55 116.11 3hdi h SER 34 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 3hdi h SER 34 Cb 0.00 -0.01 -0.03 0.00 -0.31 0.00 0.00 62.40 62.06 3hdi h SER 34 CO 0.00 0.03 0.19 -0.09 -0.87 0.00 0.00 176.83 176.09 3hdi h ARG 35 N 0.06 0.94 0.00 4.77 2.43 -0.04 -2.87 114.38 119.67 3hdi h ARG 35 Ca 0.23 -0.20 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 3hdi h ARG 35 Cb 0.82 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.24 3hdi h ARG 35 CO -0.01 0.83 0.00 0.66 -1.51 0.00 0.00 179.97 179.94 3hdi n TYR 36 N -4.40 0.00 -1.78 2.20 4.02 -0.74 -4.75 117.16 111.71 3hdi n TYR 36 Ca 0.03 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.63 3hdi n TYR 36 Cb 0.21 -0.50 0.13 0.00 -0.02 0.00 0.00 39.34 39.15 3hdi n TYR 36 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 3hdi s GLU 37 N -3.00 1.34 -0.03 -0.72 2.02 -1.08 -5.01 118.70 112.22 3hdi s GLU 37 Ca 0.09 0.04 0.03 0.00 0.02 0.00 0.00 54.97 55.16 3hdi s GLU 37 Cb 0.12 -1.88 -0.00 0.00 0.10 0.00 0.00 34.13 32.46 3hdi s GLU 37 CO 0.34 -2.01 -0.12 -1.54 0.02 0.00 0.00 175.26 171.94 3hdi s SER 38 N -4.47 1.56 0.00 -0.19 1.04 -1.26 -4.90 113.70 105.48 3hdi s SER 38 Ca 0.65 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.84 3hdi s SER 38 Cb -0.10 -0.36 0.00 0.00 0.10 0.00 0.00 66.02 65.65 3hdi s SER 38 CO 0.51 0.11 0.00 0.00 0.98 0.00 0.00 173.24 174.85 3hdi n ALA 39 N 3.12 0.00 0.27 5.32 0.00 -1.26 0.15 120.51 128.11 3hdi n ALA 39 Ca -0.17 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.40 3hdi n ALA 39 Cb 0.54 0.00 0.77 0.00 0.00 0.00 0.00 19.45 20.76 3hdi n ALA 39 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3hdi h GLU 40 N 0.00 0.00 -0.28 0.00 9.09 -2.01 -2.72 114.58 118.66 3hdi h GLU 40 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3hdi h GLU 40 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3hdi h GLU 40 CO 0.00 0.09 0.00 -0.85 0.05 0.00 0.00 179.01 178.30 3hdi n GLU 41 N -3.72 2.95 -1.65 1.06 0.28 0.40 -4.87 120.64 115.10 3hdi n GLU 41 Ca -0.02 -2.72 -0.47 0.00 -0.16 0.00 0.00 57.16 53.79 3hdi n GLU 41 Cb 0.20 -1.76 -0.04 0.00 1.43 0.00 0.00 31.44 31.26 3hdi n GLU 41 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 3hdi n ASN 42 N -0.33 3.47 0.00 -1.84 4.05 -1.03 -1.09 115.26 118.50 3hdi n ASN 42 Ca 0.20 0.81 0.00 0.00 0.45 0.00 0.00 54.58 56.04 3hdi n ASN 42 Cb 0.82 -1.42 0.00 0.00 1.23 0.00 0.00 39.78 40.42 3hdi n ASN 42 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 3hdi n GLY 43 N 4.80 0.89 0.24 8.20 0.00 -1.26 -3.98 105.19 114.07 3hdi n GLY 43 Ca 0.25 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.20 3hdi n GLY 43 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3hdi h ILE 44 N 0.00 1.16 -0.63 -0.61 6.09 -1.41 -0.02 117.51 122.09 3hdi h ILE 44 Ca 0.00 -0.33 0.10 0.00 -1.37 0.00 0.00 64.86 63.27 3hdi h ILE 44 Cb 0.00 0.32 -0.08 0.00 0.47 0.00 0.00 36.82 37.53 3hdi h ILE 44 CO 0.00 0.16 0.23 0.28 -3.07 0.00 0.00 178.15 175.75 3hdi h SER 45 N 0.80 0.21 -0.00 2.19 0.02 -1.89 0.86 113.55 115.74 3hdi h SER 45 Ca 0.21 0.09 -0.05 0.00 -0.84 0.00 0.00 61.79 61.20 3hdi h SER 45 Cb -0.06 0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.56 3hdi h SER 45 CO -0.04 0.12 -0.19 -0.74 -1.14 0.00 0.00 176.83 174.83 3hdi h HIS 46 N 0.40 0.20 -0.18 3.45 -0.00 -1.75 -3.01 115.15 114.26 3hdi h HIS 46 Ca 0.32 -0.11 0.05 0.00 -0.00 0.00 0.00 60.37 60.64 3hdi h HIS 46 Cb 0.42 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.41 27.80 3hdi h HIS 46 CO -0.18 0.90 0.13 0.35 -0.00 0.00 0.00 177.93 179.13 3hdi h PHE 47 N -0.55 0.01 -0.09 5.26 3.04 -0.77 -0.70 116.94 123.14 3hdi h PHE 47 Ca -0.02 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.91 3hdi h PHE 47 Cb 0.95 -0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.45 3hdi h PHE 47 CO 0.18 0.01 -0.03 1.25 -2.02 0.00 0.00 178.31 177.70 3hdi h LEU 48 N 0.01 0.17 -1.87 0.59 5.85 -0.88 -2.22 115.31 116.97 3hdi h LEU 48 Ca 0.09 -0.38 0.25 0.00 0.84 0.00 0.00 57.88 58.67 3hdi h LEU 48 Cb 0.33 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 41.27 3hdi h LEU 48 CO -0.00 0.52 0.64 -0.08 -0.34 0.00 0.00 178.44 179.18 3hdi h GLU 49 N -0.17 0.10 0.21 1.25 4.81 -0.99 -0.09 114.58 119.70 3hdi h GLU 49 Ca 0.02 -0.01 -0.32 0.00 -0.13 0.00 0.00 59.36 58.93 3hdi h GLU 49 Cb 0.44 -0.02 0.03 0.00 0.63 0.00 0.00 28.75 29.83 3hdi h GLU 49 CO 0.01 0.06 -1.40 0.45 -0.73 0.00 0.00 179.01 177.40 3hdi h HIS 50 N 0.10 0.88 0.00 0.92 3.86 -1.21 -3.30 115.15 116.41 3hdi h HIS 50 Ca 0.45 -0.63 -0.05 0.00 -1.16 0.00 0.00 60.37 58.98 3hdi h HIS 50 Cb 1.61 -0.04 -0.01 0.00 1.06 0.00 0.00 27.41 30.04 3hdi h HIS 50 CO -0.00 1.49 -0.23 0.52 0.86 0.00 0.00 177.93 180.57 3hdi h MET 51 N 0.15 0.00 0.00 2.45 2.86 -0.42 -2.58 114.93 117.39 3hdi h MET 51 Ca -0.22 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 3hdi h MET 51 Cb 2.10 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.76 3hdi h MET 51 CO 0.26 0.23 0.02 1.19 1.06 0.00 0.00 176.91 179.67 3hdi n PHE 52 N -3.75 0.29 0.25 -0.22 0.99 -0.82 -0.40 117.46 113.80 3hdi n PHE 52 Ca -0.01 0.15 0.05 0.00 -0.00 0.00 0.00 57.45 57.64 3hdi n PHE 52 Cb 0.33 -0.73 0.07 0.00 -1.00 0.00 0.00 39.48 38.15 3hdi n PHE 52 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.76 177.95 3hdi n PHE 53 N -1.79 0.11 0.49 1.38 3.01 -0.97 -4.61 117.46 115.08 3hdi n PHE 53 Ca -0.01 -0.13 0.05 0.00 1.01 0.00 0.00 57.45 58.37 3hdi n PHE 53 Cb 0.03 -0.01 0.18 0.00 -0.01 0.00 0.00 39.48 39.68 3hdi n PHE 53 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 3hdi n LYS 54 N 0.50 2.33 0.00 -1.08 4.76 0.46 -4.42 118.16 120.71 3hdi n LYS 54 Ca 0.07 -1.45 0.00 0.00 -2.87 0.00 0.00 58.31 54.06 3hdi n LYS 54 Cb 0.29 -1.54 0.00 0.00 -1.84 0.00 0.00 35.03 31.94 3hdi n LYS 54 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3hdi n GLY 55 N 0.77 2.93 0.00 0.72 0.00 -1.26 -4.10 105.19 104.24 3hdi n GLY 55 Ca 0.13 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.47 3hdi n GLY 55 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hdi n THR 56 N 0.38 0.00 0.12 2.61 -2.24 0.01 -2.60 114.28 112.57 3hdi n THR 56 Ca 0.00 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.58 3hdi n THR 56 Cb 0.00 0.00 -0.14 0.00 -2.10 0.00 0.00 70.33 68.09 3hdi n THR 56 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 3hdi h ASN 57 N 0.00 0.64 0.01 3.42 4.21 -1.90 -3.38 115.58 118.59 3hdi h ASN 57 Ca 0.00 -0.66 -0.00 0.00 1.21 0.00 0.00 56.30 56.85 3hdi h ASN 57 Cb 0.00 -0.21 0.00 0.00 -1.12 0.00 0.00 38.32 36.99 3hdi h ASN 57 CO 0.00 1.51 -0.01 0.74 -1.29 0.00 0.00 177.43 178.38 3hdi h THR 58 N 0.14 1.54 -4.29 2.81 2.02 -1.97 -3.47 112.91 109.69 3hdi h THR 58 Ca -0.18 -1.98 -0.56 0.00 0.77 0.00 0.00 66.41 64.46 3hdi h THR 58 Cb 2.01 2.83 -0.28 0.00 -1.74 0.00 0.00 68.15 70.97 3hdi h THR 58 CO 0.23 0.49 -0.84 0.00 0.37 0.00 0.00 175.52 175.78 3hdi s ARG 59 N -2.57 1.43 0.68 6.66 1.70 -1.26 -5.14 118.95 120.44 3hdi s ARG 59 Ca -0.17 -0.71 -0.10 0.00 -0.47 0.00 0.00 55.73 54.28 3hdi s ARG 59 Cb -0.02 -1.41 0.02 0.00 -0.57 0.00 0.00 34.95 32.97 3hdi s ARG 59 CO 0.62 0.38 1.04 -1.54 -1.08 0.00 0.00 175.30 174.72 3hdi s SER 60 N -0.62 5.42 0.35 -2.89 1.04 -1.26 -0.81 113.70 114.94 3hdi s SER 60 Ca 0.07 0.97 0.12 0.00 0.48 0.00 0.00 55.95 57.59 3hdi s SER 60 Cb -0.07 -1.81 0.94 0.00 0.10 0.00 0.00 66.02 65.18 3hdi s SER 60 CO -0.00 -1.29 1.76 0.00 0.98 0.00 0.00 173.24 174.69 3hdi h ALA 61 N -0.53 1.95 -0.09 5.32 0.00 -1.77 0.11 119.26 124.25 3hdi h ALA 61 Ca -0.45 0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.34 3hdi h ALA 61 Cb 1.26 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3hdi h ALA 61 CO 0.63 -0.36 -0.79 0.37 0.00 0.00 0.00 179.25 179.10 3hdi h GLN 62 N 0.55 0.53 -0.05 0.00 4.15 -1.93 -2.41 115.11 115.94 3hdi h GLN 62 Ca 0.60 -0.45 -0.09 0.00 0.77 0.00 0.00 58.65 59.47 3hdi h GLN 62 Cb 1.24 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 29.02 3hdi h GLN 62 CO -0.37 1.08 -0.40 0.93 -1.93 0.00 0.00 178.83 178.14 3hdi h GLU 63 N 0.35 0.10 -0.38 1.69 5.08 -1.27 -0.39 114.58 119.76 3hdi h GLU 63 Ca -0.05 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 58.20 3hdi h GLU 63 Cb 1.39 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 3hdi h GLU 63 CO 0.14 0.49 -0.03 0.82 -1.00 0.00 0.00 179.01 179.44 3hdi h ILE 64 N 0.09 1.27 -0.56 3.13 2.04 -0.77 -1.18 117.51 121.51 3hdi h ILE 64 Ca 0.01 -1.05 -0.10 0.00 1.00 0.00 0.00 64.86 64.72 3hdi h ILE 64 Cb 0.75 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.00 3hdi h ILE 64 CO 0.06 0.35 -0.04 0.00 0.00 0.00 0.00 178.15 178.51 3hdi h ALA 65 N 0.86 0.76 -0.09 1.87 0.00 -1.07 -2.82 119.26 118.77 3hdi h ALA 65 Ca 0.10 -0.32 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 3hdi h ALA 65 Cb 0.51 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 3hdi h ALA 65 CO 0.02 0.63 -0.30 0.93 0.00 0.00 0.00 179.25 180.54 3hdi h GLU 66 N 0.91 0.17 0.17 0.00 5.08 -0.92 -1.88 114.58 118.10 3hdi h GLU 66 Ca 0.15 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.45 3hdi h GLU 66 Cb 0.60 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.84 3hdi h GLU 66 CO 0.04 0.46 -0.08 0.35 -1.00 0.00 0.00 179.01 178.77 3hdi h PHE 67 N 0.15 -0.21 -0.21 4.33 3.57 -1.01 -2.28 116.94 121.28 3hdi h PHE 67 Ca 0.02 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 3hdi h PHE 67 Cb 0.61 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.41 3hdi h PHE 67 CO 0.01 0.21 -0.02 0.74 -2.23 0.00 0.00 178.31 177.02 3hdi h PHE 68 N -0.73 0.32 -0.51 0.41 0.04 -1.53 -1.84 116.94 113.10 3hdi h PHE 68 Ca -0.02 -0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.63 3hdi h PHE 68 Cb 0.51 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.54 3hdi h PHE 68 CO 0.07 0.35 -0.06 -0.44 -0.60 0.00 0.00 178.31 177.62 3hdi h ASP 69 N 0.31 0.90 0.36 2.17 3.45 -1.35 0.17 116.42 122.43 3hdi h ASP 69 Ca 0.07 -0.26 0.00 0.00 0.43 0.00 0.00 57.03 57.27 3hdi h ASP 69 Cb 0.24 -0.24 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 3hdi h ASP 69 CO 0.01 0.99 0.00 -1.54 -1.57 0.00 0.00 179.24 177.13 3hdi n SER 70 N -4.17 0.00 -2.42 6.45 3.41 -0.71 -2.77 113.62 113.42 3hdi n SER 70 Ca 0.02 0.44 -0.23 0.00 -0.26 0.00 0.00 58.87 58.84 3hdi n SER 70 Cb 0.36 -0.47 0.01 0.00 -0.26 0.00 0.00 64.21 63.85 3hdi n SER 70 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 3hdi n ILE 71 N -1.47 2.19 0.00 -1.33 -5.35 -0.81 -4.94 119.36 107.65 3hdi n ILE 71 Ca 0.03 -4.47 0.00 0.00 -0.27 0.00 0.00 62.75 58.04 3hdi n ILE 71 Cb 0.12 -0.89 0.00 0.00 -1.74 0.00 0.00 39.64 37.13 3hdi n ILE 71 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3hdi n GLY 72 N -0.48 2.92 2.07 3.28 0.00 -1.11 -4.19 105.19 107.68 3hdi n GLY 72 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.37 3hdi n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hdi n GLY 73 N -0.39 0.56 1.12 -0.02 0.00 0.54 -4.92 105.19 102.09 3hdi n GLY 73 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3hdi n GLY 73 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3hdi n GLN 74 N -2.89 0.63 -3.71 1.61 1.13 -1.26 -4.84 117.38 108.05 3hdi n GLN 74 Ca 0.00 0.00 -0.20 0.00 -1.94 0.00 0.00 57.00 54.86 3hdi n GLN 74 Cb 0.00 -1.18 -0.01 0.00 0.11 0.00 0.00 30.24 29.15 3hdi n GLN 74 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 3hdi s VAL 75 N 0.43 4.48 0.00 5.09 0.11 -1.26 -2.76 120.40 126.50 3hdi s VAL 75 Ca 0.00 -1.04 0.00 0.00 -2.93 0.00 0.00 61.98 58.01 3hdi s VAL 75 Cb 0.00 -3.56 0.00 0.00 -1.53 0.00 0.00 36.38 31.29 3hdi s VAL 75 CO 0.00 -0.23 0.00 -3.20 -3.33 0.00 0.00 175.10 168.34 3hdi n ASN 76 N -1.51 0.00 -3.66 3.54 2.85 -0.90 -4.99 115.26 110.58 3hdi n ASN 76 Ca -0.04 0.00 -0.15 0.00 -0.11 0.00 0.00 54.58 54.28 3hdi n ASN 76 Cb 0.58 0.00 -0.07 0.00 1.24 0.00 0.00 39.78 41.52 3hdi n ASN 76 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3hdi s ALA 77 N -2.00 -1.15 0.17 5.20 0.00 -1.26 -1.44 121.76 121.28 3hdi s ALA 77 Ca 0.00 0.64 -0.11 0.00 0.00 0.00 0.00 51.96 52.50 3hdi s ALA 77 Cb 0.00 0.11 -0.00 0.00 0.00 0.00 0.00 23.12 23.22 3hdi s ALA 77 CO 0.00 -0.33 0.33 -0.59 0.00 0.00 0.00 175.76 175.17 3hdi s PHE 78 N -1.50 0.29 -0.02 0.00 -0.71 -0.61 -4.99 117.98 110.43 3hdi s PHE 78 Ca -0.11 -0.65 0.04 0.00 -1.04 0.00 0.00 56.93 55.17 3hdi s PHE 78 Cb -0.03 0.04 -0.01 0.00 -1.21 0.00 0.00 43.02 41.81 3hdi s PHE 78 CO 0.05 -0.76 -0.14 0.99 -1.34 0.00 0.00 175.22 174.02 3hdi s THR 79 N -3.95 1.13 0.00 -4.49 2.01 -1.26 -0.74 115.64 108.35 3hdi s THR 79 Ca 0.15 -0.60 0.00 0.00 0.31 0.00 0.00 61.69 61.56 3hdi s THR 79 Cb 0.02 -0.96 0.00 0.00 0.01 0.00 0.00 72.50 71.58 3hdi s THR 79 CO -0.01 0.32 0.00 -0.24 -0.69 0.00 0.00 174.62 174.01 3hdi n SER 80 N 2.87 1.76 0.08 3.53 2.88 0.85 -5.00 113.62 120.59 3hdi n SER 80 Ca -0.15 -0.46 -0.10 0.00 -1.33 0.00 0.00 58.87 56.83 3hdi n SER 80 Cb 0.55 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.92 3hdi n SER 80 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 3hdi h LYS 81 N 0.00 0.12 0.00 -1.46 1.57 -1.95 -1.90 116.57 112.95 3hdi h LYS 81 Ca 0.00 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 3hdi h LYS 81 Cb 0.00 0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.37 3hdi h LYS 81 CO 0.00 1.03 -0.12 0.39 -0.57 0.00 0.00 179.45 180.18 3hdi n GLU 82 N -3.50 1.06 -3.61 3.15 1.02 -1.26 0.59 120.64 118.09 3hdi n GLU 82 Ca -0.03 -2.08 -0.05 0.00 -0.02 0.00 0.00 57.16 54.98 3hdi n GLU 82 Cb 0.91 -1.20 -0.03 0.00 -0.02 0.00 0.00 31.44 31.10 3hdi n GLU 82 CO 0.00 0.00 0.00 1.52 1.18 0.00 0.00 177.13 179.83 3hdi s TYR 83 N -2.00 -0.14 0.21 -0.32 -0.85 -1.23 -3.87 117.35 109.15 3hdi s TYR 83 Ca 0.21 0.17 0.11 0.00 -0.52 0.00 0.00 57.07 57.05 3hdi s TYR 83 Cb 0.19 0.49 -0.05 0.00 0.38 0.00 0.00 41.96 42.98 3hdi s TYR 83 CO 0.02 -0.16 -0.22 0.99 -1.52 0.00 0.00 175.55 174.66 3hdi s THR 84 N -1.64 2.28 -0.11 -3.49 2.01 -0.75 -0.10 115.64 113.84 3hdi s THR 84 Ca 0.07 -2.13 -0.10 0.00 0.31 0.00 0.00 61.69 59.84 3hdi s THR 84 Cb -0.01 -2.13 0.03 0.00 0.01 0.00 0.00 72.50 70.40 3hdi s THR 84 CO -0.05 -0.25 0.30 0.00 -0.69 0.00 0.00 174.62 173.94 3hdi s TYR 86 N 0.16 1.39 0.20 0.00 2.02 -0.96 -1.58 117.35 118.59 3hdi s TYR 86 Ca -0.00 -0.64 -0.07 0.00 -0.37 0.00 0.00 57.07 55.99 3hdi s TYR 86 Cb -0.02 -1.15 -0.02 0.00 -0.40 0.00 0.00 41.96 40.37 3hdi s TYR 86 CO 0.00 -0.44 0.28 1.52 -1.57 0.00 0.00 175.55 175.34 3hdi s TYR 87 N 1.48 0.68 0.12 2.71 1.13 -0.52 0.07 117.35 123.01 3hdi s TYR 87 Ca 0.00 -0.99 -0.19 0.00 -1.41 0.00 0.00 57.07 54.48 3hdi s TYR 87 Cb -0.13 -0.18 0.05 0.00 -1.10 0.00 0.00 41.96 40.60 3hdi s TYR 87 CO -0.05 -0.77 0.47 0.00 -2.51 0.00 0.00 175.55 172.69 3hdi s ALA 88 N -4.05 -1.18 -0.17 9.51 0.00 -0.36 -2.12 121.76 123.39 3hdi s ALA 88 Ca 0.27 0.22 -0.00 0.00 0.00 0.00 0.00 51.96 52.45 3hdi s ALA 88 Cb 0.04 0.67 0.04 0.00 0.00 0.00 0.00 23.12 23.87 3hdi s ALA 88 CO 0.07 -0.64 -0.06 0.21 0.00 0.00 0.00 175.76 175.34 3hdi s LYS 89 N -3.49 1.53 0.08 0.00 2.20 -1.11 -1.33 119.74 117.62 3hdi s LYS 89 Ca 0.01 -0.56 0.03 0.00 -0.36 0.00 0.00 55.97 55.09 3hdi s LYS 89 Cb 0.01 -2.06 -0.03 0.00 -1.51 0.00 0.00 37.83 34.23 3hdi s LYS 89 CO -0.10 -0.43 -0.10 0.14 -0.36 0.00 0.00 175.35 174.50 3hdi s VAL 90 N 1.60 0.85 0.18 4.02 -7.23 -0.57 -4.58 120.40 114.67 3hdi s VAL 90 Ca 0.01 -1.46 -0.30 0.00 -1.81 0.00 0.00 61.98 58.41 3hdi s VAL 90 Cb -0.15 -1.15 -0.09 0.00 0.56 0.00 0.00 36.38 35.55 3hdi s VAL 90 CO -0.08 -0.48 1.36 -0.76 -0.31 0.00 0.00 175.10 174.83 3hdi s LEU 91 N -2.15 4.40 0.28 1.32 1.43 -1.26 -1.02 118.68 121.67 3hdi s LEU 91 Ca 0.01 2.42 0.15 0.00 -1.03 0.00 0.00 54.13 55.68 3hdi s LEU 91 Cb -0.05 -3.60 1.01 0.00 0.03 0.00 0.00 46.19 43.57 3hdi s LEU 91 CO 0.00 -0.60 1.21 -0.90 0.23 0.00 0.00 176.35 176.29 3hdi n ASP 92 N 3.04 0.25 0.00 2.29 3.85 -1.09 -0.41 116.55 124.47 3hdi n ASP 92 Ca 0.08 1.27 0.04 0.00 -0.71 0.00 0.00 54.79 55.47 3hdi n ASP 92 Cb 0.42 -0.61 0.21 0.00 -1.35 0.00 0.00 41.12 39.79 3hdi n ASP 92 CO 0.00 0.00 0.00 -0.90 -1.01 0.00 0.00 177.20 175.29 3hdi n ASP 93 N -4.75 0.00 0.00 -1.12 5.68 -1.26 -1.45 116.55 113.65 3hdi n ASP 93 Ca 0.28 -0.12 0.00 0.00 -0.50 0.00 0.00 54.79 54.45 3hdi n ASP 93 Cb 0.96 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 40.87 3hdi n ASP 93 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3hdi n HIS 94 N -1.08 0.00 -0.12 2.11 8.25 0.45 -4.78 115.22 120.06 3hdi n HIS 94 Ca 0.05 -0.01 0.04 0.00 -0.26 0.00 0.00 57.72 57.54 3hdi n HIS 94 Cb 0.03 -0.00 0.36 0.00 1.12 0.00 0.00 29.99 31.50 3hdi n HIS 94 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3hdi h ALA 95 N 0.00 1.65 -0.40 -1.41 0.00 -1.26 -0.12 119.26 117.72 3hdi h ALA 95 Ca 0.00 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3hdi h ALA 95 Cb 0.19 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 3hdi h ALA 95 CO 0.00 0.29 -0.03 0.78 0.00 0.00 0.00 179.25 180.29 3hdi h GLY 96 N 0.73 0.79 1.45 0.00 0.00 -1.86 -1.81 103.07 102.37 3hdi h GLY 96 Ca 0.24 -0.60 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 3hdi h GLY 96 CO -0.06 0.55 -0.09 1.46 0.00 0.00 0.00 176.54 178.40 3hdi h GLN 97 N 0.55 0.66 -0.49 4.80 4.20 -1.73 -1.22 115.11 121.88 3hdi h GLN 97 Ca 0.11 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.60 3hdi h GLN 97 Cb 0.52 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 3hdi h GLN 97 CO 0.03 0.74 0.22 0.00 -0.67 0.00 0.00 178.83 179.15 3hdi h ALA 98 N 1.29 0.64 -0.30 3.87 0.00 -0.81 -1.68 119.26 122.27 3hdi h ALA 98 Ca 0.11 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 3hdi h ALA 98 Cb 0.52 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 3hdi h ALA 98 CO 0.03 0.22 -0.19 0.82 0.00 0.00 0.00 179.25 180.13 3hdi h ILE 99 N 0.66 1.25 -0.41 0.00 1.08 -0.99 -1.20 117.51 117.90 3hdi h ILE 99 Ca 0.17 -1.18 -0.06 0.00 -0.39 0.00 0.00 64.86 63.40 3hdi h ILE 99 Cb 0.14 1.23 -0.02 0.00 -3.07 0.00 0.00 36.82 35.11 3hdi h ILE 99 CO -0.02 0.38 0.03 0.44 -0.69 0.00 0.00 178.15 178.30 3hdi h ASP 100 N 0.50 0.68 -0.26 1.72 3.32 -0.85 -1.13 116.42 120.40 3hdi h ASP 100 Ca 0.08 -0.28 -0.06 0.00 0.02 0.00 0.00 57.03 56.79 3hdi h ASP 100 Cb 0.61 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 3hdi h ASP 100 CO 0.04 0.80 -0.07 0.74 -1.72 0.00 0.00 179.24 179.03 3hdi h THR 101 N 0.54 1.28 -0.28 0.35 2.02 -1.15 -2.59 112.91 113.09 3hdi h THR 101 Ca 0.12 -1.09 -0.02 0.00 0.77 0.00 0.00 66.41 66.19 3hdi h THR 101 Cb 0.43 1.47 -0.02 0.00 -1.74 0.00 0.00 68.15 68.29 3hdi h THR 101 CO 0.01 0.34 0.09 -0.07 0.37 0.00 0.00 175.52 176.27 3hdi h LEU 102 N 0.24 0.36 0.36 2.58 3.38 -1.15 -2.53 115.31 118.54 3hdi h LEU 102 Ca 0.06 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3hdi h LEU 102 Cb 0.54 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3hdi h LEU 102 CO 0.03 0.35 -0.17 0.28 0.09 0.00 0.00 178.44 179.01 3hdi h SER 103 N 0.40 -0.41 -0.82 -0.43 0.02 -1.08 -1.57 113.55 109.66 3hdi h SER 103 Ca 0.10 -0.14 0.19 0.00 -0.84 0.00 0.00 61.79 61.11 3hdi h SER 103 Cb 0.12 0.11 -0.12 0.00 0.14 0.00 0.00 62.40 62.64 3hdi h SER 103 CO -0.01 -0.07 0.27 -0.78 -1.14 0.00 0.00 176.83 175.11 3hdi h ASP 104 N -0.78 0.14 -0.35 3.07 3.58 -1.30 0.24 116.42 121.02 3hdi h ASP 104 Ca -0.05 0.16 -0.04 0.00 0.42 0.00 0.00 57.03 57.52 3hdi h ASP 104 Cb 0.52 0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.73 3hdi h ASP 104 CO 0.08 -0.03 0.07 0.24 -2.88 0.00 0.00 179.24 176.72 3hdi h MET 105 N 0.32 0.56 -0.48 0.28 2.86 -1.38 0.13 114.93 117.23 3hdi h MET 105 Ca 0.49 -0.14 -0.03 0.00 -2.06 0.00 0.00 59.70 57.95 3hdi h MET 105 Cb 0.89 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.46 3hdi h MET 105 CO -0.54 0.62 0.16 0.35 1.06 0.00 0.00 176.91 178.57 3hdi h PHE 106 N 0.41 0.75 0.00 -0.22 3.57 0.08 -3.28 116.94 118.25 3hdi h PHE 106 Ca 0.11 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.54 3hdi h PHE 106 Cb 0.32 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.84 3hdi h PHE 106 CO 0.02 0.65 -0.12 1.19 -2.23 0.00 0.00 178.31 177.82 3hdi n PHE 107 N -4.54 0.11 -0.75 0.41 3.01 0.62 -4.67 117.46 111.65 3hdi n PHE 107 Ca 0.01 0.05 -0.12 0.00 1.01 0.00 0.00 57.45 58.40 3hdi n PHE 107 Cb 0.18 -0.26 0.03 0.00 -0.01 0.00 0.00 39.48 39.42 3hdi n PHE 107 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 3hdi n HIS 108 N -2.74 1.16 -3.00 1.38 8.25 0.45 -4.89 115.22 115.82 3hdi n HIS 108 Ca -0.02 -1.70 -0.42 0.00 -0.26 0.00 0.00 57.72 55.33 3hdi n HIS 108 Cb 0.06 -0.83 -0.06 0.00 1.12 0.00 0.00 29.99 30.29 3hdi n HIS 108 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3hdi s SER 109 N 0.60 6.54 0.00 0.41 0.15 -1.11 -2.98 113.70 117.31 3hdi s SER 109 Ca 0.23 0.36 -0.22 0.00 0.70 0.00 0.00 55.95 57.02 3hdi s SER 109 Cb 0.18 -2.38 -0.05 0.00 -1.71 0.00 0.00 66.02 62.06 3hdi s SER 109 CO -0.00 -0.66 0.66 0.42 1.20 0.00 0.00 173.24 174.85 3hdi s THR 110 N 2.95 4.87 -0.97 6.45 -4.23 -1.07 -4.98 115.64 118.65 3hdi s THR 110 Ca 0.29 1.38 -0.01 0.00 -1.18 0.00 0.00 61.69 62.17 3hdi s THR 110 Cb -0.14 -4.00 0.32 0.00 1.34 0.00 0.00 72.50 70.02 3hdi s THR 110 CO 0.15 0.39 1.58 0.49 -0.54 0.00 0.00 174.62 176.68 3hdi n PHE 111 N 2.85 2.80 -1.18 3.99 3.72 -1.26 -4.69 117.46 123.69 3hdi n PHE 111 Ca -0.05 -2.81 -0.37 0.00 -0.05 0.00 0.00 57.45 54.18 3hdi n PHE 111 Cb 0.51 -1.10 0.05 0.00 -0.94 0.00 0.00 39.48 37.99 3hdi n PHE 111 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 3hdi n GLN 112 N 0.36 0.12 -0.12 -1.08 6.02 -1.26 -4.68 117.38 116.74 3hdi n GLN 112 Ca 0.38 0.06 -0.07 0.00 -0.01 0.00 0.00 57.00 57.36 3hdi n GLN 112 Cb 0.30 -1.41 0.09 0.00 1.02 0.00 0.00 30.24 30.24 3hdi n GLN 112 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 3hdi h LYS 113 N -0.45 0.86 0.06 -1.09 3.64 -1.98 -1.52 116.57 116.10 3hdi h LYS 113 Ca -0.44 -0.30 -0.00 0.00 -1.27 0.00 0.00 60.65 58.64 3hdi h LYS 113 Cb 1.37 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.12 3hdi h LYS 113 CO 0.38 0.93 -0.03 1.05 -2.27 0.00 0.00 179.45 179.51 3hdi h GLU 114 N 0.77 -0.08 0.01 1.90 9.09 -2.00 -2.67 114.58 121.60 3hdi h GLU 114 Ca 0.12 0.01 -0.00 0.00 0.05 0.00 0.00 59.36 59.54 3hdi h GLU 114 Cb 0.63 0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.75 3hdi h GLU 114 CO 0.04 0.17 -0.01 0.93 0.05 0.00 0.00 179.01 180.20 3hdi h GLU 115 N -0.33 -0.02 -0.01 1.06 3.07 -1.91 -2.73 114.58 113.71 3hdi h GLU 115 Ca -0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3hdi h GLU 115 Cb 0.29 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.20 3hdi h GLU 115 CO 0.01 0.28 0.18 1.25 -1.40 0.00 0.00 179.01 179.33 3hdi h LEU 116 N -0.32 0.00 0.01 1.33 6.46 -1.34 -0.09 115.31 121.36 3hdi h LEU 116 Ca -0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 3hdi h LEU 116 Cb 0.31 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.24 3hdi h LEU 116 CO 0.00 0.00 -0.00 -0.08 -0.62 0.00 0.00 178.44 177.74 3hdi h GLU 117 N 0.00 -0.01 -0.28 1.25 4.57 -1.18 -3.15 114.58 115.79 3hdi h GLU 117 Ca 0.01 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.11 3hdi h GLU 117 Cb 0.37 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 3hdi h GLU 117 CO -0.00 0.62 -0.17 0.87 -1.18 0.00 0.00 179.01 179.15 3hdi h LYS 118 N -0.99 0.48 0.00 1.92 1.79 -1.18 -2.75 116.57 115.84 3hdi h LYS 118 Ca -0.00 -0.15 -0.04 0.00 -2.18 0.00 0.00 60.65 58.27 3hdi h LYS 118 Cb 0.63 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.23 3hdi h LYS 118 CO 0.00 0.64 -0.21 1.49 -1.08 0.00 0.00 179.45 180.29 3hdi h GLU 119 N 0.44 0.00 -0.22 3.15 4.57 -1.18 -2.44 114.58 118.90 3hdi h GLU 119 Ca 0.08 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.16 3hdi h GLU 119 Cb 0.55 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.13 3hdi h GLU 119 CO 0.04 0.21 -0.28 -0.09 -1.18 0.00 0.00 179.01 177.71 3hdi h ARG 120 N 0.00 0.43 -0.16 1.92 2.43 -1.44 -2.95 114.38 114.61 3hdi h ARG 120 Ca -0.00 -0.17 -0.04 0.00 -0.81 0.00 0.00 59.98 58.96 3hdi h ARG 120 Cb 0.73 -0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.25 3hdi h ARG 120 CO 0.03 0.67 -0.05 0.87 -1.51 0.00 0.00 179.97 179.98 3hdi h LYS 121 N 0.38 0.32 -0.22 0.20 1.57 -1.47 -2.07 116.57 115.28 3hdi h LYS 121 Ca 0.05 -0.13 0.06 0.00 -1.87 0.00 0.00 60.65 58.77 3hdi h LYS 121 Cb 0.69 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.97 3hdi h LYS 121 CO 0.05 0.60 0.17 -0.39 -0.57 0.00 0.00 179.45 179.31 3hdi h VAL 122 N 0.01 0.82 0.00 0.50 -1.51 -1.41 0.59 116.25 115.25 3hdi h VAL 122 Ca 0.04 0.00 -0.11 0.00 -1.23 0.00 0.00 66.70 65.40 3hdi h VAL 122 Cb 0.49 0.88 -0.02 0.00 -2.13 0.00 0.00 31.29 30.52 3hdi h VAL 122 CO 0.02 0.00 -0.62 0.58 -1.23 0.00 0.00 177.57 176.32 3hdi h VAL 123 N 0.00 0.75 -0.08 7.19 2.07 -1.38 0.24 116.25 125.04 3hdi h VAL 123 Ca 0.10 -2.10 -0.15 0.00 0.82 0.00 0.00 66.70 65.38 3hdi h VAL 123 Cb 0.44 2.33 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 3hdi h VAL 123 CO -0.00 0.43 -0.61 -0.26 0.02 0.00 0.00 177.57 177.15 3hdi h PHE 124 N 0.00 0.36 0.01 1.57 0.05 0.71 0.11 116.94 119.75 3hdi h PHE 124 Ca -0.03 -0.14 -0.18 0.00 3.82 0.00 0.00 57.97 61.45 3hdi h PHE 124 Cb 1.39 -0.06 0.01 0.00 2.00 0.00 0.00 35.95 39.29 3hdi h PHE 124 CO 0.00 0.81 -0.70 0.93 -0.18 0.00 0.00 178.31 179.17 3hdi h GLU 125 N 0.20 0.46 -0.74 1.51 4.39 -0.37 -2.47 114.58 117.56 3hdi h GLU 125 Ca -0.01 -0.51 0.06 0.00 0.34 0.00 0.00 59.36 59.25 3hdi h GLU 125 Cb 1.12 0.15 -0.05 0.00 -0.10 0.00 0.00 28.75 29.87 3hdi h GLU 125 CO 0.10 1.16 0.49 1.49 -1.16 0.00 0.00 179.01 181.08 3hdi h GLU 126 N -0.03 0.77 -0.15 2.33 4.81 -0.37 0.12 114.58 122.05 3hdi h GLU 126 Ca -0.09 -0.05 -0.07 0.00 -0.13 0.00 0.00 59.36 59.03 3hdi h GLU 126 Cb 1.41 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.62 3hdi h GLU 126 CO 0.14 0.51 -0.16 0.82 -0.73 0.00 0.00 179.01 179.59 3hdi h ILE 127 N 0.79 1.35 -0.36 2.32 2.04 -0.75 -2.97 117.51 119.93 3hdi h ILE 127 Ca 0.32 -1.33 -0.04 0.00 1.00 0.00 0.00 64.86 64.81 3hdi h ILE 127 Cb 0.24 1.87 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 3hdi h ILE 127 CO -0.11 0.39 0.05 0.11 0.00 0.00 0.00 178.15 178.59 3hdi h LYS 128 N 0.01 0.55 -0.72 2.37 1.57 -0.92 -2.44 116.57 116.99 3hdi h LYS 128 Ca 0.02 -0.10 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 3hdi h LYS 128 Cb 0.70 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.89 3hdi h LYS 128 CO 0.04 0.54 0.31 1.98 -0.57 0.00 0.00 179.45 181.75 3hdi h MET 129 N 0.53 1.04 0.00 3.15 4.05 -0.70 0.42 114.93 123.42 3hdi h MET 129 Ca 0.12 -0.16 -0.06 0.00 -0.28 0.00 0.00 59.70 59.31 3hdi h MET 129 Cb 0.27 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 3hdi h MET 129 CO 0.00 0.83 -0.31 -0.39 0.23 0.00 0.00 176.91 177.27 3hdi h VAL 130 N 1.03 0.58 -0.32 -5.77 -1.51 -1.37 -3.00 116.25 105.89 3hdi h VAL 130 Ca 0.25 -1.62 -0.13 0.00 -1.23 0.00 0.00 66.70 63.97 3hdi h VAL 130 Cb 0.15 2.13 -0.01 0.00 -2.13 0.00 0.00 31.29 31.43 3hdi h VAL 130 CO -0.03 0.30 -0.34 -0.78 -1.23 0.00 0.00 177.57 175.49 3hdi h ASP 131 N 0.00 0.76 0.43 4.19 1.82 -0.72 -2.15 116.42 120.74 3hdi h ASP 131 Ca -0.00 -0.32 0.00 0.00 -0.39 0.00 0.00 57.03 56.32 3hdi h ASP 131 Cb 1.10 -0.21 0.00 0.00 0.68 0.00 0.00 39.33 40.90 3hdi h ASP 131 CO 0.04 1.04 0.00 0.47 -1.61 0.00 0.00 179.24 179.18 3hdi n ASP 132 N -4.06 0.00 -4.11 2.28 9.92 0.01 -4.28 116.55 116.31 3hdi n ASP 132 Ca -0.01 -0.26 -0.36 0.00 -0.53 0.00 0.00 54.79 53.62 3hdi n ASP 132 Cb 0.50 -0.23 -0.07 0.00 -0.64 0.00 0.00 41.12 40.67 3hdi n ASP 132 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 3hdi s THR 133 N -2.46 4.15 0.46 -3.53 2.01 -0.81 -4.94 115.64 110.52 3hdi s THR 133 Ca 0.30 -3.52 0.23 0.00 0.31 0.00 0.00 61.69 59.00 3hdi s THR 133 Cb 0.19 -3.62 0.42 0.00 0.01 0.00 0.00 72.50 69.50 3hdi s THR 133 CO 0.41 -1.01 1.86 1.55 -0.69 0.00 0.00 174.62 176.73 3hdi h PRO 134 N 6.40 0.25 0.00 4.92 0.13 -1.77 0.13 132.00 142.06 3hdi h PRO 134 Ca 0.10 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 3hdi h PRO 134 Cb 0.87 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3hdi h PRO 134 CO 0.80 0.17 0.00 -0.40 -0.23 0.00 0.00 178.00 178.33 3hdi n ASP 135 N -4.44 0.00 -0.10 1.44 5.68 -1.26 -3.00 116.55 114.88 3hdi n ASP 135 Ca 0.20 -0.13 -0.20 0.00 -0.50 0.00 0.00 54.79 54.16 3hdi n ASP 135 Cb 0.81 -0.28 -0.07 0.00 -1.14 0.00 0.00 41.12 40.44 3hdi n ASP 135 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 3hdi n ASP 136 N -1.28 1.46 0.20 -1.12 2.03 0.36 -4.65 116.55 113.55 3hdi n ASP 136 Ca 0.14 0.25 0.06 0.00 0.52 0.00 0.00 54.79 55.76 3hdi n ASP 136 Cb 0.23 -0.60 0.43 0.00 -0.72 0.00 0.00 41.12 40.46 3hdi n ASP 136 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 3hdi h ILE 137 N -0.73 0.93 0.00 5.18 2.10 -1.43 -2.89 117.51 120.67 3hdi h ILE 137 Ca -0.45 -1.23 -0.01 0.00 1.08 0.00 0.00 64.86 64.25 3hdi h ILE 137 Cb 1.36 1.72 -0.00 0.00 -1.09 0.00 0.00 36.82 38.82 3hdi h ILE 137 CO -0.28 0.31 -0.03 1.62 -1.08 0.00 0.00 178.15 178.70 3hdi h VAL 138 N 0.00 0.51 -0.18 2.19 3.04 -1.79 -0.22 116.25 119.80 3hdi h VAL 138 Ca -0.00 -0.12 -0.15 0.00 -1.01 0.00 0.00 66.70 65.41 3hdi h VAL 138 Cb 0.70 1.08 -0.01 0.00 -2.01 0.00 0.00 31.29 31.05 3hdi h VAL 138 CO 0.04 0.03 -0.53 0.45 -1.01 0.00 0.00 177.57 176.55 3hdi h HIS 139 N 0.00 0.65 -0.13 3.17 3.86 -1.78 -2.65 115.15 118.28 3hdi h HIS 139 Ca -0.00 -0.22 -0.21 0.00 -1.16 0.00 0.00 60.37 58.77 3hdi h HIS 139 Cb 0.08 -0.13 0.01 0.00 1.06 0.00 0.00 27.41 28.43 3hdi h HIS 139 CO 0.00 0.94 -0.75 -0.44 0.86 0.00 0.00 177.93 178.54 3hdi h ASP 140 N 0.41 0.88 -0.09 2.45 3.32 -1.23 -2.59 116.42 119.56 3hdi h ASP 140 Ca 0.01 -0.65 0.03 0.00 0.02 0.00 0.00 57.03 56.44 3hdi h ASP 140 Cb 1.06 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 40.34 3hdi h ASP 140 CO 0.10 1.39 0.09 -0.07 -1.72 0.00 0.00 179.24 179.03 3hdi h LEU 141 N 0.44 0.00 -0.05 1.55 3.38 -1.13 -0.51 115.31 118.99 3hdi h LEU 141 Ca -0.06 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.77 3hdi h LEU 141 Cb 1.39 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.15 3hdi h LEU 141 CO 0.15 0.00 -0.54 0.25 0.09 0.00 0.00 178.44 178.40 3hdi h LEU 142 N 0.00 0.56 -1.61 1.67 5.85 -1.15 -2.78 115.31 117.85 3hdi h LEU 142 Ca 0.04 -0.70 0.09 0.00 0.84 0.00 0.00 57.88 58.15 3hdi h LEU 142 Cb 0.23 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 3hdi h LEU 142 CO -0.00 1.18 0.41 0.28 -0.34 0.00 0.00 178.44 179.96 3hdi h SER 143 N -0.02 0.40 0.17 1.25 0.02 -0.75 -1.25 113.55 113.37 3hdi h SER 143 Ca -0.05 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 3hdi h SER 143 Cb 1.22 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.68 3hdi h SER 143 CO 0.11 0.25 -0.08 -1.28 -1.14 0.00 0.00 176.83 174.69 3hdi h SER 144 N 0.45 -0.19 -0.02 3.07 0.87 -1.29 -2.18 113.55 114.27 3hdi h SER 144 Ca 0.28 -0.25 0.02 0.00 -1.23 0.00 0.00 61.79 60.61 3hdi h SER 144 Cb 0.49 0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.48 3hdi h SER 144 CO -0.08 0.16 -0.09 0.00 -0.53 0.00 0.00 176.83 176.28 3hdi h ALA 145 N 0.19 -0.09 -0.67 6.23 0.00 -1.14 -0.22 119.26 123.57 3hdi h ALA 145 Ca -0.02 0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.99 3hdi h ALA 145 Cb 0.42 0.17 -0.07 0.00 0.00 0.00 0.00 17.79 18.31 3hdi h ALA 145 CO 0.04 -0.58 0.31 1.15 0.00 0.00 0.00 179.25 180.17 3hdi h THR 146 N -0.16 0.83 -0.35 0.00 2.02 -1.27 -3.11 112.91 110.87 3hdi h THR 146 Ca 0.04 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 67.04 3hdi h THR 146 Cb 0.21 0.24 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 3hdi h THR 146 CO -0.11 0.10 0.00 -1.22 0.37 0.00 0.00 175.52 174.66 3hdi n TYR 147 N -4.90 1.02 0.00 3.16 4.01 -0.82 -1.39 117.16 118.24 3hdi n TYR 147 Ca 0.10 -0.76 0.00 0.00 -0.16 0.00 0.00 57.90 57.08 3hdi n TYR 147 Cb 0.27 -0.27 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 3hdi n TYR 147 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3hdi n GLY 148 N -0.01 1.96 0.98 2.72 0.00 -0.11 -1.09 105.19 109.65 3hdi n GLY 148 Ca 0.20 0.49 0.08 0.00 0.00 0.00 0.00 46.02 46.79 3hdi n GLY 148 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3hdi n LYS 149 N 3.52 3.11 -1.91 1.61 5.02 -1.26 -4.74 118.16 123.51 3hdi n LYS 149 Ca 0.00 -2.52 -0.32 0.00 -2.02 0.00 0.00 58.31 53.45 3hdi n LYS 149 Cb 0.00 -1.61 0.01 0.00 -0.02 0.00 0.00 35.03 33.42 3hdi n LYS 149 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 3hdi s HIS 150 N -1.76 3.32 -0.08 2.13 2.46 -0.25 -4.94 115.29 116.17 3hdi s HIS 150 Ca 0.37 1.41 0.27 0.00 0.47 0.00 0.00 55.06 57.57 3hdi s HIS 150 Cb 0.24 -2.84 1.37 0.00 -0.13 0.00 0.00 32.58 31.23 3hdi s HIS 150 CO 0.17 -0.88 1.81 0.66 -2.47 0.00 0.00 174.74 174.03 3hdi h SER 151 N -0.07 0.00 1.23 9.88 4.64 -1.87 -1.05 113.55 126.32 3hdi h SER 151 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3hdi h SER 151 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 3hdi h SER 151 CO 0.59 0.00 0.00 0.25 -0.87 0.00 0.00 176.83 176.80 3hdi h LEU 152 N 0.00 0.00 0.00 5.97 5.85 -1.87 -2.96 115.31 122.29 3hdi h LEU 152 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3hdi h LEU 152 Cb 0.09 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.12 3hdi h LEU 152 CO 0.00 0.00 -1.29 0.61 -0.34 0.00 0.00 178.44 177.42 3hdi n GLY 153 N 0.70 -1.20 3.76 3.75 0.00 -0.40 -4.78 105.19 107.02 3hdi n GLY 153 Ca 0.04 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 3hdi n GLY 153 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3hdi s TYR 154 N -3.32 3.37 0.39 1.61 4.12 -1.12 -3.88 117.35 118.52 3hdi s TYR 154 Ca -0.00 1.60 -0.26 0.00 0.02 0.00 0.00 57.07 58.42 3hdi s TYR 154 Cb 0.13 -3.41 -0.09 0.00 -1.52 0.00 0.00 41.96 37.08 3hdi s TYR 154 CO 0.83 -1.01 1.28 -1.25 0.02 0.00 0.00 175.55 175.42 3hdi s PRO 155 N -1.66 4.05 0.11 -1.71 0.04 -1.26 -4.95 135.00 129.63 3hdi s PRO 155 Ca 0.47 2.11 -0.22 0.00 0.04 0.00 0.00 61.00 63.39 3hdi s PRO 155 Cb -0.34 -2.80 -0.07 0.00 0.04 0.00 0.00 34.50 31.33 3hdi s PRO 155 CO 0.44 -0.40 1.70 0.82 0.04 0.00 0.00 177.00 179.60 3hdi h ILE 156 N 2.54 0.77 0.00 0.56 1.08 -1.94 -1.08 117.51 119.44 3hdi h ILE 156 Ca -0.49 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 63.98 3hdi h ILE 156 Cb 1.24 0.77 0.00 0.00 -3.07 0.00 0.00 36.82 35.76 3hdi h ILE 156 CO 0.63 0.00 0.00 0.18 -0.69 0.00 0.00 178.15 178.27 3hdi n LEU 157 N -5.21 0.00 0.00 1.44 4.77 -1.26 -4.24 117.00 112.50 3hdi n LEU 157 Ca -0.05 0.44 0.01 0.00 -0.03 0.00 0.00 56.01 56.39 3hdi n LEU 157 Cb 0.14 -0.44 -0.00 0.00 -2.33 0.00 0.00 43.42 40.78 3hdi n LEU 157 CO 0.27 -0.33 -0.01 0.61 -1.33 0.00 0.00 177.39 176.60 3hdi n GLY 158 N -0.67 -1.99 3.96 -0.72 0.00 -0.41 -4.67 105.19 100.69 3hdi n GLY 158 Ca 0.02 -1.39 -0.20 0.00 0.00 0.00 0.00 46.02 44.46 3hdi n GLY 158 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hdi s THR 159 N -0.29 2.51 0.10 2.61 -4.23 -1.26 -4.82 115.64 110.27 3hdi s THR 159 Ca 0.00 -1.18 0.06 0.00 -1.18 0.00 0.00 61.69 59.38 3hdi s THR 159 Cb 0.00 -2.70 -0.22 0.00 1.34 0.00 0.00 72.50 70.92 3hdi s THR 159 CO 0.00 0.00 1.20 0.58 -0.54 0.00 0.00 174.62 175.86 3hdi h VAL 160 N 0.68 1.61 -0.31 2.29 2.07 -1.95 -2.88 116.25 117.76 3hdi h VAL 160 Ca -0.38 -3.31 -0.11 0.00 0.82 0.00 0.00 66.70 63.73 3hdi h VAL 160 Cb 1.28 2.83 -0.01 0.00 -1.52 0.00 0.00 31.29 33.86 3hdi h VAL 160 CO 0.50 0.92 -0.27 -0.33 0.02 0.00 0.00 177.57 178.41 3hdi h GLU 161 N 0.01 0.62 0.03 1.57 3.07 -1.98 -2.30 114.58 115.60 3hdi h GLU 161 Ca -0.05 -0.26 -0.00 0.00 -0.50 0.00 0.00 59.36 58.55 3hdi h GLU 161 Cb 1.82 -0.03 0.00 0.00 -0.84 0.00 0.00 28.75 29.71 3hdi h GLU 161 CO 0.14 0.83 -0.01 1.79 -1.40 0.00 0.00 179.01 180.35 3hdi h THR 162 N 0.54 1.32 -0.77 1.13 1.35 -1.88 -3.22 112.91 111.39 3hdi h THR 162 Ca 0.07 -1.14 0.09 0.00 -0.55 0.00 0.00 66.41 64.88 3hdi h THR 162 Cb 0.74 2.08 -0.07 0.00 -1.73 0.00 0.00 68.15 69.17 3hdi h THR 162 CO 0.06 0.29 0.42 -0.07 -0.25 0.00 0.00 175.52 175.97 3hdi h LEU 163 N -0.54 0.58 -0.71 3.87 3.38 -1.51 -1.75 115.31 118.63 3hdi h LEU 163 Ca -0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3hdi h LEU 163 Cb 0.50 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.20 3hdi h LEU 163 CO 0.01 0.33 0.42 0.78 0.09 0.00 0.00 178.44 180.07 3hdi h ASN 164 N 0.71 0.00 0.00 -0.43 -0.26 -1.42 -0.06 115.58 114.12 3hdi h ASN 164 Ca 0.37 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.11 3hdi h ASN 164 Cb 0.36 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.62 3hdi h ASN 164 CO -0.25 0.00 -0.48 -1.54 -1.06 0.00 0.00 177.43 174.09 3hdi n SER 165 N -2.04 1.09 -4.60 5.81 3.41 -0.67 -5.00 113.62 111.64 3hdi n SER 165 Ca -0.01 -0.47 -0.44 0.00 -0.26 0.00 0.00 58.87 57.69 3hdi n SER 165 Cb 0.44 1.06 -0.04 0.00 -0.26 0.00 0.00 64.21 65.41 3hdi n SER 165 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 3hdi n PHE 166 N -1.26 2.03 -4.29 7.33 0.99 -0.04 -4.93 117.46 117.29 3hdi n PHE 166 Ca 0.01 -0.12 -0.27 0.00 -0.00 0.00 0.00 57.45 57.07 3hdi n PHE 166 Cb 0.09 -2.72 -0.07 0.00 -1.00 0.00 0.00 39.48 35.79 3hdi n PHE 166 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.76 177.30 3hdi s ASN 167 N 7.43 4.30 0.60 4.37 2.20 -1.26 -4.99 114.94 127.60 3hdi s ASN 167 Ca 1.00 -1.24 0.30 0.00 -0.94 0.00 0.00 52.86 51.98 3hdi s ASN 167 Cb -0.42 -0.20 1.77 0.00 -2.00 0.00 0.00 41.25 40.39 3hdi s ASN 167 CO 0.39 -0.64 2.16 -0.08 -2.94 0.00 0.00 177.10 175.98 3hdi h GLU 168 N 1.40 0.00 -0.05 3.55 4.81 -1.93 -0.97 114.58 121.39 3hdi h GLU 168 Ca -0.42 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.77 3hdi h GLU 168 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 3hdi h GLU 168 CO 0.71 0.00 -0.12 0.78 -0.73 0.00 0.00 179.01 179.65 3hdi h GLY 169 N 0.00 0.19 1.27 1.92 0.00 -1.96 -1.98 103.07 102.51 3hdi h GLY 169 Ca 0.05 -0.23 -0.06 0.00 0.00 0.00 0.00 47.33 47.09 3hdi h GLY 169 CO -0.00 0.21 0.13 -0.33 0.00 0.00 0.00 176.54 176.55 3hdi h MET 170 N -0.33 0.91 0.61 4.80 2.86 -1.61 -1.10 114.93 121.08 3hdi h MET 170 Ca 0.00 -0.20 -0.03 0.00 -2.06 0.00 0.00 59.70 57.41 3hdi h MET 170 Cb 0.71 -0.13 0.01 0.00 0.06 0.00 0.00 31.60 32.25 3hdi h MET 170 CO 0.03 0.83 -0.29 -0.07 1.06 0.00 0.00 176.91 178.46 3hdi h LEU 171 N 0.87 -0.70 -1.21 1.22 3.38 -1.24 -1.91 115.31 115.73 3hdi h LEU 171 Ca 0.19 0.02 0.12 0.00 0.09 0.00 0.00 57.88 58.31 3hdi h LEU 171 Cb 0.34 0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.19 3hdi h LEU 171 CO 0.00 -0.46 0.58 0.03 0.09 0.00 0.00 178.44 178.68 3hdi h ARG 172 N -0.89 0.78 -0.17 1.13 3.08 -1.35 0.50 114.38 117.46 3hdi h ARG 172 Ca -0.08 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 59.92 3hdi h ARG 172 Cb 0.63 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 3hdi h ARG 172 CO 0.14 0.52 0.10 1.25 -1.07 0.00 0.00 179.97 180.91 3hdi h HIS 173 N 0.81 0.19 0.56 3.04 2.76 -1.16 1.11 115.15 122.46 3hdi h HIS 173 Ca 0.45 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.60 3hdi h HIS 173 Cb 0.58 -0.06 0.01 0.00 1.55 0.00 0.00 27.41 29.48 3hdi h HIS 173 CO -0.00 0.12 -0.27 -0.92 -1.30 0.00 0.00 177.93 175.55 3hdi h TYR 174 N 0.21 -0.70 -0.89 5.26 5.03 -0.36 -3.14 116.97 122.39 3hdi h TYR 174 Ca 0.07 -0.02 0.11 0.00 2.58 0.00 0.00 58.73 61.47 3hdi h TYR 174 Cb -0.01 0.23 -0.08 0.00 1.55 0.00 0.00 36.73 38.43 3hdi h TYR 174 CO -0.08 -0.37 0.52 1.98 -1.32 0.00 0.00 178.16 178.89 3hdi h MET 175 N -0.98 0.82 0.00 1.82 4.05 0.10 -0.16 114.93 120.58 3hdi h MET 175 Ca -0.08 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.29 3hdi h MET 175 Cb 0.65 -0.19 0.00 0.00 -0.80 0.00 0.00 31.60 31.26 3hdi h MET 175 CO 0.13 0.54 0.00 -0.25 0.23 0.00 0.00 176.91 177.56 3hdi n ASP 176 N -4.71 0.00 -0.11 1.39 8.00 0.38 -1.20 116.55 120.30 3hdi n ASP 176 Ca 0.16 -0.41 -0.19 0.00 0.71 0.00 0.00 54.79 55.06 3hdi n ASP 176 Cb 0.31 -0.08 -0.06 0.00 -0.02 0.00 0.00 41.12 41.28 3hdi n ASP 176 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3hdi n ARG 177 N -1.08 0.54 -0.01 -1.24 1.74 -0.10 -4.80 116.66 111.71 3hdi n ARG 177 Ca 0.12 0.23 -0.12 0.00 -0.77 0.00 0.00 57.85 57.30 3hdi n ARG 177 Cb 0.08 -1.42 -0.14 0.00 -1.02 0.00 0.00 32.46 29.96 3hdi n ARG 177 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 3hdi h PHE 178 N -0.96 0.16 0.00 -1.55 -1.00 -1.48 -3.40 116.94 108.71 3hdi h PHE 178 Ca -0.34 -0.11 -0.37 0.00 2.81 0.00 0.00 57.97 59.96 3hdi h PHE 178 Cb 1.27 -0.01 0.00 0.00 3.61 0.00 0.00 35.95 40.83 3hdi h PHE 178 CO -0.25 1.24 2.13 0.66 -1.61 0.00 0.00 178.31 180.47 3hdi n TYR 179 N -3.19 1.20 -4.37 -0.55 4.02 -0.34 -4.38 117.16 109.55 3hdi n TYR 179 Ca -0.21 -1.93 -0.19 0.00 -0.01 0.00 0.00 57.90 55.57 3hdi n TYR 179 Cb 1.05 -1.71 -0.10 0.00 -0.02 0.00 0.00 39.34 38.56 3hdi n TYR 179 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 3hdi s THR 180 N 2.70 1.30 0.04 -0.72 -4.23 -1.26 -4.74 115.64 108.73 3hdi s THR 180 Ca 0.47 -2.08 -0.07 0.00 -1.18 0.00 0.00 61.69 58.84 3hdi s THR 180 Cb 0.15 -2.35 -0.00 0.00 1.34 0.00 0.00 72.50 71.64 3hdi s THR 180 CO -0.03 -0.35 0.37 0.61 -0.54 0.00 0.00 174.62 174.68 3hdi n GLY 181 N -0.47 -0.60 0.25 3.99 0.00 -0.66 0.02 105.19 107.73 3hdi n GLY 181 Ca -0.06 0.28 0.17 0.00 0.00 0.00 0.00 46.02 46.41 3hdi n GLY 181 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3hdi h ASP 182 N 0.00 0.00 0.00 1.61 5.19 -1.77 -2.51 116.42 118.94 3hdi h ASP 182 Ca 0.05 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.26 3hdi h ASP 182 Cb 0.11 0.00 -0.04 0.00 0.18 0.00 0.00 39.33 39.58 3hdi h ASP 182 CO -0.23 0.00 -2.09 -1.22 -3.12 0.00 0.00 179.24 172.58 3hdi n TYR 183 N -2.76 0.00 -2.62 4.55 4.02 0.10 -4.88 117.16 115.57 3hdi n TYR 183 Ca -0.01 0.00 -0.40 0.00 -0.01 0.00 0.00 57.90 57.49 3hdi n TYR 183 Cb 0.15 -0.71 -0.05 0.00 -0.02 0.00 0.00 39.34 38.71 3hdi n TYR 183 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 3hdi s VAL 184 N -2.78 3.81 -0.26 -0.72 1.01 -0.85 -1.21 120.40 119.40 3hdi s VAL 184 Ca -0.08 1.76 -0.01 0.00 0.00 0.00 0.00 61.98 63.64 3hdi s VAL 184 Cb 0.08 -4.09 0.15 0.00 0.00 0.00 0.00 36.38 32.52 3hdi s VAL 184 CO 0.76 0.37 0.44 -0.69 0.00 0.00 0.00 175.10 175.98 3hdi s VAL 185 N -1.25 -0.71 -0.19 2.92 1.01 0.06 -2.81 120.40 119.43 3hdi s VAL 185 Ca 0.45 -0.08 -0.21 0.00 0.00 0.00 0.00 61.98 62.13 3hdi s VAL 185 Cb -0.28 -0.89 -0.03 0.00 0.00 0.00 0.00 36.38 35.19 3hdi s VAL 185 CO 0.35 -0.11 0.62 -0.63 0.00 0.00 0.00 175.10 175.33 3hdi s ILE 186 N 2.63 5.03 -0.09 2.22 -1.09 -0.65 -0.40 121.20 128.84 3hdi s ILE 186 Ca 0.14 1.18 0.02 0.00 -2.23 0.00 0.00 60.65 59.77 3hdi s ILE 186 Cb -0.15 -3.94 -0.02 0.00 -1.58 0.00 0.00 42.46 36.78 3hdi s ILE 186 CO -0.19 0.13 -0.17 -0.55 -1.23 0.00 0.00 174.94 172.93 3hdi s SER 187 N 1.14 3.75 -0.02 3.58 0.15 0.15 -1.56 113.70 120.89 3hdi s SER 187 Ca 0.29 -0.35 0.02 0.00 0.70 0.00 0.00 55.95 56.61 3hdi s SER 187 Cb -0.16 -1.26 0.00 0.00 -1.71 0.00 0.00 66.02 62.89 3hdi s SER 187 CO 0.11 0.22 -0.07 -0.69 1.20 0.00 0.00 173.24 174.02 3hdi s VAL 188 N -0.01 0.58 -0.07 4.45 1.01 -0.35 -0.33 120.40 125.68 3hdi s VAL 188 Ca -0.05 -0.26 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 3hdi s VAL 188 Cb -0.14 -0.53 0.02 0.00 0.00 0.00 0.00 36.38 35.73 3hdi s VAL 188 CO 0.04 0.19 0.23 0.00 0.00 0.00 0.00 175.10 175.56 3hdi s ALA 189 N 0.19 -0.57 0.00 5.51 0.00 -0.79 -0.87 121.76 125.24 3hdi s ALA 189 Ca -0.02 0.50 0.00 0.00 0.00 0.00 0.00 51.96 52.44 3hdi s ALA 189 Cb -0.07 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.79 3hdi s ALA 189 CO -0.00 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.02 3hdi n GLY 190 N 2.51 0.11 2.56 0.00 0.00 -0.62 -0.23 105.19 109.52 3hdi n GLY 190 Ca -0.15 -1.68 -0.40 0.00 0.00 0.00 0.00 46.02 43.79 3hdi n GLY 190 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3hdi n ASN 191 N 0.00 5.97 -4.64 1.61 4.05 0.36 -1.11 115.26 121.50 3hdi n ASN 191 Ca 0.00 -2.70 -0.43 0.00 0.45 0.00 0.00 54.58 51.90 3hdi n ASN 191 Cb 0.00 -1.57 -0.02 0.00 1.23 0.00 0.00 39.78 39.41 3hdi n ASN 191 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3hdi s VAL 192 N 2.84 4.32 0.07 3.44 1.01 -1.26 -4.81 120.40 126.01 3hdi s VAL 192 Ca 0.57 1.52 -0.06 0.00 0.00 0.00 0.00 61.98 64.01 3hdi s VAL 192 Cb 0.16 -4.26 -0.05 0.00 0.00 0.00 0.00 36.38 32.23 3hdi s VAL 192 CO -0.07 -0.45 0.32 -1.00 0.00 0.00 0.00 175.10 173.91 3hdi s HIS 193 N 3.96 3.53 0.39 5.22 3.76 -1.26 -4.93 115.29 125.96 3hdi s HIS 193 Ca 0.51 0.56 0.06 0.00 -0.15 0.00 0.00 55.06 56.04 3hdi s HIS 193 Cb -0.15 -1.99 0.79 0.00 1.11 0.00 0.00 32.58 32.33 3hdi s HIS 193 CO 0.19 0.53 2.01 -0.44 -0.85 0.00 0.00 174.74 176.18 3hdi h ASP 194 N 3.41 0.49 -0.92 1.40 3.45 -2.00 -2.18 116.42 120.08 3hdi h ASP 194 Ca -0.48 -0.03 0.04 0.00 0.43 0.00 0.00 57.03 56.99 3hdi h ASP 194 Cb 1.18 -0.12 -0.05 0.00 -0.56 0.00 0.00 39.33 39.77 3hdi h ASP 194 CO 0.70 0.40 0.60 -0.33 -1.57 0.00 0.00 179.24 179.04 3hdi h GLU 195 N 0.56 1.12 -0.38 3.56 3.07 -2.00 -1.68 114.58 118.84 3hdi h GLU 195 Ca 0.15 -0.07 -0.15 0.00 -0.50 0.00 0.00 59.36 58.79 3hdi h GLU 195 Cb 0.03 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 27.68 3hdi h GLU 195 CO -0.02 0.74 -0.35 1.25 -1.40 0.00 0.00 179.01 179.23 3hdi h LEU 196 N 1.15 0.96 -1.34 1.33 5.85 -1.81 -2.49 115.31 118.96 3hdi h LEU 196 Ca 0.37 -0.46 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 3hdi h LEU 196 Cb 0.02 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.75 3hdi h LEU 196 CO -0.11 1.22 0.32 0.40 -0.34 0.00 0.00 178.44 179.93 3hdi h ILE 197 N 0.71 1.17 -0.39 4.05 1.08 -1.16 -0.91 117.51 122.05 3hdi h ILE 197 Ca 0.06 -0.40 -0.14 0.00 -0.39 0.00 0.00 64.86 63.99 3hdi h ILE 197 Cb 0.94 0.39 -0.01 0.00 -3.07 0.00 0.00 36.82 35.07 3hdi h ILE 197 CO 0.09 0.18 -0.33 0.44 -0.69 0.00 0.00 178.15 177.84 3hdi h ASP 198 N 0.78 0.92 0.22 1.72 3.32 -1.19 -1.40 116.42 120.80 3hdi h ASP 198 Ca 0.20 -0.39 -0.05 0.00 0.02 0.00 0.00 57.03 56.81 3hdi h ASP 198 Cb -0.00 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.28 3hdi h ASP 198 CO -0.04 1.16 -0.24 0.50 -1.72 0.00 0.00 179.24 178.91 3hdi h LYS 199 N 0.73 0.03 -0.00 3.56 3.64 -0.89 -1.49 116.57 122.15 3hdi h LYS 199 Ca 0.07 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.44 3hdi h LYS 199 Cb 0.89 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.71 3hdi h LYS 199 CO 0.08 0.27 -0.02 0.82 -2.27 0.00 0.00 179.45 178.33 3hdi h ILE 200 N 0.03 1.52 -0.93 2.00 2.04 -0.89 -2.85 117.51 118.42 3hdi h ILE 200 Ca 0.00 -1.54 0.02 0.00 1.00 0.00 0.00 64.86 64.33 3hdi h ILE 200 Cb 0.43 2.55 -0.05 0.00 -0.74 0.00 0.00 36.82 39.02 3hdi h ILE 200 CO 0.03 0.40 0.62 0.11 0.00 0.00 0.00 178.15 179.31 3hdi h LYS 201 N -0.62 1.21 0.00 2.37 1.57 -1.11 0.19 116.57 120.17 3hdi h LYS 201 Ca -0.00 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3hdi h LYS 201 Cb 0.67 -0.27 0.00 0.00 0.08 0.00 0.00 32.23 32.71 3hdi h LYS 201 CO 0.00 0.80 0.00 1.49 -0.57 0.00 0.00 179.45 181.17 3hdi h GLU 202 N 1.24 0.00 0.00 3.15 4.81 -1.34 -3.08 114.58 119.36 3hdi h GLU 202 Ca 0.35 0.00 -0.36 0.00 -0.13 0.00 0.00 59.36 59.22 3hdi h GLU 202 Cb -0.11 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.21 3hdi h GLU 202 CO -0.08 0.00 -2.19 2.41 -0.73 0.00 0.00 179.01 178.41 3hdi n THR 203 N -2.62 1.49 0.75 0.32 -1.04 -0.76 -4.50 114.28 107.92 3hdi n THR 203 Ca 0.02 -0.27 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 3hdi n THR 203 Cb 0.31 -1.97 0.05 0.00 -1.82 0.00 0.00 70.33 66.90 3hdi n THR 203 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 3hdi n PHE 204 N -4.26 0.29 -0.01 -1.42 3.72 0.59 -1.97 117.46 114.39 3hdi n PHE 204 Ca -0.45 -0.21 0.00 0.00 -0.05 0.00 0.00 57.45 56.74 3hdi n PHE 204 Cb 0.80 -0.19 -0.12 0.00 -0.94 0.00 0.00 39.48 39.03 3hdi n PHE 204 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 3hdi n SER 205 N 0.12 0.43 0.22 4.37 3.41 -1.16 -4.04 113.62 116.97 3hdi n SER 205 Ca 0.04 0.19 0.06 0.00 -0.26 0.00 0.00 58.87 58.90 3hdi n SER 205 Cb 0.43 0.82 0.52 0.00 -0.26 0.00 0.00 64.21 65.72 3hdi n SER 205 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 3hdi h GLN 206 N 0.00 0.02 -6.57 4.33 4.15 -1.66 -3.44 115.11 111.93 3hdi h GLN 206 Ca -0.22 -0.00 -0.58 0.00 0.77 0.00 0.00 58.65 58.61 3hdi h GLN 206 Cb 1.61 -0.00 0.08 0.00 0.21 0.00 0.00 27.48 29.37 3hdi h GLN 206 CO 0.03 0.17 0.67 1.55 -1.93 0.00 0.00 178.83 179.31 3hdi n VAL 207 N -4.35 0.70 -2.32 2.39 3.14 -1.26 -4.93 118.33 111.70 3hdi n VAL 207 Ca -0.02 -0.18 -0.40 0.00 -2.96 0.00 0.00 64.34 60.78 3hdi n VAL 207 Cb 0.22 -1.50 -0.03 0.00 -1.06 0.00 0.00 33.84 31.47 3hdi n VAL 207 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 3hdi s LYS 208 N -0.07 4.39 0.71 1.45 3.01 -1.26 -4.68 119.74 123.28 3hdi s LYS 208 Ca 0.71 1.93 -0.16 0.00 -1.01 0.00 0.00 55.97 57.43 3hdi s LYS 208 Cb -0.65 -3.00 0.03 0.00 -1.01 0.00 0.00 37.83 33.19 3hdi s LYS 208 CO 0.47 -0.06 1.26 -2.14 0.51 0.00 0.00 175.35 175.38 3hdi s PRO 209 N -1.81 2.19 -0.37 -1.68 0.02 -1.26 -1.65 135.00 130.44 3hdi s PRO 209 Ca 0.49 1.93 -0.29 0.00 0.02 0.00 0.00 61.00 63.16 3hdi s PRO 209 Cb -0.34 -1.82 0.02 0.00 0.02 0.00 0.00 34.50 32.38 3hdi s PRO 209 CO 0.44 -1.84 1.21 0.99 -0.33 0.00 0.00 177.00 177.46 3hdi s THR 210 N -1.70 4.23 -0.24 0.99 2.01 -1.26 -4.67 115.64 115.00 3hdi s THR 210 Ca 0.79 1.35 -0.08 0.00 0.31 0.00 0.00 61.69 64.06 3hdi s THR 210 Cb -0.34 -4.37 -0.17 0.00 0.01 0.00 0.00 72.50 67.63 3hdi s THR 210 CO 0.44 -0.67 -0.11 0.35 -0.69 0.00 0.00 174.62 173.94 3hdi n THR 211 N 6.41 1.56 -1.72 -0.82 -2.24 -1.26 -4.96 114.28 111.25 3hdi n THR 211 Ca 0.13 -0.45 -0.40 0.00 -2.27 0.00 0.00 64.05 61.07 3hdi n THR 211 Cb 0.48 -1.71 0.03 0.00 -2.10 0.00 0.00 70.33 67.03 3hdi n THR 211 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hdi n TYR 212 N -3.78 2.22 -3.78 4.78 9.36 -1.26 -4.99 117.16 119.72 3hdi n TYR 212 Ca -0.45 0.46 -0.29 0.00 3.32 0.00 0.00 57.90 60.94 3hdi n TYR 212 Cb 0.93 -2.37 -0.13 0.00 -0.63 0.00 0.00 39.34 37.14 3hdi n TYR 212 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 3hdi s ASN 213 N -0.71 3.84 0.17 2.98 3.84 -1.26 -5.07 114.94 118.73 3hdi s ASN 213 Ca 0.66 -3.01 -0.32 0.00 0.21 0.00 0.00 52.86 50.40 3hdi s ASN 213 Cb -0.45 -1.25 -0.12 0.00 -0.55 0.00 0.00 41.25 38.88 3hdi s ASN 213 CO 0.54 -0.21 1.71 0.00 -2.79 0.00 0.00 177.10 176.34 3hdi n TYR 214 N 3.06 2.59 -4.02 0.43 9.36 -1.26 -4.98 117.16 122.34 3hdi n TYR 214 Ca 0.12 0.07 -0.31 0.00 3.32 0.00 0.00 57.90 61.10 3hdi n TYR 214 Cb 0.35 -2.65 -0.15 0.00 -0.63 0.00 0.00 39.34 36.26 3hdi n TYR 214 CO 0.00 0.00 0.00 -1.14 0.22 0.00 0.00 176.86 175.94 3hdi s GLN 215 N 1.42 2.09 0.22 2.98 0.74 -1.26 -5.12 119.66 120.74 3hdi s GLN 215 Ca 0.78 -1.08 0.09 0.00 0.05 0.00 0.00 55.36 55.20 3hdi s GLN 215 Cb -0.56 -2.66 -0.04 0.00 1.10 0.00 0.00 33.01 30.85 3hdi s GLN 215 CO 0.35 -0.51 -0.03 0.20 -0.55 0.00 0.00 175.29 174.75 3hdi s GLY 216 N 1.27 1.69 0.48 2.59 0.00 -1.26 -5.13 107.32 106.96 3hdi s GLY 216 Ca -0.05 -1.54 -0.12 0.00 0.00 0.00 0.00 44.72 43.02 3hdi s GLY 216 CO -0.07 -1.58 0.88 -1.83 0.00 0.00 0.00 173.10 170.50 3hdi s GLU 217 N -3.26 3.77 -0.18 2.90 -1.05 -1.26 -5.06 118.70 114.55 3hdi s GLU 217 Ca 0.29 0.61 -0.09 0.00 -0.15 0.00 0.00 54.97 55.63 3hdi s GLU 217 Cb -0.08 -2.27 -0.05 0.00 -0.44 0.00 0.00 34.13 31.30 3hdi s GLU 217 CO 0.18 -0.21 0.11 0.15 0.95 0.00 0.00 175.26 176.44 3hdi s LYS 218 N -4.25 4.00 1.03 -4.83 -0.14 -1.26 -5.06 119.74 109.24 3hdi s LYS 218 Ca 0.53 -0.25 -0.12 0.00 -1.36 0.00 0.00 55.97 54.77 3hdi s LYS 218 Cb -0.10 -3.32 0.21 0.00 -1.68 0.00 0.00 37.83 32.94 3hdi s LYS 218 CO 0.37 0.36 1.07 -1.25 -0.76 0.00 0.00 175.35 175.14 3hdi s PRO 219 N 0.15 0.13 -0.02 -1.68 0.04 -1.26 -5.08 135.00 127.29 3hdi s PRO 219 Ca 0.08 0.81 -0.00 0.00 0.04 0.00 0.00 61.00 61.92 3hdi s PRO 219 Cb -0.12 -1.68 0.02 0.00 0.04 0.00 0.00 34.50 32.77 3hdi s PRO 219 CO -0.01 -3.01 0.02 1.41 0.04 0.00 0.00 177.00 175.46 3hdi s MET 220 N -4.73 -0.03 -0.01 4.56 1.75 -1.26 -5.01 119.30 114.57 3hdi s MET 220 Ca 0.66 0.14 -0.30 0.00 -1.25 0.00 0.00 55.69 54.95 3hdi s MET 220 Cb -0.21 -0.19 -0.05 0.00 2.84 0.00 0.00 34.83 37.22 3hdi s MET 220 CO 0.60 -0.13 1.27 0.12 -0.65 0.00 0.00 175.02 176.23 3hdi s PHE 221 N 0.81 3.14 -0.14 4.11 5.36 -1.26 -4.54 117.98 125.46 3hdi s PHE 221 Ca -0.07 1.11 0.02 0.00 -0.96 0.00 0.00 56.93 57.03 3hdi s PHE 221 Cb -0.10 -3.50 0.01 0.00 -0.34 0.00 0.00 43.02 39.09 3hdi s PHE 221 CO -0.02 -1.68 -0.20 -0.51 -1.46 0.00 0.00 175.22 171.35 3hdi s LEU 222 N 2.01 2.01 0.00 6.12 1.43 -0.48 -5.00 118.68 124.76 3hdi s LEU 222 Ca 0.59 -0.57 -0.03 0.00 -1.03 0.00 0.00 54.13 53.09 3hdi s LEU 222 Cb -0.28 -1.36 -0.13 0.00 0.03 0.00 0.00 46.19 44.45 3hdi s LEU 222 CO 0.25 0.05 2.35 -0.81 0.23 0.00 0.00 176.35 178.43 3hdi n PRO 223 N 4.19 1.23 -1.59 1.29 -0.04 -1.26 -4.10 135.00 134.72 3hdi n PRO 223 Ca -0.20 -0.47 -0.29 0.00 -0.04 0.00 0.00 63.50 62.50 3hdi n PRO 223 Cb 0.51 -1.59 0.16 0.00 -0.04 0.00 0.00 33.50 32.54 3hdi n PRO 223 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 3hdi s ASN 224 N 2.15 3.11 -0.03 3.54 0.02 -1.26 -4.56 114.94 117.90 3hdi s ASN 224 Ca 0.31 0.74 -0.03 0.00 -1.02 0.00 0.00 52.86 52.87 3hdi s ASN 224 Cb 0.15 -1.14 0.01 0.00 0.02 0.00 0.00 41.25 40.29 3hdi s ASN 224 CO 0.00 -2.78 0.09 0.00 0.02 0.00 0.00 177.10 174.43 3hdi s ARG 225 N -5.46 0.09 -0.01 -0.60 1.70 -1.26 -0.89 118.95 112.52 3hdi s ARG 225 Ca 0.67 0.15 0.07 0.00 -0.47 0.00 0.00 55.73 56.15 3hdi s ARG 225 Cb -0.11 0.01 -0.02 0.00 -0.57 0.00 0.00 34.95 34.26 3hdi s ARG 225 CO 0.53 -0.04 -0.22 0.42 -1.08 0.00 0.00 175.30 174.91 3hdi s ILE 226 N 0.22 1.77 -0.04 4.99 1.01 0.12 -4.96 121.20 124.31 3hdi s ILE 226 Ca -0.01 -1.00 -0.01 0.00 0.00 0.00 0.00 60.65 59.62 3hdi s ILE 226 Cb -0.02 -1.48 0.03 0.00 0.01 0.00 0.00 42.46 41.00 3hdi s ILE 226 CO -0.01 0.46 0.03 -0.69 0.00 0.00 0.00 174.94 174.73 3hdi s VAL 227 N -0.57 0.08 -0.12 2.92 1.01 -1.26 -0.64 120.40 121.82 3hdi s VAL 227 Ca 0.09 0.26 0.02 0.00 0.00 0.00 0.00 61.98 62.35 3hdi s VAL 227 Cb -0.09 -0.27 -0.01 0.00 0.00 0.00 0.00 36.38 36.02 3hdi s VAL 227 CO -0.00 0.19 -0.17 -0.60 0.00 0.00 0.00 175.10 174.51 3hdi s ARG 228 N 1.80 3.24 -0.15 2.72 3.52 -0.11 -4.97 118.95 125.01 3hdi s ARG 228 Ca 0.01 -0.76 -0.26 0.00 -0.13 0.00 0.00 55.73 54.59 3hdi s ARG 228 Cb -0.12 -2.50 -0.01 0.00 -1.56 0.00 0.00 34.95 30.75 3hdi s ARG 228 CO -0.03 0.21 0.87 0.21 -0.81 0.00 0.00 175.30 175.74 3hdi s LYS 229 N 0.33 4.33 -0.12 5.12 2.20 -1.26 -2.72 119.74 127.62 3hdi s LYS 229 Ca -0.14 1.10 -0.08 0.00 -0.36 0.00 0.00 55.97 56.49 3hdi s LYS 229 Cb -0.17 -3.56 0.04 0.00 -1.51 0.00 0.00 37.83 32.63 3hdi s LYS 229 CO 0.07 -0.32 0.29 0.21 -0.36 0.00 0.00 175.35 175.25 3hdi s LYS 230 N 2.09 0.29 -0.68 4.03 2.20 -0.42 -4.94 119.74 122.30 3hdi s LYS 230 Ca 0.40 0.52 -0.26 0.00 -0.36 0.00 0.00 55.97 56.28 3hdi s LYS 230 Cb -0.17 0.01 -0.09 0.00 -1.51 0.00 0.00 37.83 36.07 3hdi s LYS 230 CO 0.14 -0.11 2.32 -2.00 -0.36 0.00 0.00 175.35 175.33 3hdi s GLU 231 N 0.82 1.95 0.37 4.03 2.12 -1.26 -3.40 118.70 123.34 3hdi s GLU 231 Ca -0.05 0.73 0.04 0.00 0.36 0.00 0.00 54.97 56.05 3hdi s GLU 231 Cb -0.07 -4.71 -0.05 0.00 0.26 0.00 0.00 34.13 29.56 3hdi s GLU 231 CO -0.06 -3.80 0.06 0.95 -0.54 0.00 0.00 175.26 171.88 3hdi s THR 232 N 12.95 1.16 -0.21 -1.70 -4.23 -1.26 -5.03 115.64 117.32 3hdi s THR 232 Ca 0.90 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.45 3hdi s THR 232 Cb -0.14 -2.65 -0.21 0.00 1.34 0.00 0.00 72.50 70.84 3hdi s THR 232 CO 0.14 0.00 0.01 -0.62 -0.54 0.00 0.00 174.62 173.61 3hdi n GLU 233 N -0.84 0.68 -4.17 3.99 -0.58 -1.26 -4.68 120.64 113.78 3hdi n GLU 233 Ca -0.05 0.15 -0.22 0.00 -0.42 0.00 0.00 57.16 56.62 3hdi n GLU 233 Cb 0.66 -1.58 -0.06 0.00 -0.57 0.00 0.00 31.44 29.90 3hdi n GLU 233 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 3hdi s GLN 234 N -2.53 2.61 -0.22 3.49 -0.21 -1.26 -3.54 119.66 118.00 3hdi s GLN 234 Ca -0.26 -1.26 -0.08 0.00 0.02 0.00 0.00 55.36 53.79 3hdi s GLN 234 Cb 0.08 -2.36 -0.04 0.00 1.00 0.00 0.00 33.01 31.69 3hdi s GLN 234 CO 0.69 0.34 0.08 0.00 -2.12 0.00 0.00 175.29 174.29 3hdi s ALA 235 N -2.25 3.33 -0.28 6.09 0.00 0.25 -4.71 121.76 124.19 3hdi s ALA 235 Ca 0.33 -0.94 -0.10 0.00 0.00 0.00 0.00 51.96 51.24 3hdi s ALA 235 Cb -0.07 -2.06 -0.04 0.00 0.00 0.00 0.00 23.12 20.95 3hdi s ALA 235 CO 0.23 -0.18 0.17 -1.01 0.00 0.00 0.00 175.76 174.96 3hdi s HIS 236 N 1.05 3.19 -0.06 0.00 0.09 -0.15 -2.54 115.29 116.87 3hdi s HIS 236 Ca 0.05 -0.04 0.03 0.00 -0.00 0.00 0.00 55.06 55.09 3hdi s HIS 236 Cb -0.14 -2.36 -0.03 0.00 -0.00 0.00 0.00 32.58 30.06 3hdi s HIS 236 CO 0.03 -0.23 -0.13 -1.17 -0.00 0.00 0.00 174.74 173.25 3hdi s LEU 237 N 1.72 2.83 -0.05 0.89 2.96 -0.21 -1.96 118.68 124.87 3hdi s LEU 237 Ca 0.07 -0.16 0.02 0.00 -0.22 0.00 0.00 54.13 53.83 3hdi s LEU 237 Cb -0.16 -1.59 0.02 0.00 0.50 0.00 0.00 46.19 44.96 3hdi s LEU 237 CO 0.09 0.34 -0.07 0.00 -1.32 0.00 0.00 176.35 175.39 3hdi s LEU 239 N 0.76 1.52 0.05 0.00 1.43 -0.48 -1.64 118.68 120.32 3hdi s LEU 239 Ca -0.12 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.59 3hdi s LEU 239 Cb -0.14 -1.05 -0.04 0.00 0.03 0.00 0.00 46.19 44.99 3hdi s LEU 239 CO 0.01 -0.07 0.05 -0.83 0.23 0.00 0.00 176.35 175.75 3hdi s GLY 240 N 1.49 1.98 0.23 -3.19 0.00 -0.56 -0.92 107.32 106.35 3hdi s GLY 240 Ca 0.03 -0.98 0.01 0.00 0.00 0.00 0.00 44.72 43.78 3hdi s GLY 240 CO -0.09 -0.92 0.07 -0.19 0.00 0.00 0.00 173.10 171.98 3hdi s TYR 241 N -1.28 1.43 0.54 1.90 1.51 0.12 -1.40 117.35 120.18 3hdi s TYR 241 Ca 0.25 -1.15 -0.21 0.00 -1.01 0.00 0.00 57.07 54.95 3hdi s TYR 241 Cb -0.12 -0.82 -0.05 0.00 -0.11 0.00 0.00 41.96 40.86 3hdi s TYR 241 CO 0.17 -0.32 1.26 -2.14 -1.11 0.00 0.00 175.55 173.41 3hdi s PRO 242 N -4.01 3.25 0.00 -1.71 0.02 -1.26 -0.43 135.00 130.86 3hdi s PRO 242 Ca 0.34 1.98 0.00 0.00 0.02 0.00 0.00 61.00 63.35 3hdi s PRO 242 Cb 0.07 -2.19 0.00 0.00 0.02 0.00 0.00 34.50 32.40 3hdi s PRO 242 CO 0.11 -1.03 0.00 0.41 -0.33 0.00 0.00 177.00 176.16 3hdi n GLY 243 N 0.59 4.89 3.15 0.52 0.00 0.14 -3.79 105.19 110.68 3hdi n GLY 243 Ca 0.11 -1.32 -0.10 0.00 0.00 0.00 0.00 46.02 44.70 3hdi n GLY 243 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hdi s LEU 244 N 0.00 1.55 0.69 0.99 1.43 -1.26 -4.74 118.68 117.34 3hdi s LEU 244 Ca 0.00 -0.44 -0.15 0.00 -1.03 0.00 0.00 54.13 52.52 3hdi s LEU 244 Cb 0.00 0.81 0.02 0.00 0.03 0.00 0.00 46.19 47.05 3hdi s LEU 244 CO 0.00 -0.54 1.13 -2.84 0.23 0.00 0.00 176.35 174.34 3hdi s PRO 245 N -2.59 2.56 0.24 1.29 0.02 -1.24 -4.12 135.00 131.17 3hdi s PRO 245 Ca -0.05 1.47 -0.15 0.00 0.02 0.00 0.00 61.00 62.29 3hdi s PRO 245 Cb -0.01 -1.91 0.29 0.00 0.02 0.00 0.00 34.50 32.88 3hdi s PRO 245 CO -0.04 -1.45 1.56 -0.84 -0.33 0.00 0.00 177.00 175.90 3hdi h ILE 246 N -0.16 0.03 -0.79 2.83 -0.00 -0.43 -1.67 117.51 117.32 3hdi h ILE 246 Ca -0.47 0.00 -0.49 0.00 -0.00 0.00 0.00 64.86 63.90 3hdi h ILE 246 Cb 1.26 0.03 -0.27 0.00 -0.00 0.00 0.00 36.82 37.84 3hdi h ILE 246 CO 0.52 0.00 0.29 0.61 -0.00 0.00 0.00 178.15 179.58 3hdi n GLY 247 N -1.51 5.39 3.75 0.16 0.00 -1.26 -4.92 105.19 106.80 3hdi n GLY 247 Ca 0.11 -1.80 -0.32 0.00 0.00 0.00 0.00 46.02 44.01 3hdi n GLY 247 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hdi s ASP 248 N -2.19 4.39 0.21 1.61 -1.08 -0.63 -4.94 116.67 114.03 3hdi s ASP 248 Ca 0.56 1.95 -0.11 0.00 -0.52 0.00 0.00 52.55 54.43 3hdi s ASP 248 Cb 0.46 -2.54 0.27 0.00 -1.46 0.00 0.00 42.92 39.65 3hdi s ASP 248 CO 0.03 -2.12 1.69 0.50 0.52 0.00 0.00 175.17 175.80 3hdi h LYS 249 N -0.93 0.20 -0.85 4.34 3.64 -1.95 -3.05 116.57 117.97 3hdi h LYS 249 Ca -0.44 -0.01 -0.56 0.00 -1.27 0.00 0.00 60.65 58.36 3hdi h LYS 249 Cb 1.24 -0.05 -0.30 0.00 -0.41 0.00 0.00 32.23 32.71 3hdi h LYS 249 CO 0.50 0.13 0.30 -0.25 -2.27 0.00 0.00 179.45 177.87 3hdi n ASP 250 N -5.17 5.85 -0.09 4.20 10.43 -1.26 -4.73 116.55 125.78 3hdi n ASP 250 Ca 0.08 -3.76 -0.07 0.00 2.57 0.00 0.00 54.79 53.61 3hdi n ASP 250 Cb 0.32 -0.76 0.00 0.00 1.84 0.00 0.00 41.12 42.52 3hdi n ASP 250 CO 0.00 0.00 0.00 -0.37 -1.07 0.00 0.00 177.20 175.76 3hdi h VAL 251 N 1.29 0.87 -0.02 2.53 -1.51 -1.87 -1.63 116.25 115.91 3hdi h VAL 251 Ca 0.50 -0.07 -0.02 0.00 -1.23 0.00 0.00 66.70 65.89 3hdi h VAL 251 Cb 1.36 0.65 -0.00 0.00 -2.13 0.00 0.00 31.29 31.17 3hdi h VAL 251 CO 1.17 0.04 -0.07 1.88 -1.23 0.00 0.00 177.57 179.36 3hdi h TYR 252 N 0.20 0.03 -0.06 5.19 0.05 -1.88 0.14 116.97 120.65 3hdi h TYR 252 Ca 0.14 -0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.81 3hdi h TYR 252 Cb 0.14 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 37.86 3hdi h TYR 252 CO -0.16 0.11 -0.49 0.00 -1.05 0.00 0.00 178.16 176.57 3hdi h ALA 253 N 1.90 1.08 -0.19 3.88 0.00 -1.70 -0.43 119.26 123.79 3hdi h ALA 253 Ca 0.01 -0.46 -0.20 0.00 0.00 0.00 0.00 54.91 54.27 3hdi h ALA 253 Cb 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3hdi h ALA 253 CO 0.01 0.63 -0.66 1.25 0.00 0.00 0.00 179.25 180.48 3hdi h LEU 254 N 0.12 0.83 -0.21 0.00 5.85 0.05 0.55 115.31 122.50 3hdi h LEU 254 Ca 0.00 -0.49 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 3hdi h LEU 254 Cb 0.90 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.68 3hdi h LEU 254 CO 0.07 1.27 0.11 0.58 -0.34 0.00 0.00 178.44 180.13 3hdi h VAL 255 N 0.52 1.12 -0.52 1.05 2.07 -0.57 0.09 116.25 120.02 3hdi h VAL 255 Ca -0.02 -0.33 -0.06 0.00 0.82 0.00 0.00 66.70 67.11 3hdi h VAL 255 Cb 1.26 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.97 3hdi h VAL 255 CO 0.13 0.12 0.06 -0.07 0.02 0.00 0.00 177.57 177.83 3hdi h LEU 256 N 0.22 0.78 -0.10 2.57 3.38 -1.01 -1.75 115.31 119.40 3hdi h LEU 256 Ca 0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3hdi h LEU 256 Cb 0.09 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 3hdi h LEU 256 CO -0.01 0.81 0.03 0.25 0.09 0.00 0.00 178.44 179.61 3hdi h LEU 257 N 0.78 0.14 -1.55 1.67 5.85 -0.54 -1.97 115.31 119.70 3hdi h LEU 257 Ca 0.16 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.72 3hdi h LEU 257 Cb 0.38 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 3hdi h LEU 257 CO 0.01 0.31 0.35 -1.13 -0.34 0.00 0.00 178.44 177.64 3hdi h ASN 258 N -0.03 0.49 -0.63 1.25 -1.24 -0.81 0.12 115.58 114.74 3hdi h ASN 258 Ca 0.03 -0.00 -0.02 0.00 0.71 0.00 0.00 56.30 57.01 3hdi h ASN 258 Cb 0.21 -0.11 -0.03 0.00 0.73 0.00 0.00 38.32 39.12 3hdi h ASN 258 CO -0.00 0.34 0.30 -1.13 -1.29 0.00 0.00 177.43 175.65 3hdi h ASN 259 N 0.57 0.83 0.92 1.15 -1.24 -0.88 0.55 115.58 117.48 3hdi h ASN 259 Ca 0.22 -0.13 -0.20 0.00 0.71 0.00 0.00 56.30 56.89 3hdi h ASN 259 Cb 0.16 -0.21 -0.03 0.00 0.73 0.00 0.00 38.32 38.97 3hdi h ASN 259 CO -0.06 0.73 -0.96 0.58 -1.29 0.00 0.00 177.43 176.44 3hdi h VAL 260 N 0.87 1.66 0.00 2.57 2.07 -0.54 -3.20 116.25 119.69 3hdi h VAL 260 Ca 0.22 -3.21 0.00 0.00 0.82 0.00 0.00 66.70 64.52 3hdi h VAL 260 Cb 0.13 2.75 0.00 0.00 -1.52 0.00 0.00 31.29 32.65 3hdi h VAL 260 CO -0.03 0.92 0.00 -0.11 0.02 0.00 0.00 177.57 178.37 3hdi n LEU 261 N -3.43 0.06 -0.49 2.57 7.94 0.33 0.32 117.00 124.30 3hdi n LEU 261 Ca -0.01 0.83 0.00 0.00 -1.11 0.00 0.00 56.01 55.72 3hdi n LEU 261 Cb 0.90 -0.46 0.00 0.00 0.53 0.00 0.00 43.42 44.39 3hdi n LEU 261 CO 0.47 -0.46 0.25 0.61 -1.11 0.00 0.00 177.39 177.14 3hdi n GLY 262 N -0.18 0.80 0.01 -3.96 0.00 -0.81 0.28 105.19 101.34 3hdi n GLY 262 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.18 3hdi n GLY 262 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hdi n GLY 263 N 0.00 -0.98 3.83 -0.02 0.00 0.19 -1.89 105.19 106.31 3hdi n GLY 263 Ca 0.00 -0.20 -0.07 0.00 0.00 0.00 0.00 46.02 45.75 3hdi n GLY 263 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hdi s SER 264 N -2.00 -0.15 0.23 1.61 1.04 -1.24 -4.84 113.70 108.34 3hdi s SER 264 Ca 0.48 -0.75 -0.07 0.00 0.48 0.00 0.00 55.95 56.09 3hdi s SER 264 Cb 0.22 0.72 0.40 0.00 0.10 0.00 0.00 66.02 67.47 3hdi s SER 264 CO 0.37 -1.38 1.70 0.24 0.98 0.00 0.00 173.24 175.15 3hdi h MET 265 N 2.00 0.28 -0.59 4.02 2.86 -1.92 -1.00 114.93 120.58 3hdi h MET 265 Ca -0.24 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.38 3hdi h MET 265 Cb 1.25 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.84 3hdi h MET 265 CO 0.29 0.18 0.00 -1.13 1.06 0.00 0.00 176.91 177.32 3hdi n SER 266 N -5.13 2.30 -4.81 1.22 3.41 -1.26 -4.20 113.62 105.15 3hdi n SER 266 Ca 0.12 -2.20 -0.33 0.00 -0.26 0.00 0.00 58.87 56.20 3hdi n SER 266 Cb 0.40 -0.41 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 3hdi n SER 266 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3hdi s SER 267 N -0.62 5.88 0.21 4.04 1.04 -0.38 -4.82 113.70 119.05 3hdi s SER 267 Ca 0.21 1.78 -0.11 0.00 0.48 0.00 0.00 55.95 58.31 3hdi s SER 267 Cb 0.14 -2.53 0.28 0.00 0.10 0.00 0.00 66.02 64.01 3hdi s SER 267 CO 0.09 -1.10 1.67 0.03 0.98 0.00 0.00 173.24 174.92 3hdi h ARG 268 N 0.47 0.13 -0.01 4.02 2.47 0.13 0.29 114.38 121.88 3hdi h ARG 268 Ca -0.47 -0.01 -0.00 0.00 -1.26 0.00 0.00 59.98 58.24 3hdi h ARG 268 Cb 1.22 -0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 29.51 3hdi h ARG 268 CO 0.58 0.08 0.00 -0.07 0.56 0.00 0.00 179.97 181.13 3hdi h LEU 269 N 0.13 0.01 -0.72 3.04 -0.00 -0.38 0.27 115.31 117.67 3hdi h LEU 269 Ca 0.31 -0.09 -0.01 0.00 -0.00 0.00 0.00 57.88 58.09 3hdi h LEU 269 Cb 0.49 -0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.12 3hdi h LEU 269 CO -0.50 0.10 0.41 0.15 -0.00 0.00 0.00 178.44 178.61 3hdi h PHE 270 N -0.08 0.98 -0.27 1.13 3.04 -1.62 0.61 116.94 120.72 3hdi h PHE 270 Ca 0.00 -0.02 -0.18 0.00 3.98 0.00 0.00 57.97 61.76 3hdi h PHE 270 Cb 0.09 -0.32 -0.00 0.00 2.56 0.00 0.00 35.95 38.29 3hdi h PHE 270 CO -0.05 0.68 -0.54 1.96 -2.02 0.00 0.00 178.31 178.34 3hdi h GLN 271 N 0.99 0.81 0.03 1.11 1.08 -0.86 0.07 115.11 118.34 3hdi h GLN 271 Ca 0.26 -0.51 -0.05 0.00 -1.45 0.00 0.00 58.65 56.90 3hdi h GLN 271 Cb 0.01 0.06 0.01 0.00 -0.05 0.00 0.00 27.48 27.50 3hdi h GLN 271 CO -0.04 1.14 -0.20 -0.44 -0.95 0.00 0.00 178.83 178.33 3hdi h ASP 272 N 0.62 0.13 0.13 1.46 3.32 -0.77 -0.33 116.42 120.97 3hdi h ASP 272 Ca 0.01 -0.93 -0.22 0.00 0.02 0.00 0.00 57.03 55.92 3hdi h ASP 272 Cb 1.14 -0.04 0.02 0.00 0.22 0.00 0.00 39.33 40.67 3hdi h ASP 272 CO 0.12 1.05 -0.93 0.40 -1.72 0.00 0.00 179.24 178.16 3hdi h ILE 273 N -0.77 1.43 0.00 0.35 1.08 -1.03 -3.10 117.51 115.48 3hdi h ILE 273 Ca -0.03 -2.46 -0.13 0.00 -0.39 0.00 0.00 64.86 61.85 3hdi h ILE 273 Cb 1.10 3.00 -0.02 0.00 -3.07 0.00 0.00 36.82 37.83 3hdi h ILE 273 CO 0.04 0.71 -1.29 -1.14 -0.69 0.00 0.00 178.15 175.78 3hdi n ARG 274 N -4.04 0.53 -0.18 2.37 0.63 -1.04 -0.83 116.66 114.10 3hdi n ARG 274 Ca -0.14 0.31 -0.03 0.00 -0.92 0.00 0.00 57.85 57.08 3hdi n ARG 274 Cb 0.86 -1.52 0.07 0.00 0.45 0.00 0.00 32.46 32.32 3hdi n ARG 274 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 3hdi h GLU 275 N -1.00 0.48 0.07 -0.14 4.57 -0.99 0.14 114.58 117.71 3hdi h GLU 275 Ca -0.19 -0.03 -0.37 0.00 -1.18 0.00 0.00 59.36 57.59 3hdi h GLU 275 Cb 1.08 -0.11 -0.04 0.00 -0.16 0.00 0.00 28.75 29.52 3hdi h GLU 275 CO -0.12 0.32 -2.16 1.63 -1.18 0.00 0.00 179.01 177.50 3hdi n LYS 276 N -4.90 0.70 -0.06 1.92 5.02 -0.14 -4.62 118.16 116.08 3hdi n LYS 276 Ca 0.06 0.23 -0.10 0.00 -2.02 0.00 0.00 58.31 56.48 3hdi n LYS 276 Cb 0.17 -1.63 -0.15 0.00 -0.02 0.00 0.00 35.03 33.40 3hdi n LYS 276 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3hdi n ARG 277 N -3.47 0.67 -2.52 1.97 1.74 -1.17 -4.99 116.66 108.89 3hdi n ARG 277 Ca -0.38 0.15 -0.11 0.00 -0.77 0.00 0.00 57.85 56.74 3hdi n ARG 277 Cb 1.00 -1.65 0.01 0.00 -1.02 0.00 0.00 32.46 30.81 3hdi n ARG 277 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hdi n GLY 278 N 1.71 0.03 0.17 -0.13 0.00 0.50 -4.93 105.19 102.55 3hdi n GLY 278 Ca -0.27 -0.35 -0.16 0.00 0.00 0.00 0.00 46.02 45.24 3hdi n GLY 278 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hdi h LEU 279 N -0.52 0.70 -8.63 0.99 3.38 -1.19 -3.47 115.31 106.58 3hdi h LEU 279 Ca -0.27 -0.56 -0.39 0.00 0.09 0.00 0.00 57.88 56.75 3hdi h LEU 279 Cb 1.19 -0.22 -0.17 0.00 0.09 0.00 0.00 40.66 41.55 3hdi h LEU 279 CO 0.29 1.36 -0.74 0.00 0.09 0.00 0.00 178.44 179.44 3hdi n TYR 281 N 0.28 0.91 -4.52 0.00 4.19 -1.26 -4.52 117.16 112.24 3hdi n TYR 281 Ca -0.14 0.25 -0.33 0.00 3.31 0.00 0.00 57.90 61.00 3hdi n TYR 281 Cb 0.58 -1.14 -0.16 0.00 0.49 0.00 0.00 39.34 39.11 3hdi n TYR 281 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 3hdi s SER 282 N -6.46 3.38 -0.25 2.98 0.15 -1.26 -5.07 113.70 107.17 3hdi s SER 282 Ca -0.15 -0.55 -0.08 0.00 0.70 0.00 0.00 55.95 55.87 3hdi s SER 282 Cb 0.07 -1.51 0.12 0.00 -1.71 0.00 0.00 66.02 62.99 3hdi s SER 282 CO 0.78 0.07 0.53 -0.69 1.20 0.00 0.00 173.24 175.13 3hdi s VAL 283 N 0.90 -0.82 0.36 4.45 1.01 -1.26 -2.43 120.40 122.61 3hdi s VAL 283 Ca -0.04 0.07 -0.17 0.00 0.00 0.00 0.00 61.98 61.84 3hdi s VAL 283 Cb -0.15 -0.84 0.05 0.00 0.00 0.00 0.00 36.38 35.44 3hdi s VAL 283 CO -0.03 0.03 0.79 0.72 0.00 0.00 0.00 175.10 176.61 3hdi s PHE 284 N 2.75 0.07 0.06 5.22 -0.12 -0.73 -4.62 117.98 120.61 3hdi s PHE 284 Ca -0.02 -0.71 -0.07 0.00 -0.05 0.00 0.00 56.93 56.08 3hdi s PHE 284 Cb -0.12 0.82 -0.01 0.00 -0.63 0.00 0.00 43.02 43.08 3hdi s PHE 284 CO -0.16 -1.50 0.13 -1.54 -0.05 0.00 0.00 175.22 172.10 3hdi s SER 285 N -3.06 0.18 0.00 1.98 1.04 -0.79 -0.43 113.70 112.61 3hdi s SER 285 Ca 0.15 -0.62 -0.27 0.00 0.48 0.00 0.00 55.95 55.69 3hdi s SER 285 Cb -0.05 0.28 0.06 0.00 0.10 0.00 0.00 66.02 66.41 3hdi s SER 285 CO 0.11 -0.62 0.61 -0.72 0.98 0.00 0.00 173.24 173.59 3hdi s TYR 286 N -3.31 -0.56 -0.06 5.02 -0.85 0.01 -4.26 117.35 113.35 3hdi s TYR 286 Ca 0.01 0.82 -0.04 0.00 -0.52 0.00 0.00 57.07 57.34 3hdi s TYR 286 Cb 0.03 0.39 -0.04 0.00 0.38 0.00 0.00 41.96 42.72 3hdi s TYR 286 CO -0.08 -0.64 0.12 -3.38 -1.52 0.00 0.00 175.55 170.06 3hdi s HIS 287 N -1.82 3.46 -0.20 -3.49 -3.43 -1.26 -0.34 115.29 108.20 3hdi s HIS 287 Ca -0.08 0.37 0.01 0.00 -0.80 0.00 0.00 55.06 54.55 3hdi s HIS 287 Cb -0.01 -1.84 0.04 0.00 -1.43 0.00 0.00 32.58 29.34 3hdi s HIS 287 CO 0.04 0.64 -0.10 -1.12 -2.00 0.00 0.00 174.74 172.20 3hdi s SER 288 N -1.44 3.40 -0.10 7.38 0.01 0.96 -4.98 113.70 118.92 3hdi s SER 288 Ca 0.20 -0.89 0.04 0.00 1.31 0.00 0.00 55.95 56.61 3hdi s SER 288 Cb -0.12 -1.22 0.00 0.00 0.21 0.00 0.00 66.02 64.89 3hdi s SER 288 CO 0.10 -0.15 -0.23 -0.44 0.41 0.00 0.00 173.24 172.93 3hdi s SER 289 N 1.40 3.12 0.49 2.44 0.01 -1.26 0.63 113.70 120.54 3hdi s SER 289 Ca -0.01 -0.56 0.05 0.00 1.31 0.00 0.00 55.95 56.74 3hdi s SER 289 Cb -0.16 -1.42 -0.00 0.00 0.21 0.00 0.00 66.02 64.65 3hdi s SER 289 CO -0.08 0.15 0.25 -0.36 0.41 0.00 0.00 173.24 173.61 3hdi s PHE 290 N 0.39 2.00 -0.66 2.43 0.40 -0.19 -4.52 117.98 117.83 3hdi s PHE 290 Ca -0.18 -0.78 0.16 0.00 -0.60 0.00 0.00 56.93 55.53 3hdi s PHE 290 Cb -0.18 -1.87 0.73 0.00 0.51 0.00 0.00 43.02 42.21 3hdi s PHE 290 CO 0.08 -0.12 1.49 -2.13 0.70 0.00 0.00 175.22 175.25 3hdi n ARG 291 N -1.49 0.09 0.00 0.44 0.63 -1.26 0.21 116.66 115.28 3hdi n ARG 291 Ca -0.05 0.44 0.00 0.00 -0.92 0.00 0.00 57.85 57.32 3hdi n ARG 291 Cb 0.65 -1.72 0.00 0.00 0.45 0.00 0.00 32.46 31.84 3hdi n ARG 291 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 3hdi n ASP 292 N -1.90 0.22 -2.16 6.15 3.85 -1.26 -4.62 116.55 116.83 3hdi n ASP 292 Ca 0.01 -0.03 -0.09 0.00 -0.71 0.00 0.00 54.79 53.97 3hdi n ASP 292 Cb 0.13 0.11 -0.03 0.00 -1.35 0.00 0.00 41.12 39.98 3hdi n ASP 292 CO 0.00 0.00 0.00 -0.24 -1.01 0.00 0.00 177.20 175.95 3hdi n SER 293 N -0.13 0.56 0.00 -1.12 2.88 -1.24 -4.74 113.62 109.83 3hdi n SER 293 Ca 0.00 -1.81 0.00 0.00 -1.33 0.00 0.00 58.87 55.73 3hdi n SER 293 Cb 0.00 0.47 0.00 0.00 -0.75 0.00 0.00 64.21 63.93 3hdi n SER 293 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3hdi n GLY 294 N 0.64 1.49 3.15 0.46 0.00 -1.26 -1.02 105.19 108.65 3hdi n GLY 294 Ca -0.00 -0.54 -0.11 0.00 0.00 0.00 0.00 46.02 45.37 3hdi n GLY 294 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3hdi s MET 295 N -2.00 0.60 -0.22 1.61 0.23 0.21 0.23 119.30 119.96 3hdi s MET 295 Ca 0.00 -0.49 -0.07 0.00 -1.03 0.00 0.00 55.69 54.10 3hdi s MET 295 Cb 0.00 0.25 -0.03 0.00 -1.53 0.00 0.00 34.83 33.52 3hdi s MET 295 CO 0.00 -0.16 0.04 -1.17 -2.03 0.00 0.00 175.02 171.70 3hdi s LEU 296 N -1.71 3.43 -0.06 0.18 2.96 0.43 -0.03 118.68 123.89 3hdi s LEU 296 Ca -0.10 -0.16 0.04 0.00 -0.22 0.00 0.00 54.13 53.69 3hdi s LEU 296 Cb -0.04 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.73 3hdi s LEU 296 CO -0.01 0.03 -0.18 -0.89 -1.32 0.00 0.00 176.35 173.98 3hdi s THR 297 N 1.21 2.66 0.01 3.68 2.01 0.53 0.16 115.64 125.90 3hdi s THR 297 Ca 0.04 -0.85 0.06 0.00 0.31 0.00 0.00 61.69 61.24 3hdi s THR 297 Cb -0.14 -2.02 -0.03 0.00 0.01 0.00 0.00 72.50 70.31 3hdi s THR 297 CO 0.03 0.57 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.73 3hdi s ILE 298 N -0.39 2.85 0.02 1.82 1.01 -0.10 -0.81 121.20 125.61 3hdi s ILE 298 Ca 0.04 -1.02 0.03 0.00 0.00 0.00 0.00 60.65 59.69 3hdi s ILE 298 Cb -0.12 -2.16 -0.01 0.00 0.01 0.00 0.00 42.46 40.17 3hdi s ILE 298 CO 0.02 0.44 -0.09 -0.47 0.00 0.00 0.00 174.94 174.83 3hdi s TYR 299 N -0.84 0.79 -0.27 3.97 5.04 0.43 -1.38 117.35 125.08 3hdi s TYR 299 Ca 0.13 -0.29 -0.19 0.00 -2.44 0.00 0.00 57.07 54.28 3hdi s TYR 299 Cb -0.11 -0.49 0.07 0.00 0.35 0.00 0.00 41.96 41.79 3hdi s TYR 299 CO 0.03 -0.02 0.68 0.00 -1.34 0.00 0.00 175.55 174.91 3hdi s ALA 300 N -0.69 -1.78 -0.13 3.97 0.00 -0.57 -1.78 121.76 120.78 3hdi s ALA 300 Ca -0.01 2.18 0.01 0.00 0.00 0.00 0.00 51.96 54.14 3hdi s ALA 300 Cb -0.06 -1.28 -0.01 0.00 0.00 0.00 0.00 23.12 21.77 3hdi s ALA 300 CO 0.00 -0.35 -0.15 0.20 0.00 0.00 0.00 175.76 175.46 3hdi s GLY 301 N 1.05 1.49 0.17 0.00 0.00 -1.02 -1.04 107.32 107.97 3hdi s GLY 301 Ca -0.05 -0.94 -0.10 0.00 0.00 0.00 0.00 44.72 43.63 3hdi s GLY 301 CO -0.10 -0.17 0.31 -1.08 0.00 0.00 0.00 173.10 172.06 3hdi s THR 302 N 0.45 0.06 0.66 0.90 -1.32 -1.05 -4.15 115.64 111.18 3hdi s THR 302 Ca -0.11 -1.36 -0.17 0.00 -1.21 0.00 0.00 61.69 58.84 3hdi s THR 302 Cb -0.16 -1.85 0.00 0.00 -1.51 0.00 0.00 72.50 68.97 3hdi s THR 302 CO 0.05 -0.26 1.22 -0.83 -2.21 0.00 0.00 174.62 172.59 3hdi s GLY 303 N -2.97 2.57 0.52 6.08 0.00 -1.26 0.85 107.32 113.11 3hdi s GLY 303 Ca 0.17 0.97 0.34 0.00 0.00 0.00 0.00 44.72 46.20 3hdi s GLY 303 CO 0.01 1.37 1.78 0.45 0.00 0.00 0.00 173.10 176.70 3hdi h HIS 304 N 0.30 0.13 0.29 1.90 -0.00 -1.87 -2.58 115.15 113.33 3hdi h HIS 304 Ca -0.49 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 59.87 3hdi h HIS 304 Cb 1.30 -0.04 0.00 0.00 -0.00 0.00 0.00 27.41 28.68 3hdi h HIS 304 CO 0.46 0.00 -0.14 -0.44 -0.00 0.00 0.00 177.93 177.81 3hdi h ASP 305 N 0.07 -0.33 0.00 2.45 3.45 -1.92 -3.29 116.42 116.84 3hdi h ASP 305 Ca 0.60 -0.11 0.00 0.00 0.43 0.00 0.00 57.03 57.95 3hdi h ASP 305 Cb 2.24 0.09 0.00 0.00 -0.56 0.00 0.00 39.33 41.09 3hdi h ASP 305 CO -0.07 0.14 0.00 0.00 -1.57 0.00 0.00 179.24 177.74 3hdi n GLN 306 N -5.04 0.26 -0.01 3.56 6.02 -0.97 -3.46 117.38 117.74 3hdi n GLN 306 Ca -0.07 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 56.88 3hdi n GLN 306 Cb 0.22 -1.07 0.17 0.00 1.02 0.00 0.00 30.24 30.58 3hdi n GLN 306 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 3hdi h LEU 307 N 0.40 0.56 0.12 1.08 5.85 -1.63 1.16 115.31 122.85 3hdi h LEU 307 Ca 0.00 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.52 3hdi h LEU 307 Cb 0.07 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.95 3hdi h LEU 307 CO 0.00 0.79 -0.06 0.44 -0.34 0.00 0.00 178.44 179.27 3hdi h ASP 308 N 0.49 -0.14 -0.50 1.25 3.45 -1.86 -1.80 116.42 117.32 3hdi h ASP 308 Ca 0.07 -0.39 0.05 0.00 0.43 0.00 0.00 57.03 57.19 3hdi h ASP 308 Cb 0.67 0.04 -0.05 0.00 -0.56 0.00 0.00 39.33 39.43 3hdi h ASP 308 CO 0.05 0.36 0.24 -0.78 -1.57 0.00 0.00 179.24 177.53 3hdi h ASP 309 N -0.68 0.32 -0.60 6.45 1.82 -1.76 -2.16 116.42 119.81 3hdi h ASP 309 Ca -0.02 0.03 0.01 0.00 -0.39 0.00 0.00 57.03 56.67 3hdi h ASP 309 Cb 0.52 -0.02 -0.03 0.00 0.68 0.00 0.00 39.33 40.47 3hdi h ASP 309 CO 0.03 0.23 0.38 0.25 -1.61 0.00 0.00 179.24 178.52 3hdi h LEU 310 N 0.46 0.65 0.15 2.28 5.85 0.14 -2.24 115.31 122.60 3hdi h LEU 310 Ca 0.22 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.93 3hdi h LEU 310 Cb 0.15 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.03 3hdi h LEU 310 CO -0.17 0.47 -0.07 0.58 -0.34 0.00 0.00 178.44 178.90 3hdi h VAL 311 N 0.78 0.85 -0.97 1.05 2.07 -0.84 -0.67 116.25 118.51 3hdi h VAL 311 Ca 0.23 -0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.82 3hdi h VAL 311 Cb -0.05 0.85 -0.07 0.00 -1.52 0.00 0.00 31.29 30.50 3hdi h VAL 311 CO -0.07 0.00 0.63 1.88 0.02 0.00 0.00 177.57 180.03 3hdi h TYR 312 N -0.20 1.14 -0.20 1.57 0.05 -1.32 0.11 116.97 118.12 3hdi h TYR 312 Ca -0.02 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.77 3hdi h TYR 312 Cb 0.15 -0.37 -0.01 0.00 1.01 0.00 0.00 36.73 37.51 3hdi h TYR 312 CO -0.07 0.57 0.05 0.77 -1.05 0.00 0.00 178.16 178.43 3hdi h SER 313 N 1.10 0.30 -0.48 3.88 0.02 -0.99 -0.26 113.55 117.13 3hdi h SER 313 Ca 0.43 -0.23 -0.05 0.00 -0.84 0.00 0.00 61.79 61.10 3hdi h SER 313 Cb 0.23 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 3hdi h SER 313 CO -0.18 0.46 0.14 0.40 -1.14 0.00 0.00 176.83 176.51 3hdi h ILE 314 N 0.14 1.22 -0.15 3.27 2.04 -0.85 -2.69 117.51 120.49 3hdi h ILE 314 Ca 0.06 -0.79 0.03 0.00 1.00 0.00 0.00 64.86 65.16 3hdi h ILE 314 Cb 0.28 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 3hdi h ILE 314 CO 0.00 0.29 -0.01 1.56 0.00 0.00 0.00 178.15 179.99 3hdi h GLN 315 N 0.79 0.03 0.44 2.37 1.08 -0.56 -2.05 115.11 117.22 3hdi h GLN 315 Ca 0.18 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.37 3hdi h GLN 315 Cb 0.27 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.67 3hdi h GLN 315 CO -0.00 0.02 -0.44 0.93 -0.95 0.00 0.00 178.83 178.39 3hdi h GLU 316 N 0.04 -0.86 -0.21 1.46 5.08 -0.74 -0.02 114.58 119.33 3hdi h GLU 316 Ca 0.07 0.06 0.05 0.00 -1.00 0.00 0.00 59.36 58.54 3hdi h GLU 316 Cb 0.09 0.20 -0.07 0.00 0.50 0.00 0.00 28.75 29.46 3hdi h GLU 316 CO -0.13 -0.57 -0.43 1.15 -1.00 0.00 0.00 179.01 178.03 3hdi h THR 317 N -0.89 0.13 -0.29 1.13 2.02 -1.38 0.37 112.91 113.99 3hdi h THR 317 Ca -0.04 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 3hdi h THR 317 Cb 0.79 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 3hdi h THR 317 CO -0.06 0.00 0.01 0.71 0.37 0.00 0.00 175.52 176.55 3hdi h THR 318 N -0.45 1.17 0.41 3.16 1.35 -1.37 0.64 112.91 117.82 3hdi h THR 318 Ca 0.09 -0.65 -0.02 0.00 -0.55 0.00 0.00 66.41 65.28 3hdi h THR 318 Cb 0.62 0.94 0.00 0.00 -1.73 0.00 0.00 68.15 67.98 3hdi h THR 318 CO -0.45 0.22 -0.20 -1.28 -0.25 0.00 0.00 175.52 173.57 3hdi h SER 319 N 0.42 -0.47 -0.57 5.36 0.87 0.26 -1.64 113.55 117.78 3hdi h SER 319 Ca 0.09 -0.08 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 3hdi h SER 319 Cb 0.26 0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 62.31 3hdi h SER 319 CO 0.01 -0.19 0.27 0.00 -0.53 0.00 0.00 176.83 176.38 3hdi h ALA 320 N -0.23 1.35 0.13 6.23 0.00 0.00 -1.67 119.26 125.07 3hdi h ALA 320 Ca -0.06 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 3hdi h ALA 320 Cb 0.52 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3hdi h ALA 320 CO 0.09 0.50 -0.06 1.25 0.00 0.00 0.00 179.25 181.03 3hdi h LEU 321 N 0.85 -0.15 -0.25 0.00 5.85 -0.83 0.07 115.31 120.86 3hdi h LEU 321 Ca 0.21 -0.18 0.06 0.00 0.84 0.00 0.00 57.88 58.80 3hdi h LEU 321 Cb 0.12 0.04 -0.06 0.00 0.37 0.00 0.00 40.66 41.13 3hdi h LEU 321 CO -0.02 0.10 -0.11 0.00 -0.34 0.00 0.00 178.44 178.07 3hdi h ALA 322 N 0.44 0.10 0.06 1.25 0.00 -1.04 0.37 119.26 120.44 3hdi h ALA 322 Ca -0.02 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3hdi h ALA 322 Cb 0.32 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.38 3hdi h ALA 322 CO 0.03 -0.52 -0.03 0.93 0.00 0.00 0.00 179.25 179.66 3hdi h GLU 323 N -0.07 -0.08 0.00 0.00 5.08 -1.30 -3.27 114.58 114.94 3hdi h GLU 323 Ca 0.13 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3hdi h GLU 323 Cb 0.27 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.54 3hdi h GLU 323 CO -0.30 0.44 -0.58 1.63 -1.00 0.00 0.00 179.01 179.20 3hdi n LYS 324 N -4.86 0.06 0.00 2.33 5.02 0.01 -5.04 118.16 115.67 3hdi n LYS 324 Ca -0.09 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 3hdi n LYS 324 Cb 0.28 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.76 3hdi n LYS 324 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hdi n GLY 325 N 1.47 -0.67 3.34 0.72 0.00 0.13 -4.91 105.19 105.27 3hdi n GLY 325 Ca 0.05 -1.14 -0.22 0.00 0.00 0.00 0.00 46.02 44.71 3hdi n GLY 325 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3hdi s LEU 326 N 0.00 2.43 0.61 0.99 2.34 -1.26 -4.71 118.68 119.08 3hdi s LEU 326 Ca 0.00 -0.85 -0.10 0.00 0.06 0.00 0.00 54.13 53.24 3hdi s LEU 326 Cb 0.00 -0.86 -0.03 0.00 -0.56 0.00 0.00 46.19 44.74 3hdi s LEU 326 CO 0.00 -0.01 1.00 0.42 -1.06 0.00 0.00 176.35 176.69 3hdi s THR 327 N -1.95 4.53 0.41 5.48 -4.23 -1.26 -4.90 115.64 113.72 3hdi s THR 327 Ca 0.15 0.70 0.10 0.00 -1.18 0.00 0.00 61.69 61.46 3hdi s THR 327 Cb -0.06 -3.80 0.20 0.00 1.34 0.00 0.00 72.50 70.18 3hdi s THR 327 CO 0.07 -1.01 1.99 -0.33 -0.54 0.00 0.00 174.62 174.80 3hdi h GLU 328 N -0.28 0.27 -0.45 3.99 4.39 -1.98 -0.38 114.58 120.13 3hdi h GLU 328 Ca -0.45 -0.04 -0.05 0.00 0.34 0.00 0.00 59.36 59.16 3hdi h GLU 328 Cb 1.20 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.79 3hdi h GLU 328 CO 0.62 0.31 0.09 -0.22 -1.16 0.00 0.00 179.01 178.65 3hdi h LYS 329 N 0.27 0.73 -0.50 2.33 3.64 -1.98 0.12 116.57 121.18 3hdi h LYS 329 Ca 0.06 -0.18 -0.09 0.00 -1.27 0.00 0.00 60.65 59.17 3hdi h LYS 329 Cb 0.21 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 3hdi h LYS 329 CO 0.01 0.74 -0.05 0.93 -2.27 0.00 0.00 179.45 178.81 3hdi h GLU 330 N 0.60 0.86 -0.24 1.90 5.08 -1.77 0.63 114.58 121.64 3hdi h GLU 330 Ca 0.14 -0.27 -0.14 0.00 -1.00 0.00 0.00 59.36 58.10 3hdi h GLU 330 Cb 0.35 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 3hdi h GLU 330 CO 0.00 0.89 -0.41 1.25 -1.00 0.00 0.00 179.01 179.74 3hdi h LEU 331 N 0.79 0.61 -0.35 1.33 5.85 -0.77 -2.19 115.31 120.58 3hdi h LEU 331 Ca 0.14 -0.27 -0.17 0.00 0.84 0.00 0.00 57.88 58.41 3hdi h LEU 331 Cb 0.54 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 3hdi h LEU 331 CO 0.03 0.95 -0.83 -0.08 -0.34 0.00 0.00 178.44 178.17 3hdi h GLU 332 N 0.47 0.02 0.00 1.25 4.57 -0.53 -2.78 114.58 117.58 3hdi h GLU 332 Ca 0.04 -0.02 -0.08 0.00 -1.18 0.00 0.00 59.36 58.12 3hdi h GLU 332 Cb 0.92 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.50 3hdi h GLU 332 CO 0.08 0.83 -0.38 -0.97 -1.18 0.00 0.00 179.01 177.39 3hdi h ASN 333 N 0.01 0.00 -0.01 1.04 -1.24 -0.68 -2.71 115.58 112.00 3hdi h ASN 333 Ca -0.01 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.91 3hdi h ASN 333 Cb 1.46 0.00 0.01 0.00 0.73 0.00 0.00 38.32 40.52 3hdi h ASN 333 CO 0.11 0.38 -0.32 1.23 -1.29 0.00 0.00 177.43 177.54 3hdi h GLY 334 N 1.47 0.26 0.65 1.57 0.00 -1.27 -2.79 103.07 102.95 3hdi h GLY 334 Ca -0.00 -0.44 0.07 0.00 0.00 0.00 0.00 47.33 46.96 3hdi h GLY 334 CO 0.05 0.39 0.42 0.50 0.00 0.00 0.00 176.54 177.90 3hdi h LYS 335 N -0.40 0.73 -0.71 4.80 1.57 -1.44 0.11 116.57 121.24 3hdi h LYS 335 Ca -0.04 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 3hdi h LYS 335 Cb 1.07 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 33.18 3hdi h LYS 335 CO 0.06 0.48 0.32 0.93 -0.57 0.00 0.00 179.45 180.68 3hdi h GLU 336 N 0.75 1.01 0.07 3.15 4.39 -1.55 0.24 114.58 122.65 3hdi h GLU 336 Ca 0.33 -0.15 -0.00 0.00 0.34 0.00 0.00 59.36 59.88 3hdi h GLU 336 Cb 0.23 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 3hdi h GLU 336 CO -0.20 0.79 -0.04 0.37 -1.16 0.00 0.00 179.01 178.78 3hdi h GLN 337 N 1.00 -0.10 -0.36 2.33 4.15 -0.83 -0.47 115.11 120.83 3hdi h GLN 337 Ca 0.24 0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.65 3hdi h GLN 337 Cb 0.13 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 27.82 3hdi h GLN 337 CO -0.03 0.20 0.17 -0.07 -1.93 0.00 0.00 178.83 177.17 3hdi h LEU 338 N -0.39 0.48 -0.28 -2.39 3.38 -0.68 0.21 115.31 115.64 3hdi h LEU 338 Ca -0.01 -0.13 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 3hdi h LEU 338 Cb 0.34 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3hdi h LEU 338 CO 0.02 0.48 0.16 0.11 0.09 0.00 0.00 178.44 179.30 3hdi h LYS 339 N 0.45 0.38 -0.25 1.13 1.57 -0.97 -0.00 116.57 118.88 3hdi h LYS 339 Ca 0.12 -0.04 -0.12 0.00 -1.87 0.00 0.00 60.65 58.75 3hdi h LYS 339 Cb 0.13 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 3hdi h LYS 339 CO -0.01 0.31 -0.34 0.78 -0.57 0.00 0.00 179.45 179.62 3hdi h GLY 340 N 0.34 0.57 0.92 3.86 0.00 -0.94 -1.59 103.07 106.23 3hdi h GLY 340 Ca 0.10 -0.52 -0.04 0.00 0.00 0.00 0.00 47.33 46.86 3hdi h GLY 340 CO -0.02 0.47 0.06 0.23 0.00 0.00 0.00 176.54 177.28 3hdi h SER 341 N 0.44 0.59 -0.71 0.19 0.87 -0.33 -2.61 113.55 111.99 3hdi h SER 341 Ca 0.05 -0.26 -0.03 0.00 -1.23 0.00 0.00 61.79 60.32 3hdi h SER 341 Cb 0.80 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.57 3hdi h SER 341 CO 0.07 0.70 0.32 0.25 -0.53 0.00 0.00 176.83 177.64 3hdi h LEU 342 N 0.46 0.96 0.44 2.23 5.85 -0.83 -2.68 115.31 121.74 3hdi h LEU 342 Ca 0.11 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 3hdi h LEU 342 Cb 0.36 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 3hdi h LEU 342 CO 0.01 0.84 -0.28 0.24 -0.34 0.00 0.00 178.44 178.91 3hdi h MET 343 N 1.01 -0.67 -0.06 1.25 2.86 -1.19 -2.70 114.93 115.43 3hdi h MET 343 Ca 0.24 0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.94 3hdi h MET 343 Cb 0.16 0.15 -0.00 0.00 0.06 0.00 0.00 31.60 31.97 3hdi h MET 343 CO -0.03 -0.45 0.06 -0.07 1.06 0.00 0.00 176.91 177.49 3hdi h LEU 344 N -0.69 0.00 -0.40 1.22 3.38 -1.42 -1.66 115.31 115.74 3hdi h LEU 344 Ca -0.05 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.76 3hdi h LEU 344 Cb 0.57 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 3hdi h LEU 344 CO 0.04 0.00 -0.77 0.77 0.09 0.00 0.00 178.44 178.57 3hdi h SER 345 N 0.00 0.00 -0.21 -0.43 4.64 -1.16 -3.19 113.55 113.19 3hdi h SER 345 Ca 0.03 0.00 0.06 0.00 -0.47 0.00 0.00 61.79 61.41 3hdi h SER 345 Cb 0.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 3hdi h SER 345 CO -0.00 0.77 0.25 -0.07 -0.87 0.00 0.00 176.83 176.91 3hdi h LEU 346 N 0.00 0.00 -1.50 5.97 3.38 -1.06 -0.83 115.31 121.28 3hdi h LEU 346 Ca -0.01 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3hdi h LEU 346 Cb 1.40 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.14 3hdi h LEU 346 CO 0.10 0.00 -0.24 -0.33 0.09 0.00 0.00 178.44 178.06 3hdi h GLU 347 N 0.00 0.00 -6.27 1.13 5.08 -1.69 -3.44 114.58 109.40 3hdi h GLU 347 Ca 0.10 0.00 -0.55 0.00 -1.00 0.00 0.00 59.36 57.91 3hdi h GLU 347 Cb 0.61 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.82 3hdi h GLU 347 CO -0.00 0.24 0.08 0.45 -1.00 0.00 0.00 179.01 178.78 3hdi s SER 348 N -6.49 7.15 -0.02 1.42 0.15 -0.32 -4.99 113.70 110.61 3hdi s SER 348 Ca -0.02 1.37 -0.22 0.00 0.70 0.00 0.00 55.95 57.78 3hdi s SER 348 Cb 0.13 -2.43 -0.23 0.00 -1.71 0.00 0.00 66.02 61.79 3hdi s SER 348 CO 0.65 0.12 1.08 0.71 1.20 0.00 0.00 173.24 177.00 3hdi h THR 349 N 3.88 1.47 0.00 6.45 1.35 -1.86 -2.83 112.91 121.37 3hdi h THR 349 Ca -0.46 -1.99 -0.00 0.00 -0.55 0.00 0.00 66.41 63.41 3hdi h THR 349 Cb 1.21 2.63 -0.00 0.00 -1.73 0.00 0.00 68.15 70.25 3hdi h THR 349 CO 0.68 0.57 -0.02 0.78 -0.25 0.00 0.00 175.52 177.28 3hdi h ASN 350 N -0.25 0.00 -0.01 5.36 -0.26 -1.94 -0.83 115.58 117.65 3hdi h ASN 350 Ca -0.05 0.00 -0.22 0.00 -0.56 0.00 0.00 56.30 55.46 3hdi h ASN 350 Cb 1.16 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 38.44 3hdi h ASN 350 CO 0.09 0.02 -0.86 -1.28 -1.06 0.00 0.00 177.43 174.33 3hdi h SER 351 N 0.00 0.78 0.30 5.81 0.87 -1.83 -2.58 113.55 116.90 3hdi h SER 351 Ca -0.00 -0.74 -0.25 0.00 -1.23 0.00 0.00 61.79 59.57 3hdi h SER 351 Cb 0.09 -0.24 0.01 0.00 -0.44 0.00 0.00 62.40 61.82 3hdi h SER 351 CO 0.00 1.41 -1.04 0.03 -0.53 0.00 0.00 176.83 176.71 3hdi h ARG 352 N 0.22 0.46 0.41 2.24 3.08 -1.15 -2.84 114.38 116.80 3hdi h ARG 352 Ca -0.11 -0.54 -0.02 0.00 0.07 0.00 0.00 59.98 59.38 3hdi h ARG 352 Cb 1.54 0.16 0.00 0.00 0.08 0.00 0.00 29.97 31.75 3hdi h ARG 352 CO 0.17 1.19 -0.20 1.98 -1.07 0.00 0.00 179.97 182.04 3hdi h MET 353 N 0.24 -0.53 -0.09 0.04 4.05 -1.26 -1.90 114.93 115.48 3hdi h MET 353 Ca -0.11 0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.34 3hdi h MET 353 Cb 1.69 0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 32.60 3hdi h MET 353 CO 0.18 -0.29 0.03 0.66 0.23 0.00 0.00 176.91 177.73 3hdi h SER 354 N -0.67 0.11 0.12 1.39 4.64 -1.56 -0.61 113.55 116.97 3hdi h SER 354 Ca -0.06 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.25 3hdi h SER 354 Cb 0.49 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.55 3hdi h SER 354 CO 0.09 0.12 -0.06 -0.09 -0.87 0.00 0.00 176.83 176.02 3hdi h ARG 355 N 0.13 -0.15 -0.16 4.77 2.43 -1.37 -2.51 114.38 117.52 3hdi h ARG 355 Ca 0.03 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.21 3hdi h ARG 355 Cb 0.05 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 3hdi h ARG 355 CO -0.00 0.28 0.09 -0.91 -1.51 0.00 0.00 179.97 177.91 3hdi h ASN 356 N -0.66 0.19 -0.28 -3.80 2.35 -1.13 -0.03 115.58 112.22 3hdi h ASN 356 Ca -0.02 -0.07 0.04 0.00 -0.55 0.00 0.00 56.30 55.70 3hdi h ASN 356 Cb 0.50 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.79 3hdi h ASN 356 CO 0.03 0.21 0.07 1.23 -1.65 0.00 0.00 177.43 177.32 3hdi h GLY 357 N 0.16 0.34 1.18 2.83 0.00 -1.21 -0.13 103.07 106.23 3hdi h GLY 357 Ca 0.06 -0.04 -0.07 0.00 0.00 0.00 0.00 47.33 47.27 3hdi h GLY 357 CO -0.01 0.01 0.09 1.70 0.00 0.00 0.00 176.54 178.32 3hdi h LYS 358 N 0.19 1.01 0.12 4.80 3.64 -1.36 -1.01 116.57 123.96 3hdi h LYS 358 Ca 0.13 -0.26 -0.01 0.00 -1.27 0.00 0.00 60.65 59.24 3hdi h LYS 358 Cb 0.12 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 3hdi h LYS 358 CO -0.15 0.93 -0.06 -0.91 -2.27 0.00 0.00 179.45 176.99 3hdi h ASN 359 N 0.94 -0.14 -0.20 4.20 2.35 -0.62 -1.20 115.58 120.92 3hdi h ASN 359 Ca 0.19 -0.26 0.05 0.00 -0.55 0.00 0.00 56.30 55.73 3hdi h ASN 359 Cb 0.43 0.04 -0.05 0.00 0.05 0.00 0.00 38.32 38.78 3hdi h ASN 359 CO 0.01 0.19 -0.10 -0.08 -1.65 0.00 0.00 177.43 175.81 3hdi h GLU 360 N -0.48 -0.08 -0.33 0.81 4.57 -0.98 1.09 114.58 119.19 3hdi h GLU 360 Ca -0.02 0.01 -0.02 0.00 -1.18 0.00 0.00 59.36 58.15 3hdi h GLU 360 Cb 0.39 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.98 3hdi h GLU 360 CO 0.03 -0.05 0.11 1.25 -1.18 0.00 0.00 179.01 179.16 3hdi h LEU 361 N -0.08 0.43 0.00 1.64 5.85 -1.16 -1.66 115.31 120.32 3hdi h LEU 361 Ca 0.11 -0.05 -0.21 0.00 0.84 0.00 0.00 57.88 58.58 3hdi h LEU 361 Cb 0.25 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.13 3hdi h LEU 361 CO -0.26 0.42 -1.77 0.18 -0.34 0.00 0.00 178.44 176.67 3hdi n LEU 362 N -4.38 0.56 -0.01 2.25 4.77 -0.46 -4.75 117.00 114.98 3hdi n LEU 362 Ca 0.02 -0.01 0.02 0.00 -0.03 0.00 0.00 56.01 56.01 3hdi n LEU 362 Cb 0.16 0.13 -0.06 0.00 -2.33 0.00 0.00 43.42 41.32 3hdi n LEU 362 CO 0.37 0.36 -0.63 0.18 -1.33 0.00 0.00 177.39 176.34 3hdi n LEU 363 N -2.51 0.00 0.00 2.23 4.77 0.34 -4.89 117.00 116.94 3hdi n LEU 363 Ca -0.19 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 3hdi n LEU 363 Cb 0.84 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.98 3hdi n LEU 363 CO 0.22 0.04 0.00 0.29 -1.33 0.00 0.00 177.39 176.61 3hdi n LYS 364 N -1.89 0.00 -4.13 3.23 5.02 0.10 -4.94 118.16 115.56 3hdi n LYS 364 Ca -0.04 0.00 -0.29 0.00 -2.02 0.00 0.00 58.31 55.96 3hdi n LYS 364 Cb 0.33 -2.83 -0.07 0.00 -0.02 0.00 0.00 35.03 32.44 3hdi n LYS 364 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 3hdi s LYS 365 N 0.00 2.62 0.12 1.97 2.20 -1.26 -4.77 119.74 120.62 3hdi s LYS 365 Ca 0.00 -0.88 0.07 0.00 -0.36 0.00 0.00 55.97 54.80 3hdi s LYS 365 Cb 0.00 -2.54 -0.04 0.00 -1.51 0.00 0.00 37.83 33.74 3hdi s LYS 365 CO 0.00 0.52 -0.17 -1.01 -0.36 0.00 0.00 175.35 174.33 3hdi s HIS 366 N -1.48 1.56 -0.01 4.03 3.76 -1.26 -4.52 115.29 117.37 3hdi s HIS 366 Ca 0.27 -0.49 0.02 0.00 -0.15 0.00 0.00 55.06 54.71 3hdi s HIS 366 Cb -0.11 -0.82 0.00 0.00 1.11 0.00 0.00 32.58 32.76 3hdi s HIS 366 CO 0.20 0.19 -0.06 1.03 -0.85 0.00 0.00 174.74 175.25 3hdi s ARG 367 N -2.40 0.58 1.01 1.40 0.52 -1.26 -5.12 118.95 113.67 3hdi s ARG 367 Ca 0.08 -0.20 -0.12 0.00 -0.52 0.00 0.00 55.73 54.97 3hdi s ARG 367 Cb -0.07 -0.57 0.19 0.00 0.52 0.00 0.00 34.95 35.02 3hdi s ARG 367 CO 0.04 0.09 1.09 -1.54 0.02 0.00 0.00 175.30 175.00 3hdi s SER 368 N 0.08 2.52 0.26 0.23 1.04 -1.26 -4.70 113.70 111.87 3hdi s SER 368 Ca -0.01 1.23 -0.02 0.00 0.48 0.00 0.00 55.95 57.63 3hdi s SER 368 Cb -0.05 -1.90 0.46 0.00 0.10 0.00 0.00 66.02 64.62 3hdi s SER 368 CO -0.00 -3.20 1.83 0.25 0.98 0.00 0.00 173.24 173.09 3hdi h LEU 369 N -1.94 0.81 -1.02 2.42 5.85 -2.01 -0.48 115.31 118.95 3hdi h LEU 369 Ca -0.55 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.13 3hdi h LEU 369 Cb 1.33 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.23 3hdi h LEU 369 CO 0.57 0.46 -0.27 0.44 -0.34 0.00 0.00 178.44 179.29 3hdi h ASP 370 N 0.91 0.38 -0.09 1.25 3.45 -1.99 -0.91 116.42 119.41 3hdi h ASP 370 Ca 0.44 -0.13 -0.13 0.00 0.43 0.00 0.00 57.03 57.64 3hdi h ASP 370 Cb 0.39 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.05 3hdi h ASP 370 CO -0.25 0.65 -0.37 -0.33 -1.57 0.00 0.00 179.24 177.37 3hdi h GLU 371 N 0.33 0.61 -0.34 3.56 5.08 -1.48 -2.27 114.58 120.07 3hdi h GLU 371 Ca 0.05 -0.30 -0.14 0.00 -1.00 0.00 0.00 59.36 57.97 3hdi h GLU 371 Cb 0.66 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.90 3hdi h GLU 371 CO 0.05 0.88 -0.33 0.52 -1.00 0.00 0.00 179.01 179.13 3hdi h MET 372 N 0.51 0.82 -0.27 2.33 2.86 -0.73 -2.71 114.93 117.74 3hdi h MET 372 Ca 0.05 -0.43 -0.09 0.00 -2.06 0.00 0.00 59.70 57.17 3hdi h MET 372 Cb 0.88 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.53 3hdi h MET 372 CO 0.08 1.07 -0.20 0.82 1.06 0.00 0.00 176.91 179.74 3hdi h ILE 373 N 0.61 1.25 -0.06 -1.22 2.04 -1.12 -2.52 117.51 116.49 3hdi h ILE 373 Ca 0.05 -1.17 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 3hdi h ILE 373 Cb 0.91 1.26 -0.00 0.00 -0.74 0.00 0.00 36.82 38.25 3hdi h ILE 373 CO 0.08 0.38 -0.01 -0.08 0.00 0.00 0.00 178.15 178.52 3hdi h GLU 374 N 0.45 0.10 -1.00 2.37 4.57 -1.37 -1.50 114.58 118.20 3hdi h GLU 374 Ca 0.07 -0.04 0.16 0.00 -1.18 0.00 0.00 59.36 58.37 3hdi h GLU 374 Cb 0.60 -0.01 -0.10 0.00 -0.16 0.00 0.00 28.75 29.08 3hdi h GLU 374 CO 0.04 0.41 0.62 1.96 -1.18 0.00 0.00 179.01 180.86 3hdi h GLN 375 N -0.22 0.84 -0.45 1.92 1.08 -1.36 0.36 115.11 117.29 3hdi h GLN 375 Ca 0.01 -0.05 -0.11 0.00 -1.45 0.00 0.00 58.65 57.05 3hdi h GLN 375 Cb 0.37 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 3hdi h GLN 375 CO 0.00 0.56 -0.17 0.82 -0.95 0.00 0.00 178.83 179.10 3hdi h ILE 376 N 0.87 1.27 0.25 2.54 2.04 -1.29 -3.26 117.51 119.94 3hdi h ILE 376 Ca 0.54 -1.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 3hdi h ILE 376 Cb 0.70 1.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.95 3hdi h ILE 376 CO -0.33 0.45 -0.12 0.78 0.00 0.00 0.00 178.15 178.93 3hdi h ASN 377 N 0.74 -0.29 -1.28 1.72 -0.26 0.11 -3.23 115.58 113.10 3hdi h ASN 377 Ca 0.11 -0.18 0.37 0.00 -0.56 0.00 0.00 56.30 56.04 3hdi h ASN 377 Cb 0.73 0.07 -0.05 0.00 -1.06 0.00 0.00 38.32 38.01 3hdi h ASN 377 CO 0.06 0.03 1.12 0.00 -1.06 0.00 0.00 177.43 177.57 3hdi h ALA 378 N 0.03 3.17 -2.65 -0.83 0.00 -0.43 -3.42 119.26 115.13 3hdi h ALA 378 Ca -0.03 -0.04 -0.54 0.00 0.00 0.00 0.00 54.91 54.29 3hdi h ALA 378 Cb 0.45 0.10 0.08 0.00 0.00 0.00 0.00 17.79 18.41 3hdi h ALA 378 CO 0.06 -1.77 0.88 0.28 0.00 0.00 0.00 179.25 178.70 3hdi n VAL 379 N -3.69 0.64 -4.17 0.00 0.31 -1.22 -5.00 118.33 105.19 3hdi n VAL 379 Ca 0.28 -0.16 -0.32 0.00 -0.01 0.00 0.00 64.34 64.13 3hdi n VAL 379 Cb 1.51 -1.88 -0.08 0.00 -0.91 0.00 0.00 33.84 32.48 3hdi n VAL 379 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3hdi s GLN 380 N 0.09 2.81 0.45 5.55 -0.21 -1.26 -5.00 119.66 122.10 3hdi s GLN 380 Ca 0.69 -0.65 0.18 0.00 0.02 0.00 0.00 55.36 55.60 3hdi s GLN 380 Cb -0.53 -2.69 1.12 0.00 1.00 0.00 0.00 33.01 31.91 3hdi s GLN 380 CO 0.43 0.60 1.94 -0.22 -2.12 0.00 0.00 175.29 175.92 3hdi h LYS 381 N 3.92 0.32 0.45 2.91 3.64 -1.95 0.27 116.57 126.13 3hdi h LYS 381 Ca -0.48 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 58.87 3hdi h LYS 381 Cb 1.17 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.90 3hdi h LYS 381 CO 0.60 0.21 -0.38 1.96 -2.27 0.00 0.00 179.45 179.57 3hdi h GLN 382 N 0.33 -0.80 -0.05 1.90 1.08 -1.94 -0.93 115.11 114.69 3hdi h GLN 382 Ca 0.34 0.05 0.02 0.00 -1.45 0.00 0.00 58.65 57.62 3hdi h GLN 382 Cb 0.87 0.18 -0.06 0.00 -0.05 0.00 0.00 27.48 28.42 3hdi h GLN 382 CO -0.09 -0.53 -0.53 -0.44 -0.95 0.00 0.00 178.83 176.28 3hdi h ASP 383 N -0.83 -1.67 0.12 1.46 3.32 -1.36 -0.65 116.42 116.81 3hdi h ASP 383 Ca -0.04 0.19 0.02 0.00 0.02 0.00 0.00 57.03 57.22 3hdi h ASP 383 Cb 0.72 0.64 -0.04 0.00 0.22 0.00 0.00 39.33 40.87 3hdi h ASP 383 CO -0.02 -0.50 -0.31 0.58 -1.72 0.00 0.00 179.24 177.26 3hdi h VAL 384 N -0.63 0.33 -0.50 -1.35 2.07 -1.36 -1.09 116.25 113.72 3hdi h VAL 384 Ca 0.02 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.62 3hdi h VAL 384 Cb 0.70 0.33 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 3hdi h VAL 384 CO -0.38 0.00 0.34 0.28 0.02 0.00 0.00 177.57 177.82 3hdi h SER 385 N -0.54 0.30 0.58 0.57 0.02 -1.01 -0.55 113.55 112.93 3hdi h SER 385 Ca 0.03 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.95 3hdi h SER 385 Cb 0.57 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 63.05 3hdi h SER 385 CO -0.18 0.19 -0.28 -0.09 -1.14 0.00 0.00 176.83 175.33 3hdi h ARG 386 N 0.34 -0.75 -0.71 3.45 2.43 -0.56 -3.00 114.38 115.59 3hdi h ARG 386 Ca 0.23 0.05 0.15 0.00 -0.81 0.00 0.00 59.98 59.60 3hdi h ARG 386 Cb 0.45 0.17 -0.10 0.00 -0.42 0.00 0.00 29.97 30.06 3hdi h ARG 386 CO -0.05 -0.44 0.17 1.25 -1.51 0.00 0.00 179.97 179.38 3hdi h LEU 387 N -1.06 0.01 -1.54 3.80 5.85 -0.64 -0.08 115.31 121.65 3hdi h LEU 387 Ca -0.08 0.14 0.19 0.00 0.84 0.00 0.00 57.88 58.97 3hdi h LEU 387 Cb 0.66 0.19 -0.06 0.00 0.37 0.00 0.00 40.66 41.81 3hdi h LEU 387 CO 0.13 -0.03 0.57 0.00 -0.34 0.00 0.00 178.44 178.77 3hdi h ALA 388 N 1.58 2.18 0.03 1.25 0.00 -1.08 -0.09 119.26 123.14 3hdi h ALA 388 Ca 0.39 0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.16 3hdi h ALA 388 Cb 0.65 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.42 3hdi h ALA 388 CO -0.49 -0.44 -0.61 -0.22 0.00 0.00 0.00 179.25 177.49 3hdi h LYS 389 N 0.41 0.36 0.75 0.00 3.64 -0.88 -1.84 116.57 119.01 3hdi h LYS 389 Ca 0.44 -0.43 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 3hdi h LYS 389 Cb 1.07 0.13 0.01 0.00 -0.41 0.00 0.00 32.23 33.03 3hdi h LYS 389 CO -0.16 1.12 -0.36 0.82 -2.27 0.00 0.00 179.45 178.60 3hdi h ILE 390 N -0.20 0.24 0.08 2.00 1.08 -0.84 -2.89 117.51 116.97 3hdi h ILE 390 Ca -0.08 -0.04 -0.00 0.00 -0.39 0.00 0.00 64.86 64.34 3hdi h ILE 390 Cb 1.35 0.25 0.00 0.00 -3.07 0.00 0.00 36.82 35.36 3hdi h ILE 390 CO 0.12 0.00 -0.04 -0.07 -0.69 0.00 0.00 178.15 177.48 3hdi h LEU 391 N -1.05 -0.09 -0.04 1.44 3.38 -1.19 -3.29 115.31 114.48 3hdi h LEU 391 Ca -0.10 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.47 3hdi h LEU 391 Cb 0.78 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.56 3hdi h LEU 391 CO 0.17 0.38 0.00 0.18 0.09 0.00 0.00 178.44 179.26 3hdi n LEU 392 N -4.92 0.04 -0.69 1.67 4.77 -0.69 -2.76 117.00 114.42 3hdi n LEU 392 Ca -0.08 -0.02 0.06 0.00 -0.03 0.00 0.00 56.01 55.94 3hdi n LEU 392 Cb 0.25 -0.02 0.18 0.00 -2.33 0.00 0.00 43.42 41.49 3hdi n LEU 392 CO 0.32 0.01 0.65 -1.20 -1.33 0.00 0.00 177.39 175.83 3hdi n SER 393 N -0.48 3.13 -4.94 -1.43 7.64 -1.09 -4.80 113.62 111.64 3hdi n SER 393 Ca 0.00 -2.21 -0.24 0.00 1.01 0.00 0.00 58.87 57.42 3hdi n SER 393 Cb 0.01 -0.30 -0.02 0.00 -1.01 0.00 0.00 64.21 62.89 3hdi n SER 393 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hdi s ALA 394 N -1.38 3.82 -0.05 -0.43 0.00 -1.11 -4.99 121.76 117.61 3hdi s ALA 394 Ca 0.27 -0.98 -0.30 0.00 0.00 0.00 0.00 51.96 50.96 3hdi s ALA 394 Cb 0.17 -1.95 -0.04 0.00 0.00 0.00 0.00 23.12 21.29 3hdi s ALA 394 CO 0.14 0.22 1.33 -1.12 0.00 0.00 0.00 175.76 176.34 3hdi s SER 395 N -3.70 6.91 0.61 0.00 0.01 -1.26 -5.00 113.70 111.27 3hdi s SER 395 Ca 0.38 1.96 -0.06 0.00 1.31 0.00 0.00 55.95 59.53 3hdi s SER 395 Cb -0.10 -2.55 0.01 0.00 0.21 0.00 0.00 66.02 63.59 3hdi s SER 395 CO 0.31 -0.70 0.93 -2.16 0.41 0.00 0.00 173.24 172.03 3hdi s PRO 396 N 2.66 2.87 0.22 12.44 0.04 -1.26 -4.61 135.00 147.35 3hdi s PRO 396 Ca 0.60 0.02 -0.03 0.00 0.04 0.00 0.00 61.00 61.63 3hdi s PRO 396 Cb -0.28 -2.24 -0.05 0.00 0.04 0.00 0.00 34.50 31.97 3hdi s PRO 396 CO 0.23 -0.76 0.44 -1.54 0.04 0.00 0.00 177.00 175.41 3hdi s SER 397 N -4.32 6.44 -0.04 6.66 1.04 -0.49 -4.61 113.70 118.38 3hdi s SER 397 Ca 0.55 0.57 0.02 0.00 0.48 0.00 0.00 55.95 57.56 3hdi s SER 397 Cb -0.11 -2.08 0.01 0.00 0.10 0.00 0.00 66.02 63.95 3hdi s SER 397 CO 0.46 -0.07 -0.08 -0.63 0.98 0.00 0.00 173.24 173.90 3hdi s ILE 398 N -1.88 0.75 -0.07 -1.02 1.09 -0.07 -1.50 121.20 118.49 3hdi s ILE 398 Ca 0.41 -0.30 0.03 0.00 -1.10 0.00 0.00 60.65 59.69 3hdi s ILE 398 Cb -0.11 -0.70 0.01 0.00 -1.06 0.00 0.00 42.46 40.59 3hdi s ILE 398 CO 0.28 0.25 -0.17 -0.94 -0.10 0.00 0.00 174.94 174.26 3hdi s SER 399 N 0.49 2.32 -0.02 3.58 1.04 -0.65 0.15 113.70 120.61 3hdi s SER 399 Ca -0.08 -0.40 -0.01 0.00 0.48 0.00 0.00 55.95 55.94 3hdi s SER 399 Cb -0.12 -0.98 0.01 0.00 0.10 0.00 0.00 66.02 65.03 3hdi s SER 399 CO 0.01 0.10 0.05 -0.22 0.98 0.00 0.00 173.24 174.16 3hdi s LEU 400 N 0.42 1.69 -0.11 2.42 2.96 0.18 -1.53 118.68 124.72 3hdi s LEU 400 Ca -0.14 0.09 0.01 0.00 -0.22 0.00 0.00 54.13 53.88 3hdi s LEU 400 Cb -0.16 0.14 0.02 0.00 0.50 0.00 0.00 46.19 46.69 3hdi s LEU 400 CO 0.05 -0.03 -0.14 -0.63 -1.32 0.00 0.00 176.35 174.28 3hdi s ILE 401 N 0.19 1.41 0.28 6.68 1.01 -0.83 -0.93 121.20 129.02 3hdi s ILE 401 Ca -0.01 -0.58 -0.10 0.00 0.00 0.00 0.00 60.65 59.96 3hdi s ILE 401 Cb -0.02 -1.32 0.00 0.00 0.01 0.00 0.00 42.46 41.13 3hdi s ILE 401 CO -0.01 0.43 0.50 0.54 0.00 0.00 0.00 174.94 176.40 3hdi s ASN 402 N 1.16 0.16 0.19 3.58 2.20 -1.10 -0.97 114.94 120.15 3hdi s ASN 402 Ca -0.03 -1.09 -0.12 0.00 -0.94 0.00 0.00 52.86 50.68 3hdi s ASN 402 Cb -0.14 0.62 0.19 0.00 -2.00 0.00 0.00 41.25 39.92 3hdi s ASN 402 CO -0.04 -1.22 1.76 0.00 -2.94 0.00 0.00 177.10 174.66 3hdi h ALA 403 N 2.21 0.67 0.00 3.54 0.00 -1.83 -1.08 119.26 122.76 3hdi h ALA 403 Ca -0.27 0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.54 3hdi h ALA 403 Cb 1.25 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.03 3hdi h ALA 403 CO 0.37 -0.18 -1.18 -2.95 0.00 0.00 0.00 179.25 175.31 3hdi h ASN 404 N 0.40 0.00 -0.03 0.00 7.08 -1.95 -3.40 115.58 117.70 3hdi h ASN 404 Ca 0.25 0.00 -0.01 0.00 -3.08 0.00 0.00 56.30 53.46 3hdi h ASN 404 Cb 0.26 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 36.49 3hdi h ASN 404 CO -0.24 0.58 -0.01 0.61 -2.08 0.00 0.00 177.43 176.29 3hdi n GLY 405 N 1.35 0.44 3.47 9.14 0.00 -1.16 -4.82 105.19 113.63 3hdi n GLY 405 Ca -0.07 -0.84 -0.30 0.00 0.00 0.00 0.00 46.02 44.81 3hdi n GLY 405 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3hdi s GLU 406 N -1.65 1.78 0.58 1.61 -1.05 -1.26 -4.64 118.70 114.08 3hdi s GLU 406 Ca 0.00 -1.17 -0.19 0.00 -0.15 0.00 0.00 54.97 53.46 3hdi s GLU 406 Cb 0.00 -2.10 -0.04 0.00 -0.44 0.00 0.00 34.13 31.55 3hdi s GLU 406 CO 0.00 0.49 1.18 -0.51 0.95 0.00 0.00 175.26 177.37 3hdi s LEU 407 N -2.01 3.67 0.56 1.83 1.43 -1.26 -4.99 118.68 117.91 3hdi s LEU 407 Ca 0.17 2.31 -0.15 0.00 -1.03 0.00 0.00 54.13 55.43 3hdi s LEU 407 Cb -0.10 -4.59 -0.06 0.00 0.03 0.00 0.00 46.19 41.47 3hdi s LEU 407 CO 0.09 -1.49 1.01 -2.16 0.23 0.00 0.00 176.35 174.02 3hdi s PRO 408 N -3.36 3.73 0.20 1.29 0.04 -1.26 -4.94 135.00 130.69 3hdi s PRO 408 Ca 0.76 0.92 -0.08 0.00 0.04 0.00 0.00 61.00 62.64 3hdi s PRO 408 Cb -0.28 -2.10 0.11 0.00 0.04 0.00 0.00 34.50 32.27 3hdi s PRO 408 CO 0.32 -0.46 1.71 0.87 0.04 0.00 0.00 177.00 179.48 3hdi h LYS 409 N 0.43 1.14 0.00 4.56 6.56 -1.97 -2.03 116.57 125.26 3hdi h LYS 409 Ca -0.46 -0.28 0.00 0.00 -1.06 0.00 0.00 60.65 58.85 3hdi h LYS 409 Cb 1.19 -0.14 0.00 0.00 -0.57 0.00 0.00 32.23 32.71 3hdi h LYS 409 CO 0.61 1.01 0.04 0.00 -2.06 0.00 0.00 179.45 179.05 3hdi n ALA 410 N -2.46 0.98 -2.31 3.86 0.00 -1.26 -3.74 120.51 115.58 3hdi n ALA 410 Ca 0.05 0.15 -0.42 0.00 0.00 0.00 0.00 53.44 53.21 3hdi n ALA 410 Cb 0.27 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.55 3hdi n ALA 410 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 3hdi n LEU 411 N -2.06 6.64 0.00 0.00 7.94 -0.76 -4.56 117.00 124.20 3hdi n LEU 411 Ca -0.01 -4.62 0.00 0.00 -1.11 0.00 0.00 56.01 50.27 3hdi n LEU 411 Cb 0.06 -1.49 0.00 0.00 0.53 0.00 0.00 43.42 42.52 3hdi n LEU 411 CO 0.07 1.35 0.00 -0.38 -1.11 0.00 0.00 177.39 177.32 3hdi n ILE 412 N 3.44 0.00 -1.68 1.96 2.08 -1.25 -4.92 119.36 119.00 3hdi n ILE 412 Ca 0.40 0.00 -0.57 0.00 0.56 0.00 0.00 62.75 63.14 3hdi n ILE 412 Cb 0.37 0.00 -0.07 0.00 -0.75 0.00 0.00 39.64 39.18 3hdi n ILE 412 CO 0.00 0.00 0.00 1.57 0.56 0.00 0.00 176.55 178.68 3hdi n HIS 413 N 0.00 1.86 -2.68 1.39 -0.00 -1.26 -4.88 115.22 109.65 3hdi n HIS 413 Ca 0.00 0.63 -0.04 0.00 0.46 0.00 0.00 57.72 58.77 3hdi n HIS 413 Cb 0.00 -2.40 0.04 0.00 -0.12 0.00 0.00 29.99 27.51 3hdi n HIS 413 CO 0.00 0.00 0.00 -0.11 0.46 0.00 0.00 176.34 176.69 3hdi n LEU 414 N 4.52 -1.63 0.00 0.27 0.00 -1.26 -5.11 117.00 113.78 3hdi n LEU 414 Ca 0.25 -1.42 0.00 0.00 0.00 0.00 0.00 56.01 54.84 3hdi n LEU 414 Cb 0.12 0.58 0.00 0.00 0.00 0.00 0.00 43.42 44.12 3hdi n LEU 414 CO 0.77 1.37 0.25 1.21 0.00 0.00 0.00 177.39 180.99