#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hm7 s PHE 4 N 0.00 3.72 0.29 -0.14 0.08 -0.71 -5.00 117.98 116.22 3hm7 s PHE 4 Ca 0.00 0.97 0.06 0.00 0.12 0.00 0.00 56.93 58.07 3hm7 s PHE 4 Cb 0.00 -2.27 0.45 0.00 -0.57 0.00 0.00 43.02 40.63 3hm7 s PHE 4 CO 0.00 0.65 1.70 -0.44 -0.10 0.00 0.00 175.22 177.03 3hm7 h ASP 5 N 4.71 0.30 -4.63 1.36 5.19 -1.54 -3.38 116.42 118.42 3hm7 h ASP 5 Ca -0.52 -0.12 -0.02 0.00 -0.62 0.00 0.00 57.03 55.75 3hm7 h ASP 5 Cb 1.22 -0.08 -0.20 0.00 0.18 0.00 0.00 39.33 40.44 3hm7 h ASP 5 CO 0.61 0.66 0.27 -0.22 -3.12 0.00 0.00 179.24 177.44 3hm7 s LEU 6 N -8.33 -0.60 -0.06 1.55 2.96 -1.13 -4.46 118.68 108.61 3hm7 s LEU 6 Ca -0.05 0.73 -0.00 0.00 -0.22 0.00 0.00 54.13 54.59 3hm7 s LEU 6 Cb 0.13 2.35 0.02 0.00 0.50 0.00 0.00 46.19 49.20 3hm7 s LEU 6 CO 0.78 -0.50 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.65 3hm7 s ILE 7 N -0.96 0.55 -0.20 6.68 1.01 -0.65 -0.76 121.20 126.88 3hm7 s ILE 7 Ca -0.07 -0.05 -0.21 0.00 0.00 0.00 0.00 60.65 60.31 3hm7 s ILE 7 Cb -0.01 -0.63 -0.02 0.00 0.01 0.00 0.00 42.46 41.81 3hm7 s ILE 7 CO 0.07 0.26 0.65 -0.63 0.00 0.00 0.00 174.94 175.28 3hm7 s ILE 8 N 1.44 5.00 -0.04 2.92 -1.09 -0.08 -1.78 121.20 127.56 3hm7 s ILE 8 Ca -0.03 1.22 0.03 0.00 -2.23 0.00 0.00 60.65 59.64 3hm7 s ILE 8 Cb -0.13 -3.96 -0.03 0.00 -1.58 0.00 0.00 42.46 36.76 3hm7 s ILE 8 CO -0.03 0.09 -0.11 -0.13 -1.23 0.00 0.00 174.94 173.54 3hm7 s ARG 9 N 1.99 2.57 -0.14 2.79 0.52 -0.77 -1.20 118.95 124.72 3hm7 s ARG 9 Ca 0.29 -0.66 0.00 0.00 -0.52 0.00 0.00 55.73 54.84 3hm7 s ARG 9 Cb -0.16 -2.46 0.00 0.00 0.52 0.00 0.00 34.95 32.85 3hm7 s ARG 9 CO 0.10 0.63 0.00 0.43 0.02 0.00 0.00 175.30 176.48 3hm7 n SER 10 N 2.12 -4.91 -4.93 0.23 7.64 -1.26 -1.07 113.62 111.44 3hm7 n SER 10 Ca -0.17 0.03 -0.26 0.00 1.01 0.00 0.00 58.87 59.48 3hm7 n SER 10 Cb 0.52 -2.53 0.07 0.00 -1.01 0.00 0.00 64.21 61.27 3hm7 n SER 10 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3hm7 s SER 11 N -2.08 4.86 -0.30 6.43 1.04 -1.24 -4.17 113.70 118.25 3hm7 s SER 11 Ca 0.00 0.45 -0.16 0.00 0.48 0.00 0.00 55.95 56.72 3hm7 s SER 11 Cb 0.00 -1.13 -0.02 0.00 0.10 0.00 0.00 66.02 64.97 3hm7 s SER 11 CO 0.00 -1.56 0.43 -0.89 0.98 0.00 0.00 173.24 172.20 3hm7 s THR 12 N -3.22 5.11 0.18 2.02 2.01 -0.80 -2.68 115.64 118.26 3hm7 s THR 12 Ca 0.60 0.47 -0.30 0.00 0.31 0.00 0.00 61.69 62.77 3hm7 s THR 12 Cb -0.11 -3.81 -0.08 0.00 0.01 0.00 0.00 72.50 68.51 3hm7 s THR 12 CO 0.45 0.00 1.17 -0.69 -0.69 0.00 0.00 174.62 174.86 3hm7 s VAL 13 N 2.19 3.64 -0.09 3.82 1.01 0.13 -0.01 120.40 131.10 3hm7 s VAL 13 Ca 0.17 1.39 0.01 0.00 0.00 0.00 0.00 61.98 63.55 3hm7 s VAL 13 Cb -0.16 -3.89 0.02 0.00 0.00 0.00 0.00 36.38 32.35 3hm7 s VAL 13 CO 0.11 0.23 -0.11 0.68 0.00 0.00 0.00 175.10 176.01 3hm7 s VAL 14 N -0.12 1.13 0.00 2.92 -7.23 -0.04 -1.66 120.40 115.40 3hm7 s VAL 14 Ca 0.52 -0.42 0.00 0.00 -1.81 0.00 0.00 61.98 60.27 3hm7 s VAL 14 Cb -0.32 -1.07 0.00 0.00 0.56 0.00 0.00 36.38 35.55 3hm7 s VAL 14 CO 0.36 0.37 0.00 0.35 -0.31 0.00 0.00 175.10 175.87 3hm7 n THR 15 N 4.28 0.00 0.24 5.32 -2.24 -0.05 -4.05 114.28 117.77 3hm7 n THR 15 Ca -0.19 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.68 3hm7 n THR 15 Cb 0.51 -0.14 0.59 0.00 -2.10 0.00 0.00 70.33 69.18 3hm7 n THR 15 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 3hm7 h GLU 16 N 0.00 0.00 0.00 -0.78 4.11 -1.87 -3.37 114.58 112.68 3hm7 h GLU 16 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 3hm7 h GLU 16 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 3hm7 h GLU 16 CO 0.00 0.19 -0.65 0.25 0.07 0.00 0.00 179.01 178.87 3hm7 n THR 17 N -3.90 0.00 -4.18 -1.06 -2.24 -1.26 -4.43 114.28 97.21 3hm7 n THR 17 Ca -0.02 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.63 3hm7 n THR 17 Cb 0.28 0.16 -0.09 0.00 -2.10 0.00 0.00 70.33 68.58 3hm7 n THR 17 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 3hm7 s THR 18 N -1.36 0.00 0.01 4.28 -1.32 -1.26 -5.01 115.64 110.98 3hm7 s THR 18 Ca 0.00 -1.90 0.02 0.00 -1.21 0.00 0.00 61.69 58.60 3hm7 s THR 18 Cb 0.00 -2.47 -0.01 0.00 -1.51 0.00 0.00 72.50 68.51 3hm7 s THR 18 CO 0.00 0.00 -0.07 0.42 -2.21 0.00 0.00 174.62 172.76 3hm7 s THR 19 N -3.98 0.52 -0.04 5.08 -4.23 -1.26 -0.88 115.64 110.85 3hm7 s THR 19 Ca 0.37 -0.52 -0.30 0.00 -1.18 0.00 0.00 61.69 60.05 3hm7 s THR 19 Cb 0.05 -0.49 0.08 0.00 1.34 0.00 0.00 72.50 73.48 3hm7 s THR 19 CO 0.14 -0.02 0.72 -0.72 -0.54 0.00 0.00 174.62 174.21 3hm7 s TYR 20 N -0.52 -0.59 -0.31 3.99 -0.85 -0.67 -4.99 117.35 113.40 3hm7 s TYR 20 Ca -0.01 0.94 -0.24 0.00 -0.52 0.00 0.00 57.07 57.23 3hm7 s TYR 20 Cb -0.05 0.44 0.00 0.00 0.38 0.00 0.00 41.96 42.73 3hm7 s TYR 20 CO 0.00 -0.60 0.84 1.03 -1.52 0.00 0.00 175.55 175.30 3hm7 s ARG 21 N -1.53 3.96 0.18 -3.49 1.81 -1.26 0.21 118.95 118.83 3hm7 s ARG 21 Ca -0.08 0.64 -0.17 0.00 -1.72 0.00 0.00 55.73 54.40 3hm7 s ARG 21 Cb -0.00 -3.74 0.03 0.00 -0.45 0.00 0.00 34.95 30.79 3hm7 s ARG 21 CO 0.06 -0.74 0.51 0.00 -0.68 0.00 0.00 175.30 174.45 3hm7 s ALA 22 N 3.09 -0.94 -0.07 2.13 0.00 -1.09 -4.52 121.76 120.36 3hm7 s ALA 22 Ca 0.35 -0.19 -0.04 0.00 0.00 0.00 0.00 51.96 52.08 3hm7 s ALA 22 Cb -0.14 0.84 -0.04 0.00 0.00 0.00 0.00 23.12 23.78 3hm7 s ALA 22 CO 0.13 -0.78 0.11 -0.51 0.00 0.00 0.00 175.76 174.72 3hm7 s ASP 23 N -2.86 6.05 -0.14 0.00 -0.00 0.11 -3.63 116.67 116.20 3hm7 s ASP 23 Ca 0.08 0.32 0.01 0.00 -0.00 0.00 0.00 52.55 52.97 3hm7 s ASP 23 Cb -0.01 -1.86 -0.00 0.00 -0.00 0.00 0.00 42.92 41.05 3hm7 s ASP 23 CO -0.04 0.35 -0.18 -0.69 -0.00 0.00 0.00 175.17 174.60 3hm7 s VAL 24 N -1.10 2.47 -0.15 -1.27 1.01 -0.34 -1.29 120.40 119.74 3hm7 s VAL 24 Ca 0.19 -0.85 -0.04 0.00 0.00 0.00 0.00 61.98 61.28 3hm7 s VAL 24 Cb -0.12 -2.01 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 3hm7 s VAL 24 CO 0.09 0.53 -0.01 0.00 0.00 0.00 0.00 175.10 175.71 3hm7 s ALA 25 N 0.67 3.15 -0.09 5.51 0.00 0.17 -0.91 121.76 130.26 3hm7 s ALA 25 Ca -0.09 -0.80 0.04 0.00 0.00 0.00 0.00 51.96 51.11 3hm7 s ALA 25 Cb -0.16 -1.62 -0.01 0.00 0.00 0.00 0.00 23.12 21.33 3hm7 s ALA 25 CO 0.02 0.28 -0.20 0.42 0.00 0.00 0.00 175.76 176.28 3hm7 s ILE 26 N 0.11 2.42 -0.08 0.00 1.01 0.06 -0.07 121.20 124.65 3hm7 s ILE 26 Ca 0.01 -0.91 -0.03 0.00 0.00 0.00 0.00 60.65 59.72 3hm7 s ILE 26 Cb -0.13 -1.94 0.05 0.00 0.01 0.00 0.00 42.46 40.44 3hm7 s ILE 26 CO 0.02 0.56 0.16 -0.60 0.00 0.00 0.00 174.94 175.08 3hm7 s ARG 27 N 0.08 0.05 -1.45 2.79 3.52 -0.31 -1.43 118.95 122.20 3hm7 s ARG 27 Ca -0.09 0.52 -0.10 0.00 -0.13 0.00 0.00 55.73 55.94 3hm7 s ARG 27 Cb -0.15 -0.25 0.05 0.00 -1.56 0.00 0.00 34.95 33.04 3hm7 s ARG 27 CO 0.06 -0.27 0.95 0.09 -0.81 0.00 0.00 175.30 175.31 3hm7 n ASN 28 N 5.07 -4.14 0.00 -2.12 5.03 -1.26 -2.49 115.26 115.35 3hm7 n ASN 28 Ca -0.10 -0.75 0.00 0.00 0.87 0.00 0.00 54.58 54.60 3hm7 n ASN 28 Cb 0.50 -4.13 0.00 0.00 -1.02 0.00 0.00 39.78 35.13 3hm7 n ASN 28 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3hm7 n GLY 29 N -1.70 1.07 3.54 7.41 0.00 -1.26 -5.02 105.19 109.23 3hm7 n GLY 29 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 3hm7 n GLY 29 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hm7 s ILE 30 N -3.72 1.80 -0.09 -0.61 -4.36 -1.04 -0.91 121.20 112.27 3hm7 s ILE 30 Ca 0.00 -2.05 -0.26 0.00 -0.26 0.00 0.00 60.65 58.08 3hm7 s ILE 30 Cb 0.00 -2.83 -0.02 0.00 1.25 0.00 0.00 42.46 40.86 3hm7 s ILE 30 CO 0.00 -0.07 0.84 -0.69 0.24 0.00 0.00 174.94 175.27 3hm7 s VAL 31 N -2.87 4.92 -0.13 8.37 1.01 -0.21 -1.16 120.40 130.32 3hm7 s VAL 31 Ca 0.34 1.72 0.08 0.00 0.00 0.00 0.00 61.98 64.12 3hm7 s VAL 31 Cb 0.08 -4.17 -0.13 0.00 0.00 0.00 0.00 36.38 32.16 3hm7 s VAL 31 CO 0.16 0.12 -0.01 -0.24 0.00 0.00 0.00 175.10 175.14 3hm7 n SER 32 N 4.45 2.28 -3.79 3.32 2.88 0.90 -0.98 113.62 122.68 3hm7 n SER 32 Ca 0.03 -0.02 -0.13 0.00 -1.33 0.00 0.00 58.87 57.42 3hm7 n SER 32 Cb 0.50 0.50 -0.10 0.00 -0.75 0.00 0.00 64.21 64.37 3hm7 n SER 32 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hm7 s ALA 33 N -2.29 -0.67 -0.11 -1.46 0.00 -1.02 -4.91 121.76 111.30 3hm7 s ALA 33 Ca -0.10 0.39 0.02 0.00 0.00 0.00 0.00 51.96 52.27 3hm7 s ALA 33 Cb 0.04 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 23.08 3hm7 s ALA 33 CO 0.45 -0.21 -0.16 0.42 0.00 0.00 0.00 175.76 176.26 3hm7 s ILE 34 N -0.88 1.52 0.13 0.00 1.01 -1.26 0.43 121.20 122.15 3hm7 s ILE 34 Ca -0.10 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 59.90 3hm7 s ILE 34 Cb -0.05 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 41.00 3hm7 s ILE 34 CO 0.03 0.44 -0.00 0.42 0.00 0.00 0.00 174.94 175.83 3hm7 s THR 35 N 0.92 0.49 0.50 2.92 -4.23 -0.41 -5.00 115.64 110.82 3hm7 s THR 35 Ca -0.08 -1.93 -0.23 0.00 -1.18 0.00 0.00 61.69 58.26 3hm7 s THR 35 Cb -0.15 -1.95 -0.06 0.00 1.34 0.00 0.00 72.50 71.68 3hm7 s THR 35 CO -0.01 -0.61 1.32 -1.83 -0.54 0.00 0.00 174.62 172.96 3hm7 s GLU 36 N -3.93 3.45 0.01 3.99 -1.05 -1.26 -0.71 118.70 119.21 3hm7 s GLU 36 Ca 0.20 2.16 -0.37 0.00 -0.15 0.00 0.00 54.97 56.80 3hm7 s GLU 36 Cb 0.06 -2.41 -0.17 0.00 -0.44 0.00 0.00 34.13 31.18 3hm7 s GLU 36 CO 0.00 -0.91 1.41 -2.30 0.95 0.00 0.00 175.26 174.40 3hm7 n PRO 37 N -0.64 1.11 -1.00 -4.83 -0.02 -1.26 -2.42 135.00 125.92 3hm7 n PRO 37 Ca 0.08 0.40 -0.00 0.00 -2.02 0.00 0.00 63.50 61.96 3hm7 n PRO 37 Cb 0.45 -2.05 -0.00 0.00 -0.02 0.00 0.00 33.50 31.88 3hm7 n PRO 37 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hm7 n GLY 38 N 2.80 0.47 0.21 -1.23 0.00 -1.26 -4.93 105.19 101.25 3hm7 n GLY 38 Ca 0.20 -0.20 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 3hm7 n GLY 38 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3hm7 h SER 39 N 0.00 0.43 -3.25 1.61 0.87 -1.84 -3.42 113.55 107.94 3hm7 h SER 39 Ca -0.00 -0.18 -0.59 0.00 -1.23 0.00 0.00 61.79 59.79 3hm7 h SER 39 Cb 0.03 -0.12 -0.09 0.00 -0.44 0.00 0.00 62.40 61.79 3hm7 h SER 39 CO 0.00 0.77 -0.25 -0.63 -0.53 0.00 0.00 176.83 176.20 3hm7 s ILE 40 N -4.24 5.23 0.65 2.23 1.09 -1.26 -5.07 121.20 119.83 3hm7 s ILE 40 Ca -0.06 0.72 -0.17 0.00 -1.10 0.00 0.00 60.65 60.03 3hm7 s ILE 40 Cb 0.13 -3.70 -0.01 0.00 -1.06 0.00 0.00 42.46 37.82 3hm7 s ILE 40 CO 0.80 0.40 1.22 -0.44 -0.10 0.00 0.00 174.94 176.82 3hm7 s SER 41 N 0.27 4.77 0.55 3.58 0.01 -1.26 -4.93 113.70 116.70 3hm7 s SER 41 Ca 0.21 2.42 0.25 0.00 1.31 0.00 0.00 55.95 60.13 3hm7 s SER 41 Cb -0.14 -2.60 1.49 0.00 0.21 0.00 0.00 66.02 64.98 3hm7 s SER 41 CO 0.07 -1.88 2.08 -1.28 0.41 0.00 0.00 173.24 172.64 3hm7 h SER 42 N 0.44 0.00 -1.00 2.44 0.87 -1.95 -2.82 113.55 111.52 3hm7 h SER 42 Ca -0.50 0.00 -0.66 0.00 -1.23 0.00 0.00 61.79 59.40 3hm7 h SER 42 Cb 1.30 0.00 -0.31 0.00 -0.44 0.00 0.00 62.40 62.95 3hm7 h SER 42 CO 0.53 0.00 0.64 0.47 -0.53 0.00 0.00 176.83 177.94 3hm7 n ASP 43 N -4.16 7.31 -0.93 6.23 9.92 -1.26 -4.41 116.55 129.26 3hm7 n ASP 43 Ca 0.03 -3.79 -0.00 0.00 -0.53 0.00 0.00 54.79 50.51 3hm7 n ASP 43 Cb 0.37 -0.89 0.20 0.00 -0.64 0.00 0.00 41.12 40.16 3hm7 n ASP 43 CO 0.00 0.00 0.00 0.47 0.13 0.00 0.00 177.20 177.80 3hm7 n ASP 44 N -0.88 2.19 0.00 -2.24 8.00 -1.07 -4.83 116.55 117.73 3hm7 n ASP 44 Ca 0.60 -3.81 0.00 0.00 0.71 0.00 0.00 54.79 52.29 3hm7 n ASP 44 Cb 0.69 -0.59 0.00 0.00 -0.02 0.00 0.00 41.12 41.20 3hm7 n ASP 44 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3hm7 n GLY 45 N -1.12 3.55 3.76 0.44 0.00 -1.26 -1.74 105.19 108.83 3hm7 n GLY 45 Ca 0.27 -1.78 -0.40 0.00 0.00 0.00 0.00 46.02 44.12 3hm7 n GLY 45 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hm7 s PRO 46 N -2.61 4.50 0.22 1.61 0.02 -1.26 -4.84 135.00 132.64 3hm7 s PRO 46 Ca 0.00 1.91 0.11 0.00 0.02 0.00 0.00 61.00 63.04 3hm7 s PRO 46 Cb 0.00 -3.09 -0.05 0.00 0.02 0.00 0.00 34.50 31.38 3hm7 s PRO 46 CO 0.00 0.05 -0.22 0.00 -0.33 0.00 0.00 177.00 176.50 3hm7 s ALA 47 N -1.19 2.63 -0.12 -1.55 0.00 -1.26 -1.63 121.76 118.63 3hm7 s ALA 47 Ca 0.47 -1.71 0.02 0.00 0.00 0.00 0.00 51.96 50.74 3hm7 s ALA 47 Cb -0.34 -0.33 -0.00 0.00 0.00 0.00 0.00 23.12 22.45 3hm7 s ALA 47 CO 0.44 0.38 -0.19 0.42 0.00 0.00 0.00 175.76 176.80 3hm7 s ILE 48 N -1.96 2.41 -0.66 0.00 -1.09 -0.74 -4.95 121.20 114.22 3hm7 s ILE 48 Ca 0.24 -0.88 -0.27 0.00 -2.23 0.00 0.00 60.65 57.51 3hm7 s ILE 48 Cb -0.07 -1.97 0.04 0.00 -1.58 0.00 0.00 42.46 38.88 3hm7 s ILE 48 CO 0.12 0.54 1.18 -0.62 -1.23 0.00 0.00 174.94 174.93 3hm7 s ASP 49 N 0.52 6.28 -0.22 3.58 3.68 -1.26 -1.84 116.67 127.41 3hm7 s ASP 49 Ca -0.12 -0.30 0.15 0.00 2.13 0.00 0.00 52.55 54.40 3hm7 s ASP 49 Cb -0.17 -2.53 0.75 0.00 -1.45 0.00 0.00 42.92 39.52 3hm7 s ASP 49 CO 0.05 -1.61 1.66 0.61 0.13 0.00 0.00 175.17 176.01 3hm7 n GLY 50 N 5.24 3.25 3.66 2.66 0.00 -0.23 -4.98 105.19 114.79 3hm7 n GLY 50 Ca 0.04 -0.95 -0.47 0.00 0.00 0.00 0.00 46.02 44.64 3hm7 n GLY 50 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3hm7 n THR 51 N 0.37 0.10 -0.35 2.61 -1.04 -1.24 -1.51 114.28 113.21 3hm7 n THR 51 Ca 0.26 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 62.25 3hm7 n THR 51 Cb 1.11 -1.52 0.00 0.00 -1.82 0.00 0.00 70.33 68.10 3hm7 n THR 51 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3hm7 n GLY 52 N 3.50 1.76 3.79 3.41 0.00 -1.26 -5.01 105.19 111.37 3hm7 n GLY 52 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 3hm7 n GLY 52 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hm7 s LEU 53 N 0.00 3.26 -0.06 0.99 1.43 -0.57 -4.80 118.68 118.92 3hm7 s LEU 53 Ca 0.00 -0.88 0.06 0.00 -1.03 0.00 0.00 54.13 52.28 3hm7 s LEU 53 Cb 0.00 -1.74 -0.01 0.00 0.03 0.00 0.00 46.19 44.47 3hm7 s LEU 53 CO 0.00 -0.52 -0.24 -1.00 0.23 0.00 0.00 176.35 174.82 3hm7 s HIS 54 N -2.51 2.42 -0.42 0.29 3.76 -0.23 -1.91 115.29 116.69 3hm7 s HIS 54 Ca 0.43 -0.77 -0.16 0.00 -0.15 0.00 0.00 55.06 54.40 3hm7 s HIS 54 Cb -0.00 -1.60 0.02 0.00 1.11 0.00 0.00 32.58 32.11 3hm7 s HIS 54 CO 0.24 -0.25 0.37 -1.17 -0.85 0.00 0.00 174.74 173.08 3hm7 s LEU 55 N -0.06 5.00 0.05 0.89 2.96 0.99 -1.27 118.68 127.25 3hm7 s LEU 55 Ca -0.06 -0.80 -0.00 0.00 -0.22 0.00 0.00 54.13 53.04 3hm7 s LEU 55 Cb -0.14 -2.27 -0.04 0.00 0.50 0.00 0.00 46.19 44.24 3hm7 s LEU 55 CO 0.05 -0.52 0.21 -0.36 -1.32 0.00 0.00 176.35 174.40 3hm7 s PHE 56 N 1.90 3.52 0.59 5.38 0.08 -0.29 -0.86 117.98 128.30 3hm7 s PHE 56 Ca 0.08 0.26 -0.18 0.00 0.12 0.00 0.00 56.93 57.21 3hm7 s PHE 56 Cb -0.18 -1.77 -0.04 0.00 -0.57 0.00 0.00 43.02 40.46 3hm7 s PHE 56 CO 0.12 0.60 1.16 -2.14 -0.10 0.00 0.00 175.22 174.85 3hm7 s PRO 57 N -2.44 3.07 0.21 0.24 0.02 -1.26 -0.67 135.00 134.17 3hm7 s PRO 57 Ca 0.34 1.66 -0.32 0.00 0.02 0.00 0.00 61.00 62.70 3hm7 s PRO 57 Cb -0.13 -1.96 -0.13 0.00 0.02 0.00 0.00 34.50 32.30 3hm7 s PRO 57 CO 0.27 -1.09 1.59 0.41 -0.33 0.00 0.00 177.00 177.85 3hm7 n GLY 58 N 0.19 1.21 3.76 0.52 0.00 -0.27 -4.59 105.19 106.01 3hm7 n GLY 58 Ca 0.12 0.59 -0.37 0.00 0.00 0.00 0.00 46.02 46.36 3hm7 n GLY 58 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3hm7 s MET 59 N 0.55 3.24 -0.20 1.61 1.00 -0.74 -4.58 119.30 120.18 3hm7 s MET 59 Ca 0.74 1.89 0.01 0.00 0.00 0.00 0.00 55.69 58.33 3hm7 s MET 59 Cb -0.60 -2.13 0.03 0.00 0.00 0.00 0.00 34.83 32.13 3hm7 s MET 59 CO 0.40 -1.00 -0.17 0.08 0.00 0.00 0.00 175.02 174.32 3hm7 s VAL 60 N -1.53 2.15 -0.39 -6.03 1.01 0.12 -1.84 120.40 113.88 3hm7 s VAL 60 Ca 0.72 -1.07 -0.06 0.00 0.00 0.00 0.00 61.98 61.58 3hm7 s VAL 60 Cb -0.32 -1.98 0.08 0.00 0.00 0.00 0.00 36.38 34.16 3hm7 s VAL 60 CO 0.36 0.41 0.19 -0.62 0.00 0.00 0.00 175.10 175.45 3hm7 s ASP 61 N 1.26 5.39 0.00 3.32 2.15 -0.58 -4.45 116.67 123.76 3hm7 s ASP 61 Ca 0.02 -1.58 0.30 0.00 0.43 0.00 0.00 52.55 51.72 3hm7 s ASP 61 Cb -0.15 -1.89 1.57 0.00 -0.30 0.00 0.00 42.92 42.15 3hm7 s ASP 61 CO -0.11 -0.48 2.04 1.33 -0.17 0.00 0.00 175.17 177.78 3hm7 n VAL 62 N 4.77 0.00 -3.47 1.11 0.24 -1.26 -1.62 118.33 118.10 3hm7 n VAL 62 Ca -0.09 -0.10 -0.29 0.00 -2.04 0.00 0.00 64.34 61.83 3hm7 n VAL 62 Cb 0.43 -0.11 -0.12 0.00 -1.47 0.00 0.00 33.84 32.57 3hm7 n VAL 62 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 3hm7 s HIS 63 N -2.00 0.85 0.03 6.34 5.65 -1.25 -4.46 115.29 120.45 3hm7 s HIS 63 Ca 0.44 -1.76 0.05 0.00 0.25 0.00 0.00 55.06 54.03 3hm7 s HIS 63 Cb 0.22 -0.98 -0.02 0.00 -1.18 0.00 0.00 32.58 30.61 3hm7 s HIS 63 CO 0.36 -0.83 -0.13 0.14 -0.65 0.00 0.00 174.74 173.63 3hm7 s VAL 64 N 0.89 1.05 -0.36 0.89 -7.23 -1.03 -1.71 120.40 112.90 3hm7 s VAL 64 Ca 0.20 -0.94 -0.05 0.00 -1.81 0.00 0.00 61.98 59.38 3hm7 s VAL 64 Cb -0.20 -0.95 0.07 0.00 0.56 0.00 0.00 36.38 35.86 3hm7 s VAL 64 CO -0.02 0.02 0.14 -1.00 -0.31 0.00 0.00 175.10 173.93 3hm7 s HIS 65 N -0.80 3.35 -1.65 2.82 3.76 -0.31 -0.52 115.29 121.94 3hm7 s HIS 65 Ca 0.01 -1.79 0.25 0.00 -0.15 0.00 0.00 55.06 53.37 3hm7 s HIS 65 Cb -0.07 -2.61 0.40 0.00 1.11 0.00 0.00 32.58 31.41 3hm7 s HIS 65 CO 0.01 -0.83 1.34 1.19 -0.85 0.00 0.00 174.74 175.60 3hm7 n PHE 66 N 4.73 0.00 -2.22 1.40 3.72 -1.26 -4.56 117.46 119.27 3hm7 n PHE 66 Ca -0.10 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.11 3hm7 n PHE 66 Cb 0.43 -0.09 -0.03 0.00 -0.94 0.00 0.00 39.48 38.85 3hm7 n PHE 66 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3hm7 n ASN 67 N -0.67 -5.58 -4.15 4.37 5.03 -1.26 -0.40 115.26 112.60 3hm7 n ASN 67 Ca 0.10 0.12 -0.31 0.00 0.87 0.00 0.00 54.58 55.35 3hm7 n ASN 67 Cb 0.38 -4.72 -0.17 0.00 -1.02 0.00 0.00 39.78 34.26 3hm7 n ASN 67 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 3hm7 s GLU 68 N -4.74 2.75 0.00 3.52 2.12 -1.26 -2.49 118.70 118.60 3hm7 s GLU 68 Ca 0.00 -0.76 0.00 0.00 0.36 0.00 0.00 54.97 54.57 3hm7 s GLU 68 Cb 0.00 -2.20 0.00 0.00 0.26 0.00 0.00 34.13 32.19 3hm7 s GLU 68 CO 0.00 0.03 0.00 -0.35 -0.54 0.00 0.00 175.26 174.40 3hm7 n PRO 69 N 3.94 0.49 0.00 4.30 -0.05 -1.26 -4.87 135.00 137.55 3hm7 n PRO 69 Ca -0.20 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.25 3hm7 n PRO 69 Cb 0.52 0.00 0.00 0.00 -0.05 0.00 0.00 33.50 33.97 3hm7 n PRO 69 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 3hm7 n GLY 70 N 5.00 1.97 2.43 0.55 0.00 -1.14 -1.58 105.19 112.42 3hm7 n GLY 70 Ca 0.00 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 3hm7 n GLY 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hm7 n ARG 71 N 0.00 3.37 -0.27 1.61 1.74 -1.09 -4.86 116.66 117.15 3hm7 n ARG 71 Ca 0.00 -4.30 -0.03 0.00 -0.77 0.00 0.00 57.85 52.75 3hm7 n ARG 71 Cb 0.00 -2.26 0.08 0.00 -1.02 0.00 0.00 32.46 29.26 3hm7 n ARG 71 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 3hm7 h THR 72 N 2.39 1.13 0.00 0.55 2.02 -1.70 -2.55 112.91 114.74 3hm7 h THR 72 Ca 0.35 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 67.20 3hm7 h THR 72 Cb 0.95 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.45 3hm7 h THR 72 CO 0.92 0.17 0.00 -1.84 0.37 0.00 0.00 175.52 175.14 3hm7 n GLU 73 N -4.61 0.00 -0.06 6.66 0.28 -1.26 -0.52 120.64 121.14 3hm7 n GLU 73 Ca 0.08 0.46 -0.13 0.00 -0.16 0.00 0.00 57.16 57.41 3hm7 n GLU 73 Cb 0.07 -1.51 -0.07 0.00 1.43 0.00 0.00 31.44 31.36 3hm7 n GLU 73 CO 0.00 0.00 0.00 -1.49 -0.16 0.00 0.00 177.13 175.48 3hm7 h TRP 74 N 0.00 0.53 0.00 -1.84 4.06 -1.80 -3.46 115.95 113.44 3hm7 h TRP 74 Ca 0.00 -0.17 0.00 0.00 2.06 0.00 0.00 58.89 60.78 3hm7 h TRP 74 Cb 0.05 -0.11 0.00 0.00 -1.00 0.00 0.00 29.16 28.10 3hm7 h TRP 74 CO 0.00 0.83 0.00 -1.91 -3.56 0.00 0.00 178.44 173.80 3hm7 n GLU 75 N -4.47 0.00 0.00 0.49 0.00 0.32 -4.47 120.64 112.51 3hm7 n GLU 75 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.10 3hm7 n GLU 75 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.84 3hm7 n GLU 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3hm7 n GLY 76 N 0.14 1.74 0.23 8.31 0.00 0.47 -4.56 105.19 111.53 3hm7 n GLY 76 Ca 0.00 -1.77 -0.01 0.00 0.00 0.00 0.00 46.02 44.24 3hm7 n GLY 76 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3hm7 h PHE 77 N 0.00 0.37 0.37 1.61 0.04 -1.92 -2.18 116.94 115.24 3hm7 h PHE 77 Ca 0.00 -0.06 -0.02 0.00 2.80 0.00 0.00 57.97 60.69 3hm7 h PHE 77 Cb 0.00 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 38.06 3hm7 h PHE 77 CO 0.00 0.54 -0.18 0.00 -0.60 0.00 0.00 178.31 178.07 3hm7 h ALA 78 N 1.47 -0.50 0.00 2.45 0.00 -1.89 -2.48 119.26 118.31 3hm7 h ALA 78 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3hm7 h ALA 78 Cb 0.55 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3hm7 h ALA 78 CO 0.04 -0.49 0.00 -1.13 0.00 0.00 0.00 179.25 177.67 3hm7 n SER 79 N -5.11 0.00 -0.10 0.00 3.41 -1.24 -1.50 113.62 109.07 3hm7 n SER 79 Ca -0.07 -0.50 -0.19 0.00 -0.26 0.00 0.00 58.87 57.84 3hm7 n SER 79 Cb 0.23 -0.03 -0.09 0.00 -0.26 0.00 0.00 64.21 64.06 3hm7 n SER 79 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hm7 n GLY 80 N 0.16 -0.78 0.20 5.00 0.00 -0.82 -3.93 105.19 105.01 3hm7 n GLY 80 Ca 0.13 -0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.20 3hm7 n GLY 80 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hm7 h SER 81 N -1.00 0.00 -0.57 1.61 4.64 -1.24 -1.83 113.55 115.16 3hm7 h SER 81 Ca -0.32 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.98 3hm7 h SER 81 Cb 1.19 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.25 3hm7 h SER 81 CO -0.20 0.34 0.31 0.50 -0.87 0.00 0.00 176.83 176.92 3hm7 h LYS 82 N 0.00 0.81 -0.30 4.77 3.64 -1.48 -2.09 116.57 121.92 3hm7 h LYS 82 Ca -0.00 -0.10 -0.13 0.00 -1.27 0.00 0.00 60.65 59.15 3hm7 h LYS 82 Cb 0.71 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.36 3hm7 h LYS 82 CO 0.04 0.62 -0.34 0.77 -2.27 0.00 0.00 179.45 178.27 3hm7 h SER 83 N 0.78 0.69 -0.27 4.20 0.02 -1.55 -2.75 113.55 114.67 3hm7 h SER 83 Ca 0.20 -0.29 -0.06 0.00 -0.84 0.00 0.00 61.79 60.80 3hm7 h SER 83 Cb 0.06 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 3hm7 h SER 83 CO -0.03 0.98 -0.06 -0.07 -1.14 0.00 0.00 176.83 176.50 3hm7 h LEU 84 N 0.56 0.52 -1.37 5.07 3.38 -1.23 -2.12 115.31 120.11 3hm7 h LEU 84 Ca 0.06 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 3hm7 h LEU 84 Cb 0.85 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.44 3hm7 h LEU 84 CO 0.07 0.76 0.10 0.00 0.09 0.00 0.00 178.44 179.47 3hm7 h ALA 85 N 0.77 1.50 0.00 1.53 0.00 -1.41 0.25 119.26 121.91 3hm7 h ALA 85 Ca 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3hm7 h ALA 85 Cb 0.54 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3hm7 h ALA 85 CO 0.03 0.37 0.00 0.00 0.00 0.00 0.00 179.25 179.65 3hm7 n ALA 86 N -2.48 2.37 0.27 0.00 0.00 -1.04 -2.75 120.51 116.89 3hm7 n ALA 86 Ca 0.02 -0.14 0.04 0.00 0.00 0.00 0.00 53.44 53.36 3hm7 n ALA 86 Cb 0.17 -1.42 0.04 0.00 0.00 0.00 0.00 19.45 18.24 3hm7 n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hm7 n GLY 87 N 0.79 -0.21 1.37 0.00 0.00 -0.17 -4.80 105.19 102.18 3hm7 n GLY 87 Ca 0.15 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3hm7 n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hm7 n GLY 88 N 0.42 0.69 3.46 -0.02 0.00 -0.71 -4.39 105.19 104.63 3hm7 n GLY 88 Ca 0.05 -0.70 -0.35 0.00 0.00 0.00 0.00 46.02 45.01 3hm7 n GLY 88 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hm7 s VAL 89 N -2.00 4.12 -0.54 1.61 1.01 0.70 -1.80 120.40 123.50 3hm7 s VAL 89 Ca 0.00 -0.25 0.13 0.00 0.00 0.00 0.00 61.98 61.86 3hm7 s VAL 89 Cb 0.00 -2.88 -0.15 0.00 0.00 0.00 0.00 36.38 33.35 3hm7 s VAL 89 CO 0.00 0.40 0.52 0.35 0.00 0.00 0.00 175.10 176.37 3hm7 n THR 90 N 4.43 0.00 -3.87 3.92 -2.24 -0.77 -3.52 114.28 112.25 3hm7 n THR 90 Ca -0.17 -0.21 -0.12 0.00 -2.27 0.00 0.00 64.05 61.29 3hm7 n THR 90 Cb 0.52 0.89 -0.14 0.00 -2.10 0.00 0.00 70.33 69.50 3hm7 n THR 90 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3hm7 s THR 91 N -2.33 0.00 0.04 4.28 2.01 -1.17 -1.19 115.64 117.29 3hm7 s THR 91 Ca 0.04 -0.04 0.00 0.00 0.31 0.00 0.00 61.69 62.01 3hm7 s THR 91 Cb 0.10 -0.05 -0.03 0.00 0.01 0.00 0.00 72.50 72.52 3hm7 s THR 91 CO 0.54 -0.02 -0.05 -0.72 -0.69 0.00 0.00 174.62 173.69 3hm7 s TYR 92 N -0.05 0.49 -0.20 4.92 -0.85 -0.94 -1.52 117.35 119.21 3hm7 s TYR 92 Ca -0.01 -0.70 -0.03 0.00 -0.52 0.00 0.00 57.07 55.82 3hm7 s TYR 92 Cb -0.01 -0.33 -0.01 0.00 0.38 0.00 0.00 41.96 42.00 3hm7 s TYR 92 CO 0.00 -0.20 -0.07 -0.06 -1.52 0.00 0.00 175.55 173.70 3hm7 s PHE 93 N -2.29 2.92 -0.11 -3.49 0.08 -0.64 -1.22 117.98 113.23 3hm7 s PHE 93 Ca -0.06 -0.88 -0.22 0.00 0.12 0.00 0.00 56.93 55.89 3hm7 s PHE 93 Cb -0.04 -2.03 -0.03 0.00 -0.57 0.00 0.00 43.02 40.35 3hm7 s PHE 93 CO -0.03 -0.46 0.67 0.34 -0.10 0.00 0.00 175.22 175.64 3hm7 s ASP 94 N 1.16 6.88 0.40 1.36 -1.08 -0.53 -2.47 116.67 122.39 3hm7 s ASP 94 Ca 0.02 1.06 -0.24 0.00 -0.52 0.00 0.00 52.55 52.86 3hm7 s ASP 94 Cb -0.14 -2.39 -0.09 0.00 -1.46 0.00 0.00 42.92 38.84 3hm7 s ASP 94 CO -0.02 -0.16 1.08 -0.04 0.52 0.00 0.00 175.17 176.56 3hm7 s MET 95 N 1.14 4.14 0.28 4.34 -1.94 0.32 -1.14 119.30 126.45 3hm7 s MET 95 Ca 0.34 1.61 0.15 0.00 -1.71 0.00 0.00 55.69 56.08 3hm7 s MET 95 Cb -0.17 -2.60 0.26 0.00 2.01 0.00 0.00 34.83 34.33 3hm7 s MET 95 CO 0.15 -0.19 1.53 -1.00 -0.01 0.00 0.00 175.02 175.51 3hm7 h PRO 96 N 2.58 0.00 -7.61 2.03 0.13 -1.86 -3.45 132.00 123.81 3hm7 h PRO 96 Ca -0.48 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.18 3hm7 h PRO 96 Cb 1.22 0.00 0.11 0.00 0.13 0.00 0.00 31.00 32.46 3hm7 h PRO 96 CO 0.62 0.55 0.39 -0.48 -0.23 0.00 0.00 178.00 178.86 3hm7 s LEU 97 N -6.82 2.43 0.00 1.56 2.34 -1.26 -3.14 118.68 113.80 3hm7 s LEU 97 Ca 0.02 0.77 0.00 0.00 0.06 0.00 0.00 54.13 54.98 3hm7 s LEU 97 Cb 0.10 -3.20 0.00 0.00 -0.56 0.00 0.00 46.19 42.53 3hm7 s LEU 97 CO 0.74 -2.07 0.00 0.59 -1.06 0.00 0.00 176.35 174.55 3hm7 n ASN 98 N -3.42 0.00 -4.74 1.48 5.03 -1.26 -4.76 115.26 107.58 3hm7 n ASN 98 Ca 0.08 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.11 3hm7 n ASN 98 Cb 0.61 0.00 -0.01 0.00 -1.02 0.00 0.00 39.78 39.35 3hm7 n ASN 98 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 3hm7 n SER 99 N 0.72 3.70 -3.97 6.41 2.88 -1.25 -4.48 113.62 117.62 3hm7 n SER 99 Ca 0.00 1.17 -0.27 0.00 -1.33 0.00 0.00 58.87 58.44 3hm7 n SER 99 Cb 0.00 -1.58 -0.17 0.00 -0.75 0.00 0.00 64.21 61.71 3hm7 n SER 99 CO 0.00 0.00 0.00 0.21 -1.23 0.00 0.00 175.04 174.02 3hm7 s ASN 100 N 0.31 2.19 0.57 -3.46 2.47 -0.61 -2.32 114.94 114.09 3hm7 s ASN 100 Ca 0.62 -0.34 -0.19 0.00 0.42 0.00 0.00 52.86 53.36 3hm7 s ASN 100 Cb -0.51 -0.92 -0.05 0.00 -1.45 0.00 0.00 41.25 38.33 3hm7 s ASN 100 CO 0.52 -0.06 1.16 -2.84 -3.72 0.00 0.00 177.10 172.17 3hm7 s PRO 101 N 1.36 3.17 0.91 0.43 0.02 -1.26 -2.90 135.00 136.73 3hm7 s PRO 101 Ca -0.01 1.70 -0.11 0.00 0.02 0.00 0.00 61.00 62.60 3hm7 s PRO 101 Cb -0.14 -1.97 0.14 0.00 0.02 0.00 0.00 34.50 32.55 3hm7 s PRO 101 CO -0.05 -1.01 1.09 -1.25 -0.33 0.00 0.00 177.00 175.45 3hm7 s PRO 102 N -3.33 1.09 -0.91 5.54 0.04 -0.98 -4.88 135.00 131.57 3hm7 s PRO 102 Ca 0.75 1.02 -0.25 0.00 0.04 0.00 0.00 61.00 62.56 3hm7 s PRO 102 Cb -0.27 -1.77 -0.07 0.00 0.04 0.00 0.00 34.50 32.43 3hm7 s PRO 102 CO 0.30 -2.41 2.04 0.99 0.04 0.00 0.00 177.00 177.96 3hm7 s THR 103 N -2.81 3.36 -0.18 1.26 2.01 -1.19 -4.61 115.64 113.48 3hm7 s THR 103 Ca 0.64 -0.34 -0.05 0.00 0.31 0.00 0.00 61.69 62.24 3hm7 s THR 103 Cb -0.20 -3.87 -0.09 0.00 0.01 0.00 0.00 72.50 68.35 3hm7 s THR 103 CO 0.58 -0.75 -0.21 -0.38 -0.69 0.00 0.00 174.62 173.17 3hm7 n ILE 104 N 8.08 1.02 -3.56 1.82 5.41 -1.26 -2.14 119.36 128.74 3hm7 n ILE 104 Ca 0.42 -0.31 -0.21 0.00 1.00 0.00 0.00 62.75 63.65 3hm7 n ILE 104 Cb 0.46 -1.52 -0.02 0.00 -0.71 0.00 0.00 39.64 37.85 3hm7 n ILE 104 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 3hm7 s THR 105 N -2.35 2.56 0.22 1.39 -1.32 -1.26 -4.78 115.64 110.10 3hm7 s THR 105 Ca -0.25 -1.33 0.17 0.00 -1.21 0.00 0.00 61.69 59.07 3hm7 s THR 105 Cb 0.09 -2.89 0.11 0.00 -1.51 0.00 0.00 72.50 68.30 3hm7 s THR 105 CO 0.36 0.00 1.74 -0.09 -2.21 0.00 0.00 174.62 174.42 3hm7 h ARG 106 N 0.96 0.00 -0.23 7.08 2.43 -1.91 -2.17 114.38 120.54 3hm7 h ARG 106 Ca -0.40 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 58.69 3hm7 h ARG 106 Cb 1.27 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.81 3hm7 h ARG 106 CO 0.56 0.40 -0.20 1.49 -1.51 0.00 0.00 179.97 180.71 3hm7 h GLU 107 N 0.00 0.41 0.00 0.20 4.57 -2.00 -0.91 114.58 116.85 3hm7 h GLU 107 Ca -0.00 -0.13 -0.02 0.00 -1.18 0.00 0.00 59.36 58.02 3hm7 h GLU 107 Cb 0.87 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.42 3hm7 h GLU 107 CO 0.05 0.60 -0.61 1.49 -1.18 0.00 0.00 179.01 179.36 3hm7 h GLU 108 N 0.37 0.00 0.09 1.92 4.57 -1.90 -3.32 114.58 116.30 3hm7 h GLU 108 Ca 0.06 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.24 3hm7 h GLU 108 Cb 0.57 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.16 3hm7 h GLU 108 CO 0.04 0.05 -0.04 1.25 -1.18 0.00 0.00 179.01 179.13 3hm7 h LEU 109 N 0.00 -0.10 -1.27 1.64 5.85 -0.80 -3.19 115.31 117.44 3hm7 h LEU 109 Ca -0.01 -0.48 -0.05 0.00 0.84 0.00 0.00 57.88 58.18 3hm7 h LEU 109 Cb 1.06 0.03 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 3hm7 h LEU 109 CO 0.01 0.48 -0.22 0.44 -0.34 0.00 0.00 178.44 178.81 3hm7 h ASP 110 N -0.73 0.00 -0.40 1.25 3.45 -1.35 0.19 116.42 118.82 3hm7 h ASP 110 Ca -0.01 0.00 -0.06 0.00 0.43 0.00 0.00 57.03 57.39 3hm7 h ASP 110 Cb 0.57 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.32 3hm7 h ASP 110 CO 0.02 0.22 0.05 0.11 -1.57 0.00 0.00 179.24 178.07 3hm7 h LYS 111 N 0.00 0.76 0.00 3.56 1.57 -1.68 -2.64 116.57 118.14 3hm7 h LYS 111 Ca -0.00 -0.18 -0.20 0.00 -1.87 0.00 0.00 60.65 58.40 3hm7 h LYS 111 Cb 0.67 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.85 3hm7 h LYS 111 CO 0.03 0.74 -1.02 -0.22 -0.57 0.00 0.00 179.45 178.41 3hm7 h LYS 112 N 0.72 0.00 0.17 3.15 3.64 -1.23 -3.22 116.57 119.81 3hm7 h LYS 112 Ca 0.15 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 3hm7 h LYS 112 Cb 0.37 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 3hm7 h LYS 112 CO 0.01 0.83 -0.08 -0.09 -2.27 0.00 0.00 179.45 177.84 3hm7 h ARG 113 N 0.00 -0.22 -0.00 1.90 9.65 -0.55 -2.95 114.38 122.20 3hm7 h ARG 113 Ca -0.05 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.85 3hm7 h ARG 113 Cb 1.73 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 30.36 3hm7 h ARG 113 CO 0.11 -0.11 -0.44 1.04 2.80 0.00 0.00 179.97 183.37 3hm7 n GLN 114 N -5.17 0.09 0.12 0.20 6.02 -1.01 -2.57 117.38 115.07 3hm7 n GLN 114 Ca -0.09 -0.05 -0.01 0.00 -0.01 0.00 0.00 57.00 56.84 3hm7 n GLN 114 Cb 0.13 -1.50 0.11 0.00 1.02 0.00 0.00 30.24 30.00 3hm7 n GLN 114 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 3hm7 h LEU 115 N 0.12 0.00 0.00 1.08 3.38 -1.56 -3.05 115.31 115.28 3hm7 h LEU 115 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hm7 h LEU 115 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3hm7 h LEU 115 CO 0.00 0.67 -0.33 0.00 0.09 0.00 0.00 178.44 178.87 3hm7 h ALA 116 N 1.33 0.80 -0.58 1.53 0.00 -1.32 -3.09 119.26 117.93 3hm7 h ALA 116 Ca -0.01 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3hm7 h ALA 116 Cb 1.27 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 3hm7 h ALA 116 CO 0.09 0.00 0.05 -0.91 0.00 0.00 0.00 179.25 178.48 3hm7 h ASN 117 N 0.00 0.91 0.43 0.00 2.35 -1.38 -1.91 115.58 115.99 3hm7 h ASN 117 Ca 0.00 -0.22 -0.23 0.00 -0.55 0.00 0.00 56.30 55.30 3hm7 h ASN 117 Cb 0.84 -0.24 0.00 0.00 0.05 0.00 0.00 38.32 38.97 3hm7 h ASN 117 CO 0.00 0.94 -0.99 -0.08 -1.65 0.00 0.00 177.43 175.65 3hm7 h GLU 118 N 0.89 0.35 0.00 0.81 4.81 -1.58 -3.40 114.58 116.46 3hm7 h GLU 118 Ca 0.17 -0.41 -0.20 0.00 -0.13 0.00 0.00 59.36 58.79 3hm7 h GLU 118 Cb 0.45 0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.92 3hm7 h GLU 118 CO 0.02 1.10 -1.79 1.63 -0.73 0.00 0.00 179.01 179.24 3hm7 n LYS 119 N -3.69 1.93 -2.74 1.92 4.01 -1.17 -5.00 118.16 113.41 3hm7 n LYS 119 Ca -0.07 -0.02 -0.43 0.00 -0.51 0.00 0.00 58.31 57.29 3hm7 n LYS 119 Cb 0.87 -1.30 -0.03 0.00 -0.51 0.00 0.00 35.03 34.05 3hm7 n LYS 119 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 3hm7 s SER 120 N -4.38 7.03 0.16 4.39 0.15 -0.72 -4.07 113.70 116.27 3hm7 s SER 120 Ca -0.06 1.29 -0.06 0.00 0.70 0.00 0.00 55.95 57.82 3hm7 s SER 120 Cb 0.04 -2.51 0.01 0.00 -1.71 0.00 0.00 66.02 61.85 3hm7 s SER 120 CO 0.49 -0.59 1.43 0.25 1.20 0.00 0.00 173.24 176.02 3hm7 h LEU 121 N 9.16 0.72-10.34 3.45 5.85 -1.85 -3.47 115.31 118.83 3hm7 h LEU 121 Ca -0.22 -0.42 -0.59 0.00 0.84 0.00 0.00 57.88 57.49 3hm7 h LEU 121 Cb 1.08 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.85 3hm7 h LEU 121 CO 0.93 1.17 -0.31 0.68 -0.34 0.00 0.00 178.44 180.57 3hm7 s VAL 122 N -3.89 1.60 0.61 1.05 -7.23 -1.26 -5.00 120.40 106.28 3hm7 s VAL 122 Ca -0.08 -1.53 -0.16 0.00 -1.81 0.00 0.00 61.98 58.41 3hm7 s VAL 122 Cb 0.10 -2.13 -0.03 0.00 0.56 0.00 0.00 36.38 34.89 3hm7 s VAL 122 CO 0.86 0.00 1.07 -0.62 -0.31 0.00 0.00 175.10 176.10 3hm7 s ASP 123 N -4.26 5.63 0.01 4.85 3.68 -0.33 -4.97 116.67 121.28 3hm7 s ASP 123 Ca 0.32 1.87 -0.03 0.00 2.13 0.00 0.00 52.55 56.83 3hm7 s ASP 123 Cb -0.02 -2.54 -0.01 0.00 -1.45 0.00 0.00 42.92 38.90 3hm7 s ASP 123 CO 0.20 -1.27 0.05 -0.72 0.13 0.00 0.00 175.17 173.56 3hm7 s TYR 124 N -2.40 0.13 0.15 -5.34 -0.85 -1.26 -2.21 117.35 105.57 3hm7 s TYR 124 Ca 0.65 -0.29 0.01 0.00 -0.52 0.00 0.00 57.07 56.92 3hm7 s TYR 124 Cb -0.17 -0.11 -0.04 0.00 0.38 0.00 0.00 41.96 42.02 3hm7 s TYR 124 CO 0.38 -0.21 0.01 1.03 -1.52 0.00 0.00 175.55 175.23 3hm7 s ARG 125 N -1.26 1.00 -0.04 -3.49 1.81 -0.36 -4.95 118.95 111.67 3hm7 s ARG 125 Ca -0.14 -1.47 0.07 0.00 -1.72 0.00 0.00 55.73 52.47 3hm7 s ARG 125 Cb -0.08 -0.09 -0.02 0.00 -0.45 0.00 0.00 34.95 34.32 3hm7 s ARG 125 CO 0.00 -0.16 -0.25 -0.06 -0.68 0.00 0.00 175.30 174.15 3hm7 s PHE 126 N -3.78 2.38 -0.10 -0.53 0.40 -1.26 -1.45 117.98 113.63 3hm7 s PHE 126 Ca 0.22 -0.55 -0.24 0.00 -0.60 0.00 0.00 56.93 55.76 3hm7 s PHE 126 Cb 0.07 -1.54 -0.03 0.00 0.51 0.00 0.00 43.02 42.02 3hm7 s PHE 126 CO 0.02 -0.11 0.76 -1.58 0.70 0.00 0.00 175.22 175.01 3hm7 s TRP 127 N -0.43 3.52 0.74 0.36 0.52 -0.29 -2.23 118.94 121.12 3hm7 s TRP 127 Ca 0.05 1.27 -0.11 0.00 0.02 0.00 0.00 56.10 57.32 3hm7 s TRP 127 Cb -0.12 -2.90 0.03 0.00 -1.15 0.00 0.00 33.47 29.34 3hm7 s TRP 127 CO 0.01 -0.04 1.07 0.20 0.02 0.00 0.00 176.95 178.21 3hm7 s GLY 128 N 0.96 1.66 -0.00 0.98 0.00 0.83 -4.04 107.32 107.70 3hm7 s GLY 128 Ca 0.38 0.05 0.02 0.00 0.00 0.00 0.00 44.72 45.17 3hm7 s GLY 128 CO 0.17 0.39 -0.04 -0.32 0.00 0.00 0.00 173.10 173.30 3hm7 s GLY 129 N -3.74 1.81 -0.21 0.20 0.00 -0.91 -0.33 107.32 104.14 3hm7 s GLY 129 Ca 0.59 -0.98 0.01 0.00 0.00 0.00 0.00 44.72 44.34 3hm7 s GLY 129 CO 0.55 -0.84 -0.07 -2.27 0.00 0.00 0.00 173.10 170.46 3hm7 s LEU 130 N -1.45 2.26 0.16 0.66 2.96 0.61 -4.81 118.68 119.08 3hm7 s LEU 130 Ca 0.18 -0.95 0.05 0.00 -0.22 0.00 0.00 54.13 53.19 3hm7 s LEU 130 Cb -0.11 -1.15 -0.04 0.00 0.50 0.00 0.00 46.19 45.38 3hm7 s LEU 130 CO 0.08 -0.19 -0.11 0.68 -1.32 0.00 0.00 176.35 175.50 3hm7 s VAL 131 N 1.44 1.30 0.00 1.68 -7.23 -1.26 -4.40 120.40 111.94 3hm7 s VAL 131 Ca -0.03 -2.10 0.00 0.00 -1.81 0.00 0.00 61.98 58.05 3hm7 s VAL 131 Cb -0.17 -1.90 0.00 0.00 0.56 0.00 0.00 36.38 34.87 3hm7 s VAL 131 CO -0.07 -0.71 0.00 -2.65 -0.31 0.00 0.00 175.10 171.36 3hm7 n PRO 132 N -0.24 0.00 -3.32 4.82 -0.02 -1.26 -3.11 135.00 131.87 3hm7 n PRO 132 Ca -0.10 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.22 3hm7 n PRO 132 Cb 0.61 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 34.02 3hm7 n PRO 132 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3hm7 s GLY 133 N -1.92 -0.07 0.00 -1.23 0.00 -1.26 -4.69 107.32 98.15 3hm7 s GLY 133 Ca 0.00 -1.01 0.03 0.00 0.00 0.00 0.00 44.72 43.74 3hm7 s GLY 133 CO 0.00 2.79 0.89 1.16 0.00 0.00 0.00 173.10 177.95 3hm7 n ASN 134 N 4.05 0.07 0.32 1.64 6.94 -1.18 -4.89 115.26 122.20 3hm7 n ASN 134 Ca 0.13 -1.74 0.19 0.00 -0.02 0.00 0.00 54.58 53.15 3hm7 n ASN 134 Cb 0.47 -0.13 1.02 0.00 -2.36 0.00 0.00 39.78 38.77 3hm7 n ASN 134 CO 0.00 0.00 0.00 0.16 -1.03 0.00 0.00 177.26 176.39 3hm7 h ILE 135 N 6.35 0.09 -0.73 1.53 -0.00 -1.94 -0.36 117.51 122.45 3hm7 h ILE 135 Ca -0.07 0.00 0.07 0.00 -0.00 0.00 0.00 64.86 64.86 3hm7 h ILE 135 Cb 1.36 0.86 -0.05 0.00 -0.00 0.00 0.00 36.82 38.99 3hm7 h ILE 135 CO -0.01 0.00 0.48 0.44 -0.00 0.00 0.00 178.15 179.07 3hm7 h ASP 136 N 0.00 0.65 -0.35 2.16 3.32 -1.99 -3.18 116.42 117.03 3hm7 h ASP 136 Ca 0.01 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3hm7 h ASP 136 Cb 0.31 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.73 3hm7 h ASP 136 CO -0.00 0.41 0.00 1.41 -1.72 0.00 0.00 179.24 179.34 3hm7 n HIS 137 N -4.48 0.45 0.01 4.55 8.25 -0.15 -4.62 115.22 119.23 3hm7 n HIS 137 Ca 0.11 -0.30 -0.18 0.00 -0.26 0.00 0.00 57.72 57.09 3hm7 n HIS 137 Cb 0.25 -0.01 -0.12 0.00 1.12 0.00 0.00 29.99 31.23 3hm7 n HIS 137 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 3hm7 h LEU 138 N 3.35 0.47 -0.96 2.41 3.38 -1.56 -0.77 115.31 121.63 3hm7 h LEU 138 Ca 0.00 -0.82 -0.04 0.00 0.09 0.00 0.00 57.88 57.12 3hm7 h LEU 138 Cb 0.82 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.39 3hm7 h LEU 138 CO 0.00 1.23 0.29 -0.61 0.09 0.00 0.00 178.44 179.44 3hm7 h GLN 139 N -0.23 1.04 0.32 1.13 5.75 -1.82 -1.75 115.11 119.55 3hm7 h GLN 139 Ca -0.09 -0.17 -0.00 0.00 -0.15 0.00 0.00 58.65 58.24 3hm7 h GLN 139 Cb 1.36 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 29.71 3hm7 h GLN 139 CO 0.12 0.84 -0.29 0.22 -2.65 0.00 0.00 178.83 177.07 3hm7 h ASP 140 N 1.02 -0.77 -0.10 -0.69 -0.00 -1.81 -2.27 116.42 111.80 3hm7 h ASP 140 Ca 0.24 0.06 -0.03 0.00 -0.00 0.00 0.00 57.03 57.31 3hm7 h ASP 140 Cb 0.18 0.26 -0.01 0.00 -0.00 0.00 0.00 39.33 39.76 3hm7 h ASP 140 CO -0.02 -0.42 -0.01 -0.07 -0.00 0.00 0.00 179.24 178.72 3hm7 h LEU 141 N -0.63 0.26 -0.49 2.28 3.38 -1.04 -0.25 115.31 118.81 3hm7 h LEU 141 Ca -0.02 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.78 3hm7 h LEU 141 Cb 0.57 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3hm7 h LEU 141 CO -0.04 0.32 -0.23 -0.74 0.09 0.00 0.00 178.44 177.85 3hm7 h HIS 142 N 0.28 1.15 0.00 1.13 2.76 -1.18 -2.56 115.15 116.73 3hm7 h HIS 142 Ca 0.07 -0.28 0.00 0.00 -2.20 0.00 0.00 60.37 57.95 3hm7 h HIS 142 Cb 0.21 -0.27 0.00 0.00 1.55 0.00 0.00 27.41 28.90 3hm7 h HIS 142 CO 0.00 1.11 0.00 -0.44 -1.30 0.00 0.00 177.93 177.31 3hm7 h ASP 143 N 0.86 0.00 0.00 3.26 3.45 -1.11 -2.14 116.42 120.74 3hm7 h ASP 143 Ca 0.11 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.57 3hm7 h ASP 143 Cb 0.81 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.58 3hm7 h ASP 143 CO 0.07 0.00 0.00 0.61 -1.57 0.00 0.00 179.24 178.35 3hm7 n GLY 144 N 0.83 -0.79 2.02 2.75 0.00 -0.13 -4.90 105.19 104.96 3hm7 n GLY 144 Ca 0.03 -0.04 -0.01 0.00 0.00 0.00 0.00 46.02 46.00 3hm7 n GLY 144 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hm7 n GLY 145 N 0.37 0.40 3.75 -0.02 0.00 -0.81 -5.02 105.19 103.87 3hm7 n GLY 145 Ca 0.05 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.77 3hm7 n GLY 145 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hm7 s VAL 146 N -2.04 2.91 -0.51 1.61 -7.23 -1.15 -4.72 120.40 109.27 3hm7 s VAL 146 Ca 0.00 0.46 0.23 0.00 -1.81 0.00 0.00 61.98 60.86 3hm7 s VAL 146 Cb 0.00 -3.01 -0.04 0.00 0.56 0.00 0.00 36.38 33.89 3hm7 s VAL 146 CO 0.00 -0.23 1.11 2.30 -0.31 0.00 0.00 175.10 177.97 3hm7 n ILE 147 N -2.31 0.34 -1.33 -0.62 -6.64 -0.95 -4.92 119.36 102.94 3hm7 n ILE 147 Ca 0.12 -0.34 0.00 0.00 -1.77 0.00 0.00 62.75 60.76 3hm7 n ILE 147 Cb 0.51 -0.05 0.00 0.00 -1.44 0.00 0.00 39.64 38.66 3hm7 n ILE 147 CO 0.00 0.00 0.00 0.61 -1.77 0.00 0.00 176.55 175.39 3hm7 n GLY 148 N 1.31 -1.23 3.27 3.28 0.00 -1.26 -4.67 105.19 105.88 3hm7 n GLY 148 Ca 0.02 -0.94 -0.23 0.00 0.00 0.00 0.00 46.02 44.86 3hm7 n GLY 148 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hm7 s PHE 149 N -2.43 1.69 0.01 1.61 0.40 -0.23 -0.12 117.98 118.90 3hm7 s PHE 149 Ca 0.00 -0.43 0.07 0.00 -0.60 0.00 0.00 56.93 55.97 3hm7 s PHE 149 Cb 0.00 -0.93 -0.02 0.00 0.51 0.00 0.00 43.02 42.58 3hm7 s PHE 149 CO 0.00 0.18 -0.21 0.21 0.70 0.00 0.00 175.22 176.10 3hm7 s LYS 150 N -1.90 1.57 0.05 0.44 2.20 0.55 -0.48 119.74 122.18 3hm7 s LYS 150 Ca 0.05 -0.86 0.02 0.00 -0.36 0.00 0.00 55.97 54.82 3hm7 s LYS 150 Cb -0.10 -1.60 -0.03 0.00 -1.51 0.00 0.00 37.83 34.59 3hm7 s LYS 150 CO 0.04 0.42 -0.07 0.00 -0.36 0.00 0.00 175.35 175.38 3hm7 s ALA 151 N -0.65 0.64 -0.05 3.13 0.00 -0.87 -0.29 121.76 123.67 3hm7 s ALA 151 Ca 0.08 -0.91 -0.02 0.00 0.00 0.00 0.00 51.96 51.11 3hm7 s ALA 151 Cb -0.08 0.09 -0.04 0.00 0.00 0.00 0.00 23.12 23.08 3hm7 s ALA 151 CO 0.01 -0.09 0.06 -0.06 0.00 0.00 0.00 175.76 175.68 3hm7 s PHE 152 N -2.01 3.30 -1.68 0.00 0.40 -1.26 -2.24 117.98 114.49 3hm7 s PHE 152 Ca -0.05 0.26 0.16 0.00 -0.60 0.00 0.00 56.93 56.70 3hm7 s PHE 152 Cb -0.06 -1.79 0.05 0.00 0.51 0.00 0.00 43.02 41.74 3hm7 s PHE 152 CO -0.01 0.56 0.91 -1.33 0.70 0.00 0.00 175.22 176.04 3hm7 n MET 153 N 1.64 1.53 -4.94 0.44 2.81 -1.06 -0.03 117.12 117.51 3hm7 n MET 153 Ca -0.16 -1.08 -0.31 0.00 -1.81 0.00 0.00 57.70 54.34 3hm7 n MET 153 Cb 0.53 -1.28 -0.14 0.00 -0.71 0.00 0.00 33.22 31.63 3hm7 n MET 153 CO 0.00 0.00 0.00 -1.12 1.51 0.00 0.00 175.97 176.36 3hm7 s SER 154 N -1.63 3.50 -1.06 7.83 0.01 -1.25 -3.42 113.70 117.68 3hm7 s SER 154 Ca 0.15 -0.43 -0.25 0.00 1.31 0.00 0.00 55.95 56.74 3hm7 s SER 154 Cb 0.13 -0.51 -0.13 0.00 0.21 0.00 0.00 66.02 65.71 3hm7 s SER 154 CO 0.31 0.29 2.06 -1.61 0.41 0.00 0.00 173.24 174.70 3hm7 s GLU 155 N -1.02 1.94 0.34 12.44 2.02 -1.26 -4.46 118.70 128.69 3hm7 s GLU 155 Ca 0.12 -0.57 -0.16 0.00 0.02 0.00 0.00 54.97 54.38 3hm7 s GLU 155 Cb -0.10 -5.07 0.03 0.00 0.10 0.00 0.00 34.13 29.09 3hm7 s GLU 155 CO 0.02 -4.47 0.71 0.00 0.02 0.00 0.00 175.26 171.54 3hm7 n GLY 157 N -0.50 1.16 0.00 0.00 0.00 -1.26 -4.62 105.19 99.96 3hm7 n GLY 157 Ca -0.05 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.38 3hm7 n GLY 157 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3hm7 n THR 158 N 0.00 0.00 0.00 2.61 -2.24 -1.26 -4.83 114.28 108.56 3hm7 n THR 158 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3hm7 n THR 158 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 3hm7 n THR 158 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3hm7 n ASP 159 N -0.79 2.79 -0.12 3.42 4.64 -1.26 -4.97 116.55 120.27 3hm7 n ASP 159 Ca 0.00 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.41 3hm7 n ASP 159 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.08 3hm7 n ASP 159 CO 0.00 0.00 0.00 -0.67 -0.82 0.00 0.00 177.20 175.71 3hm7 n ASP 160 N -2.58 0.00 -3.97 1.67 2.03 -1.26 -4.53 116.55 107.90 3hm7 n ASP 160 Ca 0.00 -1.18 -0.42 0.00 0.52 0.00 0.00 54.79 53.71 3hm7 n ASP 160 Cb 0.47 -0.04 0.00 0.00 -0.72 0.00 0.00 41.12 40.84 3hm7 n ASP 160 CO 0.00 0.00 0.00 0.33 -1.92 0.00 0.00 177.20 175.61 3hm7 n PHE 161 N 0.00 3.85 -2.13 -0.67 7.35 -1.26 -4.90 117.46 119.69 3hm7 n PHE 161 Ca 0.00 -2.94 -0.38 0.00 -0.76 0.00 0.00 57.45 53.37 3hm7 n PHE 161 Cb 0.54 -2.56 -0.00 0.00 0.35 0.00 0.00 39.48 37.80 3hm7 n PHE 161 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 3hm7 s GLN 162 N 3.37 3.82 0.52 -4.13 -0.21 -1.26 -4.55 119.66 117.22 3hm7 s GLN 162 Ca 0.49 1.98 -0.22 0.00 0.02 0.00 0.00 55.36 57.63 3hm7 s GLN 162 Cb 0.11 -2.57 -0.06 0.00 1.00 0.00 0.00 33.01 31.49 3hm7 s GLN 162 CO -0.04 -0.56 1.25 -0.59 -2.12 0.00 0.00 175.29 173.23 3hm7 s PHE 163 N -1.39 2.55 -0.32 0.91 -0.71 -1.26 -4.46 117.98 113.31 3hm7 s PHE 163 Ca 0.61 1.47 -0.18 0.00 -1.04 0.00 0.00 56.93 57.78 3hm7 s PHE 163 Cb -0.34 -3.56 -0.01 0.00 -1.21 0.00 0.00 43.02 37.90 3hm7 s PHE 163 CO 0.42 -2.17 0.54 -1.12 -1.34 0.00 0.00 175.22 171.54 3hm7 s SER 164 N -1.26 6.37 0.94 1.98 0.01 0.96 -4.51 113.70 118.19 3hm7 s SER 164 Ca 0.69 0.19 -0.14 0.00 1.31 0.00 0.00 55.95 58.00 3hm7 s SER 164 Cb -0.33 -2.28 0.16 0.00 0.21 0.00 0.00 66.02 63.78 3hm7 s SER 164 CO 0.39 -0.43 1.22 -1.38 0.41 0.00 0.00 173.24 173.44 3hm7 s HIS 165 N 2.42 2.03 0.40 2.43 -3.43 -1.26 -4.64 115.29 113.25 3hm7 s HIS 165 Ca 0.21 0.58 0.15 0.00 -0.80 0.00 0.00 55.06 55.20 3hm7 s HIS 165 Cb -0.15 -3.70 1.01 0.00 -1.43 0.00 0.00 32.58 28.30 3hm7 s HIS 165 CO 0.12 -2.51 1.86 -0.44 -2.00 0.00 0.00 174.74 171.77 3hm7 h ASP 166 N -1.57 0.48 -0.19 7.38 5.19 -1.98 0.06 116.42 125.79 3hm7 h ASP 166 Ca -0.46 0.05 -0.03 0.00 -0.62 0.00 0.00 57.03 55.97 3hm7 h ASP 166 Cb 1.29 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 40.75 3hm7 h ASP 166 CO 0.51 0.20 0.02 -0.08 -3.12 0.00 0.00 179.24 176.76 3hm7 h GLU 167 N 0.48 0.32 -0.12 3.56 4.22 -1.99 -2.24 114.58 118.80 3hm7 h GLU 167 Ca 0.47 -0.09 -0.02 0.00 0.08 0.00 0.00 59.36 59.79 3hm7 h GLU 167 Cb 1.05 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.27 3hm7 h GLU 167 CO -0.19 0.50 -0.01 1.15 -2.18 0.00 0.00 179.01 178.27 3hm7 h THR 168 N 0.09 1.27 -0.37 0.32 2.02 -1.51 -2.65 112.91 112.07 3hm7 h THR 168 Ca 0.05 -0.89 0.07 0.00 0.77 0.00 0.00 66.41 66.42 3hm7 h THR 168 Cb 0.35 1.62 -0.06 0.00 -1.74 0.00 0.00 68.15 68.31 3hm7 h THR 168 CO 0.01 0.26 -0.04 -0.07 0.37 0.00 0.00 175.52 176.05 3hm7 h LEU 169 N -0.06 -0.22 -0.56 2.58 3.38 -1.05 0.26 115.31 119.63 3hm7 h LEU 169 Ca 0.03 0.10 -0.15 0.00 0.09 0.00 0.00 57.88 57.95 3hm7 h LEU 169 Cb 0.40 0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 3hm7 h LEU 169 CO 0.01 -0.07 -0.50 -0.07 0.09 0.00 0.00 178.44 177.90 3hm7 h LEU 170 N 0.06 0.63 -0.50 1.67 3.38 -1.45 -0.93 115.31 118.17 3hm7 h LEU 170 Ca 0.18 -0.32 -0.13 0.00 0.09 0.00 0.00 57.88 57.70 3hm7 h LEU 170 Cb 0.26 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3hm7 h LEU 170 CO -0.33 1.02 -0.19 0.11 0.09 0.00 0.00 178.44 179.14 3hm7 h LYS 171 N 0.45 1.02 0.22 1.13 1.57 -1.23 -2.66 116.57 117.06 3hm7 h LYS 171 Ca 0.02 -0.42 -0.01 0.00 -1.87 0.00 0.00 60.65 58.37 3hm7 h LYS 171 Cb 1.03 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.30 3hm7 h LYS 171 CO 0.10 1.11 -0.10 0.78 -0.57 0.00 0.00 179.45 180.76 3hm7 h GLY 172 N 0.88 -0.30 1.17 3.86 0.00 -0.81 -3.18 103.07 104.69 3hm7 h GLY 172 Ca 0.12 0.11 0.04 0.00 0.00 0.00 0.00 47.33 47.60 3hm7 h GLY 172 CO 0.06 -0.11 0.46 -0.33 0.00 0.00 0.00 176.54 176.62 3hm7 h MET 173 N -0.49 0.77 -0.50 4.80 2.86 -1.22 -0.42 114.93 120.72 3hm7 h MET 173 Ca -0.03 -0.05 0.05 0.00 -2.06 0.00 0.00 59.70 57.61 3hm7 h MET 173 Cb 0.37 -0.17 -0.04 0.00 0.06 0.00 0.00 31.60 31.81 3hm7 h MET 173 CO 0.05 0.51 0.25 -0.22 1.06 0.00 0.00 176.91 178.56 3hm7 h LYS 174 N 0.80 0.47 -0.00 1.72 3.64 -1.50 -1.59 116.57 120.10 3hm7 h LYS 174 Ca 0.28 -0.03 -0.21 0.00 -1.27 0.00 0.00 60.65 59.42 3hm7 h LYS 174 Cb 0.12 -0.11 0.02 0.00 -0.41 0.00 0.00 32.23 31.85 3hm7 h LYS 174 CO -0.08 0.31 -0.82 -0.22 -2.27 0.00 0.00 179.45 176.36 3hm7 h LYS 175 N 0.48 0.56 -0.88 1.90 3.64 -1.31 -3.11 116.57 117.85 3hm7 h LYS 175 Ca 0.22 -0.60 0.04 0.00 -1.27 0.00 0.00 60.65 59.04 3hm7 h LYS 175 Cb 0.14 0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.08 3hm7 h LYS 175 CO -0.16 1.22 0.58 0.82 -2.27 0.00 0.00 179.45 179.63 3hm7 h ILE 176 N 0.15 1.14 -0.56 2.00 2.04 -1.04 0.51 117.51 121.75 3hm7 h ILE 176 Ca -0.10 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 65.40 3hm7 h ILE 176 Cb 1.50 -0.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 3hm7 h ILE 176 CO 0.16 0.20 0.36 0.00 0.00 0.00 0.00 178.15 178.87 3hm7 h ALA 177 N 1.49 0.72 0.00 1.87 0.00 -1.36 -2.26 119.26 119.72 3hm7 h ALA 177 Ca 0.35 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.15 3hm7 h ALA 177 Cb 0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3hm7 h ALA 177 CO -0.11 0.12 -0.40 0.00 0.00 0.00 0.00 179.25 178.86 3hm7 h ALA 178 N 1.22 1.20 0.00 0.00 0.00 -1.18 -2.25 119.26 118.24 3hm7 h ALA 178 Ca 0.21 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3hm7 h ALA 178 Cb -0.05 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3hm7 h ALA 178 CO -0.06 0.50 0.00 1.28 0.00 0.00 0.00 179.25 180.97 3hm7 n LEU 179 N -3.86 0.45 -0.55 0.00 4.77 0.06 -4.93 117.00 112.94 3hm7 n LEU 179 Ca -0.01 0.56 -0.05 0.00 -0.03 0.00 0.00 56.01 56.47 3hm7 n LEU 179 Cb 0.46 -0.43 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 3hm7 n LEU 179 CO 0.38 -0.18 -0.06 0.61 -1.33 0.00 0.00 177.39 176.81 3hm7 n GLY 180 N 1.08 0.40 0.00 -0.72 0.00 -0.85 -5.03 105.19 100.08 3hm7 n GLY 180 Ca 0.05 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.36 3hm7 n GLY 180 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3hm7 n SER 181 N 1.01 0.00 -3.65 1.61 3.41 -0.93 -5.05 113.62 110.02 3hm7 n SER 181 Ca -0.06 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.40 3hm7 n SER 181 Cb 0.41 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.28 3hm7 n SER 181 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 175.04 174.37 3hm7 s ILE 182 N 4.33 0.01 -0.18 -1.33 2.07 -1.26 -4.38 121.20 120.46 3hm7 s ILE 182 Ca 0.00 -0.06 -0.02 0.00 -1.41 0.00 0.00 60.65 59.16 3hm7 s ILE 182 Cb 0.00 -0.83 -0.01 0.00 0.13 0.00 0.00 42.46 41.76 3hm7 s ILE 182 CO 0.00 -0.03 -0.10 -0.22 -1.91 0.00 0.00 174.94 172.68 3hm7 s LEU 183 N -0.25 2.72 0.04 8.50 2.96 -0.70 -1.07 118.68 130.89 3hm7 s LEU 183 Ca -0.04 -0.40 -0.08 0.00 -0.22 0.00 0.00 54.13 53.38 3hm7 s LEU 183 Cb -0.03 -1.65 -0.05 0.00 0.50 0.00 0.00 46.19 44.95 3hm7 s LEU 183 CO 0.03 0.05 0.34 0.00 -1.32 0.00 0.00 176.35 175.45 3hm7 s ALA 184 N 1.03 3.78 0.02 5.97 0.00 0.36 -0.59 121.76 132.33 3hm7 s ALA 184 Ca -0.00 -0.47 0.04 0.00 0.00 0.00 0.00 51.96 51.53 3hm7 s ALA 184 Cb -0.15 -2.18 -0.02 0.00 0.00 0.00 0.00 23.12 20.78 3hm7 s ALA 184 CO -0.02 0.60 -0.12 0.14 0.00 0.00 0.00 175.76 176.37 3hm7 s VAL 185 N -1.35 0.95 -0.59 0.00 -7.23 -0.63 -2.05 120.40 109.50 3hm7 s VAL 185 Ca 0.30 -0.75 -0.25 0.00 -1.81 0.00 0.00 61.98 59.47 3hm7 s VAL 185 Cb -0.14 -0.84 0.04 0.00 0.56 0.00 0.00 36.38 36.00 3hm7 s VAL 185 CO 0.17 0.09 1.04 -2.28 -0.31 0.00 0.00 175.10 173.82 3hm7 s HIS 186 N -0.60 2.68 -1.19 2.82 5.65 -0.95 -2.03 115.29 121.67 3hm7 s HIS 186 Ca 0.02 0.03 -0.10 0.00 0.25 0.00 0.00 55.06 55.26 3hm7 s HIS 186 Cb -0.06 -4.27 0.21 0.00 -1.18 0.00 0.00 32.58 27.28 3hm7 s HIS 186 CO 0.00 -1.53 1.53 0.00 -0.65 0.00 0.00 174.74 174.10 3hm7 n ALA 187 N 7.94 4.65 -2.58 1.58 0.00 -1.26 -2.55 120.51 128.29 3hm7 n ALA 187 Ca 0.03 -4.45 -0.22 0.00 0.00 0.00 0.00 53.44 48.80 3hm7 n ALA 187 Cb 0.48 -2.80 -0.13 0.00 0.00 0.00 0.00 19.45 17.00 3hm7 n ALA 187 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3hm7 s GLU 188 N -0.11 1.07 -0.45 0.00 2.02 -1.26 -4.31 118.70 115.65 3hm7 s GLU 188 Ca 0.38 -1.03 -0.26 0.00 0.02 0.00 0.00 54.97 54.07 3hm7 s GLU 188 Cb 0.01 -1.23 0.03 0.00 0.10 0.00 0.00 34.13 33.04 3hm7 s GLU 188 CO 0.01 0.29 0.95 0.45 0.02 0.00 0.00 175.26 176.98 3hm7 s SER 189 N -1.67 6.53 0.16 -0.19 0.15 -1.07 -3.85 113.70 113.76 3hm7 s SER 189 Ca 0.04 0.21 -0.20 0.00 0.70 0.00 0.00 55.95 56.70 3hm7 s SER 189 Cb -0.10 -2.47 0.06 0.00 -1.71 0.00 0.00 66.02 61.80 3hm7 s SER 189 CO 0.03 -1.06 1.64 -1.13 1.20 0.00 0.00 173.24 173.92 3hm7 h ASN 190 N 9.04 -0.64 1.06 5.45 -1.24 -1.92 -1.10 115.58 126.22 3hm7 h ASN 190 Ca -0.24 0.13 -0.20 0.00 0.71 0.00 0.00 56.30 56.71 3hm7 h ASN 190 Cb 1.07 0.33 -0.03 0.00 0.73 0.00 0.00 38.32 40.42 3hm7 h ASN 190 CO 1.04 -0.23 -0.95 -0.33 -1.29 0.00 0.00 177.43 175.67 3hm7 h GLU 191 N -0.16 0.00 -0.81 6.67 4.39 -1.93 -2.81 114.58 119.92 3hm7 h GLU 191 Ca 0.16 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.83 3hm7 h GLU 191 Cb 0.41 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.02 3hm7 h GLU 191 CO -0.40 0.91 0.40 0.52 -1.16 0.00 0.00 179.01 179.27 3hm7 h MET 192 N 0.00 1.17 0.82 2.33 2.86 -1.91 -2.83 114.93 117.37 3hm7 h MET 192 Ca -0.02 -0.17 -0.04 0.00 -2.06 0.00 0.00 59.70 57.41 3hm7 h MET 192 Cb 1.72 -0.21 0.01 0.00 0.06 0.00 0.00 31.60 33.17 3hm7 h MET 192 CO 0.12 0.90 -0.39 0.28 1.06 0.00 0.00 176.91 178.87 3hm7 h VAL 193 N 1.15 0.00 -0.32 -2.22 2.07 -1.10 -3.03 116.25 112.79 3hm7 h VAL 193 Ca 0.28 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.71 3hm7 h VAL 193 Cb 0.11 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.88 3hm7 h VAL 193 CO -0.04 0.00 0.00 -0.46 0.02 0.00 0.00 177.57 177.09 3hm7 n ASN 194 N -5.22 2.04 -0.12 0.57 2.04 -1.07 -1.63 115.26 111.88 3hm7 n ASN 194 Ca -0.14 -2.08 -0.18 0.00 -0.44 0.00 0.00 54.58 51.75 3hm7 n ASN 194 Cb 0.43 -0.29 -0.12 0.00 -2.53 0.00 0.00 39.78 37.27 3hm7 n ASN 194 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3hm7 n ALA 195 N 0.44 1.41 0.18 -2.53 0.00 -1.07 -3.91 120.51 115.04 3hm7 n ALA 195 Ca 0.11 -1.09 0.05 0.00 0.00 0.00 0.00 53.44 52.51 3hm7 n ALA 195 Cb 0.35 -0.15 0.26 0.00 0.00 0.00 0.00 19.45 19.91 3hm7 n ALA 195 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3hm7 h LEU 196 N 0.00 0.00 -0.11 0.00 3.38 -1.45 -2.67 115.31 114.46 3hm7 h LEU 196 Ca -0.57 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.32 3hm7 h LEU 196 Cb 1.94 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.69 3hm7 h LEU 196 CO -0.07 0.40 -0.26 0.74 0.09 0.00 0.00 178.44 179.34 3hm7 h THR 197 N 0.00 1.39 -0.44 0.22 2.02 -1.51 -2.73 112.91 111.86 3hm7 h THR 197 Ca -0.00 -1.57 0.02 0.00 0.77 0.00 0.00 66.41 65.63 3hm7 h THR 197 Cb 1.03 2.14 -0.03 0.00 -1.74 0.00 0.00 68.15 69.55 3hm7 h THR 197 CO 0.05 0.46 0.25 0.74 0.37 0.00 0.00 175.52 177.39 3hm7 h THR 198 N -0.08 1.03 -0.47 3.16 2.02 -1.67 -2.02 112.91 114.88 3hm7 h THR 198 Ca -0.00 -0.17 -0.00 0.00 0.77 0.00 0.00 66.41 67.00 3hm7 h THR 198 Cb 0.87 0.48 -0.02 0.00 -1.74 0.00 0.00 68.15 67.74 3hm7 h THR 198 CO 0.06 0.09 0.28 0.40 0.37 0.00 0.00 175.52 176.72 3hm7 h ILE 199 N 0.51 1.15 0.00 3.11 2.04 -1.54 -2.87 117.51 119.91 3hm7 h ILE 199 Ca 0.18 -0.34 -0.05 0.00 1.00 0.00 0.00 64.86 65.64 3hm7 h ILE 199 Cb 0.03 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 3hm7 h ILE 199 CO -0.09 0.15 -0.25 0.00 0.00 0.00 0.00 178.15 177.96 3hm7 h ALA 200 N 1.13 1.07 -0.04 1.87 0.00 -1.31 -2.72 119.26 119.26 3hm7 h ALA 200 Ca 0.17 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3hm7 h ALA 200 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3hm7 h ALA 200 CO -0.03 0.31 -0.11 0.82 0.00 0.00 0.00 179.25 180.24 3hm7 h ILE 201 N 0.00 1.45 -0.07 0.00 2.04 -1.17 -2.81 117.51 116.95 3hm7 h ILE 201 Ca -0.00 -1.49 -0.07 0.00 1.00 0.00 0.00 64.86 64.30 3hm7 h ILE 201 Cb 0.71 2.33 -0.01 0.00 -0.74 0.00 0.00 36.82 39.12 3hm7 h ILE 201 CO 0.03 0.41 -0.27 -0.33 0.00 0.00 0.00 178.15 177.98 3hm7 h GLU 202 N -0.40 0.12 -0.68 2.37 3.07 -1.45 -3.03 114.58 114.58 3hm7 h GLU 202 Ca -0.00 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.82 3hm7 h GLU 202 Cb 0.71 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.61 3hm7 h GLU 202 CO 0.02 0.39 0.00 0.39 -1.40 0.00 0.00 179.01 178.41 3hm7 n GLU 203 N -4.17 3.33 -1.28 2.33 1.02 -1.03 -4.92 120.64 115.91 3hm7 n GLU 203 Ca -0.02 -2.04 -0.11 0.00 -0.02 0.00 0.00 57.16 54.97 3hm7 n GLU 203 Cb 0.35 -1.89 -0.05 0.00 -0.02 0.00 0.00 31.44 29.83 3hm7 n GLU 203 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 3hm7 n GLN 204 N 0.52 -1.61 -2.77 3.49 1.13 -1.15 -4.91 117.38 112.09 3hm7 n GLN 204 Ca 0.18 0.83 -0.43 0.00 -1.94 0.00 0.00 57.00 55.64 3hm7 n GLN 204 Cb 0.79 -5.10 -0.03 0.00 0.11 0.00 0.00 30.24 26.01 3hm7 n GLN 204 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 3hm7 s ARG 205 N -2.86 3.37 0.00 -1.09 0.52 -1.06 -4.82 118.95 113.01 3hm7 s ARG 205 Ca 0.00 -1.09 0.01 0.00 -0.52 0.00 0.00 55.73 54.14 3hm7 s ARG 205 Cb 0.00 -4.66 0.04 0.00 0.52 0.00 0.00 34.95 30.84 3hm7 s ARG 205 CO 0.00 -1.94 1.00 1.28 0.02 0.00 0.00 175.30 175.67 3hm7 n LEU 206 N 7.85 2.05 -4.77 2.53 4.77 -1.26 -4.69 117.00 123.48 3hm7 n LEU 206 Ca 0.13 -1.94 -0.29 0.00 -0.03 0.00 0.00 56.01 53.88 3hm7 n LEU 206 Cb 0.48 -0.03 0.12 0.00 -2.33 0.00 0.00 43.42 41.67 3hm7 n LEU 206 CO 0.61 0.51 0.70 0.42 -1.33 0.00 0.00 177.39 178.30 3hm7 s THR 207 N -0.94 2.54 0.20 -5.08 -4.23 -1.26 -4.41 115.64 102.46 3hm7 s THR 207 Ca 0.03 0.18 0.22 0.00 -1.18 0.00 0.00 61.69 60.94 3hm7 s THR 207 Cb 0.01 -2.84 0.20 0.00 1.34 0.00 0.00 72.50 71.21 3hm7 s THR 207 CO 0.02 -0.23 1.83 -0.37 -0.54 0.00 0.00 174.62 175.33 3hm7 h VAL 208 N -1.40 0.70 -0.27 2.29 -1.51 -1.95 -1.58 116.25 112.53 3hm7 h VAL 208 Ca -0.49 -1.17 -0.10 0.00 -1.23 0.00 0.00 66.70 63.70 3hm7 h VAL 208 Cb 1.30 1.75 -0.01 0.00 -2.13 0.00 0.00 31.29 32.20 3hm7 h VAL 208 CO 0.59 0.26 -0.26 0.50 -1.23 0.00 0.00 177.57 177.43 3hm7 h LYS 209 N 0.00 0.53 -0.05 5.19 3.64 -1.93 -0.43 116.57 123.53 3hm7 h LYS 209 Ca -0.00 -0.21 -0.14 0.00 -1.27 0.00 0.00 60.65 59.03 3hm7 h LYS 209 Cb 0.73 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.51 3hm7 h LYS 209 CO 0.03 0.74 -0.61 -0.44 -2.27 0.00 0.00 179.45 176.91 3hm7 h ASP 210 N 0.46 0.20 -0.23 4.20 3.32 -1.63 -0.41 116.42 122.34 3hm7 h ASP 210 Ca 0.07 -0.11 -0.20 0.00 0.02 0.00 0.00 57.03 56.80 3hm7 h ASP 210 Cb 0.70 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.19 3hm7 h ASP 210 CO 0.05 0.76 -0.62 0.22 -1.72 0.00 0.00 179.24 177.93 3hm7 h TYR 211 N 0.13 1.08 -0.70 4.55 3.20 -1.26 -2.11 116.97 121.86 3hm7 h TYR 211 Ca -0.01 -0.41 -0.03 0.00 3.14 0.00 0.00 58.73 61.42 3hm7 h TYR 211 Cb 1.10 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 39.15 3hm7 h TYR 211 CO 0.02 1.24 0.31 1.03 -1.64 0.00 0.00 178.16 179.12 3hm7 h SER 212 N 0.62 0.93 1.38 -2.11 0.87 -0.85 -2.25 113.55 112.14 3hm7 h SER 212 Ca -0.01 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.40 3hm7 h SER 212 Cb 1.23 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.95 3hm7 h SER 212 CO 0.13 0.83 0.00 -0.33 -0.53 0.00 0.00 176.83 176.93 3hm7 h GLU 213 N 0.98 0.00 -0.03 2.24 5.08 -1.11 -3.16 114.58 118.58 3hm7 h GLU 213 Ca 0.24 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.45 3hm7 h GLU 213 Cb 0.16 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3hm7 h GLU 213 CO -0.03 0.00 -0.65 0.00 -1.00 0.00 0.00 179.01 177.34 3hm7 h ALA 214 N 2.27 0.86 -2.43 3.43 0.00 -0.77 -3.31 119.26 119.32 3hm7 h ALA 214 Ca 0.00 -0.58 -0.60 0.00 0.00 0.00 0.00 54.91 53.73 3hm7 h ALA 214 Cb 0.69 -0.09 -0.42 0.00 0.00 0.00 0.00 17.79 17.97 3hm7 h ALA 214 CO 0.00 0.78 -0.60 0.54 0.00 0.00 0.00 179.25 179.97 3hm7 n ARG 215 N -3.81 2.29 -1.88 0.00 1.74 -1.12 -4.41 116.66 109.48 3hm7 n ARG 215 Ca -0.02 -4.59 -0.30 0.00 -0.77 0.00 0.00 57.85 52.18 3hm7 n ARG 215 Cb 0.64 -2.24 0.19 0.00 -1.02 0.00 0.00 32.46 30.03 3hm7 n ARG 215 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3hm7 s PRO 216 N -2.17 0.56 0.30 5.56 0.04 -1.23 -4.55 135.00 133.51 3hm7 s PRO 216 Ca 0.36 -0.37 0.03 0.00 0.04 0.00 0.00 61.00 61.06 3hm7 s PRO 216 Cb 0.10 -1.83 0.48 0.00 0.04 0.00 0.00 34.50 33.29 3hm7 s PRO 216 CO -0.06 -2.48 1.78 0.82 0.04 0.00 0.00 177.00 177.11 3hm7 h ILE 217 N -1.69 1.24 0.00 0.56 2.04 -1.94 -2.51 117.51 115.22 3hm7 h ILE 217 Ca -0.44 -1.09 -0.03 0.00 1.00 0.00 0.00 64.86 64.29 3hm7 h ILE 217 Cb 1.24 1.20 -0.00 0.00 -0.74 0.00 0.00 36.82 38.52 3hm7 h ILE 217 CO 0.39 0.35 -0.17 0.58 0.00 0.00 0.00 178.15 179.30 3hm7 h VAL 218 N 0.45 1.07 -0.49 1.67 2.07 -1.99 -0.47 116.25 118.57 3hm7 h VAL 218 Ca 0.08 -0.58 -0.10 0.00 0.82 0.00 0.00 66.70 66.92 3hm7 h VAL 218 Cb 0.54 1.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.61 3hm7 h VAL 218 CO 0.03 0.16 -0.11 -1.28 0.02 0.00 0.00 177.57 176.40 3hm7 h SER 219 N 0.00 0.89 -0.26 0.57 0.87 -1.80 -1.12 113.55 112.70 3hm7 h SER 219 Ca -0.00 -0.28 -0.04 0.00 -1.23 0.00 0.00 61.79 60.24 3hm7 h SER 219 Cb 0.30 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.01 3hm7 h SER 219 CO 0.02 1.01 0.02 -0.33 -0.53 0.00 0.00 176.83 177.02 3hm7 h GLU 220 N 0.80 0.45 -0.52 2.24 5.08 -1.20 -2.62 114.58 118.81 3hm7 h GLU 220 Ca 0.13 -0.13 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 3hm7 h GLU 220 Cb 0.63 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 3hm7 h GLU 220 CO 0.04 0.60 0.34 -0.07 -1.00 0.00 0.00 179.01 178.92 3hm7 h LEU 221 N 0.25 0.57 -0.27 1.33 3.38 -1.02 0.47 115.31 120.02 3hm7 h LEU 221 Ca 0.08 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3hm7 h LEU 221 Cb 0.38 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 3hm7 h LEU 221 CO 0.01 0.41 0.17 -0.08 0.09 0.00 0.00 178.44 179.05 3hm7 h GLU 222 N 0.68 0.35 -0.11 1.13 4.22 -1.21 -0.63 114.58 119.02 3hm7 h GLU 222 Ca 0.20 -0.02 -0.02 0.00 0.08 0.00 0.00 59.36 59.59 3hm7 h GLU 222 Cb -0.06 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 3hm7 h GLU 222 CO -0.05 0.25 -0.02 0.00 -2.18 0.00 0.00 179.01 177.01 3hm7 h ALA 223 N 1.09 0.15 -0.13 2.92 0.00 -1.23 -1.11 119.26 120.95 3hm7 h ALA 223 Ca 0.10 -0.21 0.04 0.00 0.00 0.00 0.00 54.91 54.84 3hm7 h ALA 223 Cb -0.03 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 3hm7 h ALA 223 CO -0.02 -0.13 -0.10 0.28 0.00 0.00 0.00 179.25 179.27 3hm7 h VAL 224 N -0.10 0.70 -0.45 0.00 2.07 -0.88 -1.24 116.25 116.35 3hm7 h VAL 224 Ca 0.03 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.63 3hm7 h VAL 224 Cb 0.41 0.70 -0.06 0.00 -1.52 0.00 0.00 31.29 30.82 3hm7 h VAL 224 CO 0.01 0.00 0.07 -0.33 0.02 0.00 0.00 177.57 177.34 3hm7 h GLU 225 N -0.11 0.19 0.04 1.57 5.08 -1.06 -0.13 114.58 120.16 3hm7 h GLU 225 Ca 0.08 -0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 3hm7 h GLU 225 Cb 0.24 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 3hm7 h GLU 225 CO -0.20 0.13 -0.09 -0.09 -1.00 0.00 0.00 179.01 177.76 3hm7 h ARG 226 N 0.20 -0.16 -0.26 2.33 2.43 -0.89 -2.32 114.38 115.72 3hm7 h ARG 226 Ca 0.22 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.37 3hm7 h ARG 226 Cb 0.30 0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.87 3hm7 h ARG 226 CO -0.31 -0.11 0.03 0.97 -1.51 0.00 0.00 179.97 179.04 3hm7 h ILE 227 N -0.17 1.14 -0.35 1.20 6.09 -0.96 -2.02 117.51 122.44 3hm7 h ILE 227 Ca 0.02 -0.54 -0.07 0.00 -1.37 0.00 0.00 64.86 62.90 3hm7 h ILE 227 Cb 0.19 0.92 -0.02 0.00 0.47 0.00 0.00 36.82 38.38 3hm7 h ILE 227 CO -0.06 0.19 -0.08 -0.07 -3.07 0.00 0.00 178.15 175.06 3hm7 h LEU 228 N 0.37 0.57 -0.16 2.19 3.38 -0.71 0.50 115.31 121.44 3hm7 h LEU 228 Ca 0.09 -0.14 -0.23 0.00 0.09 0.00 0.00 57.88 57.69 3hm7 h LEU 228 Cb 0.20 -0.15 0.01 0.00 0.09 0.00 0.00 40.66 40.81 3hm7 h LEU 228 CO 0.00 0.69 -0.84 0.03 0.09 0.00 0.00 178.44 178.41 3hm7 h ARG 229 N 0.55 0.69 -0.52 1.13 2.47 -1.00 -2.12 114.38 115.58 3hm7 h ARG 229 Ca 0.11 -0.61 -0.05 0.00 -1.26 0.00 0.00 59.98 58.16 3hm7 h ARG 229 Cb 0.47 0.14 -0.02 0.00 -1.65 0.00 0.00 29.97 28.90 3hm7 h ARG 229 CO 0.02 1.22 0.12 0.74 0.56 0.00 0.00 179.97 182.63 3hm7 h PHE 230 N 0.45 0.83 -0.26 3.04 0.05 -1.23 -0.85 116.94 118.97 3hm7 h PHE 230 Ca -0.07 -0.08 0.00 0.00 3.82 0.00 0.00 57.97 61.65 3hm7 h PHE 230 Cb 1.47 -0.24 -0.01 0.00 2.00 0.00 0.00 35.95 39.16 3hm7 h PHE 230 CO 0.08 0.70 0.16 0.00 -0.18 0.00 0.00 178.31 179.08 3hm7 h ALA 231 N 1.35 0.33 -0.72 2.45 0.00 -0.87 -2.36 119.26 119.45 3hm7 h ALA 231 Ca 0.17 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 3hm7 h ALA 231 Cb 0.30 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3hm7 h ALA 231 CO -0.00 -0.19 0.39 1.96 0.00 0.00 0.00 179.25 181.42 3hm7 h GLN 232 N 0.34 1.00 -0.26 0.00 4.20 -0.71 0.49 115.11 120.17 3hm7 h GLN 232 Ca 0.09 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 3hm7 h GLN 232 Cb -0.02 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 3hm7 h GLN 232 CO -0.02 0.74 0.01 1.25 -0.67 0.00 0.00 178.83 180.14 3hm7 h LEU 233 N 0.99 0.44 -0.39 1.46 6.46 -1.15 -3.33 115.31 119.79 3hm7 h LEU 233 Ca 0.25 -0.30 0.00 0.00 -0.12 0.00 0.00 57.88 57.71 3hm7 h LEU 233 Cb 0.04 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 39.85 3hm7 h LEU 233 CO -0.04 0.63 -0.62 0.35 -0.62 0.00 0.00 178.44 178.14 3hm7 n THR 234 N -4.63 0.00 -1.86 1.05 -2.24 -0.89 -4.97 114.28 100.74 3hm7 n THR 234 Ca -0.03 -0.10 -0.21 0.00 -2.27 0.00 0.00 64.05 61.44 3hm7 n THR 234 Cb 0.24 0.83 -0.06 0.00 -2.10 0.00 0.00 70.33 69.24 3hm7 n THR 234 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hm7 s PRO 237 N 1.55 3.68 0.02 0.00 0.02 -1.26 -4.75 135.00 134.26 3hm7 s PRO 237 Ca 0.37 2.45 0.01 0.00 0.02 0.00 0.00 61.00 63.86 3hm7 s PRO 237 Cb -0.17 -2.67 -0.01 0.00 0.02 0.00 0.00 34.50 31.67 3hm7 s PRO 237 CO 0.15 -0.83 -0.04 -1.50 -0.33 0.00 0.00 177.00 174.45 3hm7 s ILE 238 N -1.19 0.28 -0.09 2.83 2.07 -0.63 -1.72 121.20 122.76 3hm7 s ILE 238 Ca 0.61 -0.62 -0.00 0.00 -1.41 0.00 0.00 60.65 59.23 3hm7 s ILE 238 Cb -0.44 -0.33 0.02 0.00 0.13 0.00 0.00 42.46 41.84 3hm7 s ILE 238 CO 0.57 -0.22 -0.06 -2.28 -1.91 0.00 0.00 174.94 171.04 3hm7 s HIS 239 N -0.83 1.20 -0.32 3.50 5.65 0.24 -1.36 115.29 123.36 3hm7 s HIS 239 Ca -0.07 -0.52 -0.19 0.00 0.25 0.00 0.00 55.06 54.53 3hm7 s HIS 239 Cb -0.06 -1.05 -0.01 0.00 -1.18 0.00 0.00 32.58 30.29 3hm7 s HIS 239 CO -0.00 -0.41 0.59 0.42 -0.65 0.00 0.00 174.74 174.69 3hm7 s ILE 240 N 1.57 4.96 0.72 0.89 -1.09 0.64 -1.61 121.20 127.29 3hm7 s ILE 240 Ca 0.01 0.69 -0.12 0.00 -2.23 0.00 0.00 60.65 59.00 3hm7 s ILE 240 Cb -0.13 -3.98 0.03 0.00 -1.58 0.00 0.00 42.46 36.80 3hm7 s ILE 240 CO -0.05 -0.16 1.09 0.00 -1.23 0.00 0.00 174.94 174.59 3hm7 n HIS 242 N -3.07 0.00 -3.76 0.00 -0.00 -1.25 -4.69 115.22 102.44 3hm7 n HIS 242 Ca 0.09 0.00 -0.35 0.00 -0.00 0.00 0.00 57.72 57.46 3hm7 n HIS 242 Cb 0.53 0.00 -0.08 0.00 -0.00 0.00 0.00 29.99 30.44 3hm7 n HIS 242 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 3hm7 s VAL 243 N 0.00 5.35 -0.37 0.61 1.01 -0.88 -4.60 120.40 121.51 3hm7 s VAL 243 Ca 0.00 0.17 0.23 0.00 0.00 0.00 0.00 61.98 62.38 3hm7 s VAL 243 Cb 0.00 -3.44 -0.12 0.00 0.00 0.00 0.00 36.38 32.82 3hm7 s VAL 243 CO 0.00 0.45 0.93 -1.54 0.00 0.00 0.00 175.10 174.94 3hm7 n SER 244 N 3.44 0.57 -4.05 3.32 3.41 -1.26 -4.66 113.62 114.39 3hm7 n SER 244 Ca -0.16 0.01 -0.12 0.00 -0.26 0.00 0.00 58.87 58.34 3hm7 n SER 244 Cb 0.52 0.91 -0.11 0.00 -0.26 0.00 0.00 64.21 65.27 3hm7 n SER 244 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3hm7 s SER 245 N -4.51 0.73 0.52 4.04 0.15 -1.26 -4.83 113.70 108.53 3hm7 s SER 245 Ca 0.00 -0.55 0.33 0.00 0.70 0.00 0.00 55.95 56.43 3hm7 s SER 245 Cb 0.13 0.05 1.44 0.00 -1.71 0.00 0.00 66.02 65.93 3hm7 s SER 245 CO 0.82 -0.23 1.99 -0.09 1.20 0.00 0.00 173.24 176.92 3hm7 h ARG 246 N 4.48 0.00 -0.40 5.44 2.43 -1.85 -2.48 114.38 122.01 3hm7 h ARG 246 Ca -0.35 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 58.77 3hm7 h ARG 246 Cb 1.20 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.73 3hm7 h ARG 246 CO 0.41 0.00 0.02 0.87 -1.51 0.00 0.00 179.97 179.76 3hm7 h LYS 247 N 0.00 0.62 -0.06 0.20 1.57 -1.96 0.11 116.57 117.05 3hm7 h LYS 247 Ca 0.00 -0.14 -0.22 0.00 -1.87 0.00 0.00 60.65 58.42 3hm7 h LYS 247 Cb 0.41 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 32.65 3hm7 h LYS 247 CO 0.00 0.63 -0.84 0.28 -0.57 0.00 0.00 179.45 178.95 3hm7 h VAL 248 N 0.59 1.31 -0.79 0.50 2.07 -1.82 -2.85 116.25 115.26 3hm7 h VAL 248 Ca 0.13 -2.08 0.01 0.00 0.82 0.00 0.00 66.70 65.57 3hm7 h VAL 248 Cb 0.35 2.26 -0.04 0.00 -1.52 0.00 0.00 31.29 32.34 3hm7 h VAL 248 CO 0.01 0.64 0.52 -0.07 0.02 0.00 0.00 177.57 178.69 3hm7 h LEU 249 N 0.34 0.91 -1.19 2.57 3.38 -1.32 -2.53 115.31 117.46 3hm7 h LEU 249 Ca -0.09 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 3hm7 h LEU 249 Cb 1.49 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.98 3hm7 h LEU 249 CO 0.17 0.66 0.32 0.11 0.09 0.00 0.00 178.44 179.79 3hm7 h LYS 250 N 1.07 0.88 -0.52 1.13 1.57 -0.74 0.28 116.57 120.23 3hm7 h LYS 250 Ca 0.29 -0.10 -0.08 0.00 -1.87 0.00 0.00 60.65 58.88 3hm7 h LYS 250 Cb -0.12 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.00 3hm7 h LYS 250 CO -0.06 0.67 -0.00 -0.09 -0.57 0.00 0.00 179.45 179.40 3hm7 h ARG 251 N 0.88 0.89 -0.22 3.15 9.65 -1.28 -2.53 114.38 124.92 3hm7 h ARG 251 Ca 0.22 -0.25 -0.21 0.00 -1.10 0.00 0.00 59.98 58.64 3hm7 h ARG 251 Cb 0.06 -0.10 0.01 0.00 -1.39 0.00 0.00 29.97 28.55 3hm7 h ARG 251 CO -0.03 0.89 -0.67 0.82 2.80 0.00 0.00 179.97 183.77 3hm7 h ILE 252 N 0.82 1.28 -0.99 1.20 2.04 -0.83 -2.28 117.51 118.75 3hm7 h ILE 252 Ca 0.15 -1.86 0.06 0.00 1.00 0.00 0.00 64.86 64.22 3hm7 h ILE 252 Cb 0.49 1.81 -0.07 0.00 -0.74 0.00 0.00 36.82 38.32 3hm7 h ILE 252 CO 0.02 0.60 0.64 0.50 0.00 0.00 0.00 178.15 179.91 3hm7 h LYS 253 N 0.60 1.15 -0.49 2.37 3.64 -0.94 0.42 116.57 123.31 3hm7 h LYS 253 Ca -0.02 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.26 3hm7 h LYS 253 Cb 1.29 -0.26 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 3hm7 h LYS 253 CO 0.14 0.76 0.21 0.37 -2.27 0.00 0.00 179.45 178.66 3hm7 h GLN 254 N 1.18 0.73 -0.40 1.90 4.15 -1.34 -1.94 115.11 119.40 3hm7 h GLN 254 Ca 0.42 -0.13 -0.10 0.00 0.77 0.00 0.00 58.65 59.62 3hm7 h GLN 254 Cb 0.13 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.68 3hm7 h GLN 254 CO -0.16 0.65 -0.15 0.00 -1.93 0.00 0.00 178.83 177.23 3hm7 h ALA 255 N 1.05 0.99 -0.72 3.38 0.00 -0.77 -2.44 119.26 120.75 3hm7 h ALA 255 Ca 0.17 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.77 3hm7 h ALA 255 Cb 0.18 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.77 3hm7 h ALA 255 CO -0.02 0.60 0.46 0.87 0.00 0.00 0.00 179.25 181.16 3hm7 h LYS 256 N 0.66 0.88 -0.23 0.00 1.57 -0.01 -2.20 116.57 117.24 3hm7 h LYS 256 Ca 0.11 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3hm7 h LYS 256 Cb 0.63 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 3hm7 h LYS 256 CO 0.04 0.58 0.10 0.78 -0.57 0.00 0.00 179.45 180.39 3hm7 h GLY 257 N 0.91 0.33 -1.14 3.86 0.00 -1.02 -1.58 103.07 104.43 3hm7 h GLY 257 Ca 0.28 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.47 3hm7 h GLY 257 CO -0.09 0.13 0.00 1.18 0.00 0.00 0.00 176.54 177.76 3hm7 n GLU 258 N -4.46 1.74 0.00 4.80 1.02 -0.88 -4.93 120.64 117.94 3hm7 n GLU 258 Ca 0.00 -1.15 0.00 0.00 -0.02 0.00 0.00 57.16 55.99 3hm7 n GLU 258 Cb 0.11 -1.27 0.00 0.00 -0.02 0.00 0.00 31.44 30.26 3hm7 n GLU 258 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3hm7 n GLY 259 N 1.03 0.10 3.73 0.62 0.00 -0.59 -5.06 105.19 105.02 3hm7 n GLY 259 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 3hm7 n GLY 259 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hm7 s VAL 260 N -2.00 2.43 -1.27 1.61 1.01 -0.90 -4.91 120.40 116.37 3hm7 s VAL 260 Ca 0.00 0.33 -0.19 0.00 0.00 0.00 0.00 61.98 62.12 3hm7 s VAL 260 Cb 0.00 -3.21 0.02 0.00 0.00 0.00 0.00 36.38 33.19 3hm7 s VAL 260 CO 0.00 0.04 1.83 -3.20 0.00 0.00 0.00 175.10 173.76 3hm7 n ASN 261 N 3.29 4.35 -4.45 3.32 2.85 -1.26 -4.45 115.26 118.92 3hm7 n ASN 261 Ca 0.12 -2.86 -0.32 0.00 -0.11 0.00 0.00 54.58 51.41 3hm7 n ASN 261 Cb 0.38 -1.72 -0.13 0.00 1.24 0.00 0.00 39.78 39.54 3hm7 n ASN 261 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 3hm7 s VAL 262 N 5.78 2.85 0.23 3.44 1.01 -1.26 -1.60 120.40 130.85 3hm7 s VAL 262 Ca 0.57 -0.91 0.11 0.00 0.00 0.00 0.00 61.98 61.75 3hm7 s VAL 262 Cb 0.04 -2.13 -0.05 0.00 0.00 0.00 0.00 36.38 34.25 3hm7 s VAL 262 CO 0.08 0.51 -0.14 -0.94 0.00 0.00 0.00 175.10 174.62 3hm7 s SER 263 N -0.93 3.94 0.01 3.32 1.04 -0.47 -5.00 113.70 115.61 3hm7 s SER 263 Ca 0.12 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.76 3hm7 s SER 263 Cb -0.10 -0.52 -0.01 0.00 0.10 0.00 0.00 66.02 65.49 3hm7 s SER 263 CO 0.02 0.07 -0.02 0.54 0.98 0.00 0.00 173.24 174.82 3hm7 s VAL 264 N -2.08 0.14 0.30 5.02 0.11 -1.26 -0.26 120.40 122.37 3hm7 s VAL 264 Ca 0.27 -0.27 0.11 0.00 -2.93 0.00 0.00 61.98 59.17 3hm7 s VAL 264 Cb -0.07 -0.16 -0.05 0.00 -1.53 0.00 0.00 36.38 34.57 3hm7 s VAL 264 CO 0.15 -0.08 -0.17 -1.83 -3.33 0.00 0.00 175.10 169.84 3hm7 s GLU 265 N -0.37 1.73 0.34 1.54 -1.05 -0.85 -1.18 118.70 118.86 3hm7 s GLU 265 Ca -0.03 -1.80 0.03 0.00 -0.15 0.00 0.00 54.97 53.02 3hm7 s GLU 265 Cb -0.03 -1.76 -0.04 0.00 -0.44 0.00 0.00 34.13 31.86 3hm7 s GLU 265 CO -0.00 0.28 0.13 -0.08 0.95 0.00 0.00 175.26 176.54 3hm7 s THR 266 N -2.53 0.58 0.18 1.83 -1.32 -1.19 -2.08 115.64 111.12 3hm7 s THR 266 Ca 0.31 -2.00 0.09 0.00 -1.21 0.00 0.00 61.69 58.88 3hm7 s THR 266 Cb -0.03 -2.52 -0.04 0.00 -1.51 0.00 0.00 72.50 68.40 3hm7 s THR 266 CO 0.16 0.00 -0.20 0.00 -2.21 0.00 0.00 174.62 172.37 3hm7 h PRO 268 N 3.11 0.69 -0.40 0.00 0.11 -1.86 -2.33 132.00 131.32 3hm7 h PRO 268 Ca -0.43 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 3hm7 h PRO 268 Cb 1.21 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 3hm7 h PRO 268 CO 0.52 0.45 0.15 1.12 -0.21 0.00 0.00 178.00 180.03 3hm7 h HIS 269 N 0.71 0.57 0.00 0.65 2.07 -1.94 -0.25 115.15 116.96 3hm7 h HIS 269 Ca 0.33 -0.02 -0.08 0.00 -2.85 0.00 0.00 60.37 57.75 3hm7 h HIS 269 Cb 0.37 -0.18 -0.01 0.00 2.57 0.00 0.00 27.41 30.16 3hm7 h HIS 269 CO -0.00 0.45 -0.36 1.88 -3.07 0.00 0.00 177.93 176.83 3hm7 h TYR 270 N 0.57 0.00 0.00 6.12 0.05 -1.68 0.11 116.97 122.15 3hm7 h TYR 270 Ca 0.14 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.92 3hm7 h TYR 270 Cb 0.13 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.87 3hm7 h TYR 270 CO 0.01 0.36 -0.51 -0.07 -1.05 0.00 0.00 178.16 176.90 3hm7 h LEU 271 N 0.00 0.00 0.00 3.88 3.38 -1.10 -3.40 115.31 118.07 3hm7 h LEU 271 Ca -0.00 -0.06 -0.27 0.00 0.09 0.00 0.00 57.88 57.64 3hm7 h LEU 271 Cb 0.69 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 3hm7 h LEU 271 CO 0.05 0.03 -1.89 -0.11 0.09 0.00 0.00 178.44 176.60 3hm7 n LEU 272 N -2.60 1.19 -4.75 1.67 0.00 -0.27 -5.01 117.00 107.24 3hm7 n LEU 272 Ca 0.03 0.18 -0.36 0.00 0.00 0.00 0.00 56.01 55.86 3hm7 n LEU 272 Cb 0.50 -0.47 -0.07 0.00 0.00 0.00 0.00 43.42 43.38 3hm7 n LEU 272 CO 0.36 0.35 -0.04 -0.36 0.00 0.00 0.00 177.39 177.70 3hm7 s PHE 273 N -2.29 3.50 0.00 1.96 2.99 0.38 -5.05 117.98 119.47 3hm7 s PHE 273 Ca -0.22 0.60 0.00 0.00 0.00 0.00 0.00 56.93 57.30 3hm7 s PHE 273 Cb 0.08 -2.27 0.00 0.00 0.00 0.00 0.00 43.02 40.83 3hm7 s PHE 273 CO 0.28 0.34 0.00 -1.13 -0.00 0.00 0.00 175.22 174.71 3hm7 n SER 274 N 3.23 0.73 0.14 1.36 3.41 -1.26 -4.58 113.62 116.65 3hm7 n SER 274 Ca -0.13 -0.38 0.01 0.00 -0.26 0.00 0.00 58.87 58.10 3hm7 n SER 274 Cb 0.52 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.59 3hm7 n SER 274 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 3hm7 h LEU 275 N 0.00 0.00 -0.22 1.04 5.85 -0.78 0.76 115.31 121.96 3hm7 h LEU 275 Ca 0.00 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.61 3hm7 h LEU 275 Cb 0.00 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.03 3hm7 h LEU 275 CO 0.00 0.57 -0.29 0.44 -0.34 0.00 0.00 178.44 178.82 3hm7 h ASP 276 N 0.00 0.63 1.51 1.25 3.32 -1.96 -3.08 116.42 118.09 3hm7 h ASP 276 Ca -0.01 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.54 3hm7 h ASP 276 Cb 1.26 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 40.63 3hm7 h ASP 276 CO 0.07 1.01 0.00 -0.33 -1.72 0.00 0.00 179.24 178.28 3hm7 h GLU 277 N 0.27 0.00 0.61 3.56 3.07 -1.92 -3.02 114.58 117.16 3hm7 h GLU 277 Ca 0.03 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.86 3hm7 h GLU 277 Cb 0.86 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.78 3hm7 h GLU 277 CO 0.07 0.00 -0.29 0.35 -1.40 0.00 0.00 179.01 177.73 3hm7 h PHE 278 N 0.00 -0.76 -0.01 4.33 3.04 -0.76 -2.03 116.94 120.75 3hm7 h PHE 278 Ca 0.00 -0.02 -0.08 0.00 3.98 0.00 0.00 57.97 61.85 3hm7 h PHE 278 Cb 0.75 0.25 -0.01 0.00 2.56 0.00 0.00 35.95 39.50 3hm7 h PHE 278 CO 0.00 -0.43 -0.38 0.00 -2.02 0.00 0.00 178.31 175.49 3hm7 h ALA 279 N -0.71 1.37 -0.06 2.41 0.00 -1.61 0.44 119.26 121.10 3hm7 h ALA 279 Ca -0.08 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 3hm7 h ALA 279 Cb 0.68 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 3hm7 h ALA 279 CO 0.14 0.47 -0.04 1.49 0.00 0.00 0.00 179.25 181.32 3hm7 h GLU 280 N 0.01 0.13 -0.24 0.00 4.81 -1.52 -3.10 114.58 114.67 3hm7 h GLU 280 Ca -0.00 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 59.01 3hm7 h GLU 280 Cb 0.67 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.05 3hm7 h GLU 280 CO 0.05 0.53 -0.45 0.82 -0.73 0.00 0.00 179.01 179.22 3hm7 h ILE 281 N -0.27 1.30 0.00 2.32 2.04 -1.36 -3.49 117.51 118.06 3hm7 h ILE 281 Ca 0.01 -1.66 0.00 0.00 1.00 0.00 0.00 64.86 64.22 3hm7 h ILE 281 Cb 0.49 1.75 0.00 0.00 -0.74 0.00 0.00 36.82 38.32 3hm7 h ILE 281 CO 0.01 0.53 0.00 0.61 0.00 0.00 0.00 178.15 179.30 3hm7 n GLY 282 N 0.38 0.95 0.11 5.37 0.00 0.15 -4.58 105.19 107.57 3hm7 n GLY 282 Ca -0.05 -0.96 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 3hm7 n GLY 282 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3hm7 n TYR 283 N 0.00 0.87 0.89 1.61 0.53 -1.26 -4.04 117.16 115.77 3hm7 n TYR 283 Ca 0.00 0.25 0.08 0.00 -1.02 0.00 0.00 57.90 57.21 3hm7 n TYR 283 Cb 0.00 -1.14 0.46 0.00 -1.03 0.00 0.00 39.34 37.63 3hm7 n TYR 283 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 3hm7 n LEU 284 N -3.18 0.00 -1.14 7.72 4.77 -1.26 -1.83 117.00 122.08 3hm7 n LEU 284 Ca -0.27 0.19 0.10 0.00 -0.03 0.00 0.00 56.01 56.00 3hm7 n LEU 284 Cb 1.06 -0.19 0.27 0.00 -2.33 0.00 0.00 43.42 42.23 3hm7 n LEU 284 CO 0.42 -0.08 0.73 0.00 -1.33 0.00 0.00 177.39 177.13 3hm7 n ALA 285 N -1.19 2.40 -2.46 -1.18 0.00 -1.26 -4.38 120.51 112.44 3hm7 n ALA 285 Ca 0.10 -1.08 -0.42 0.00 0.00 0.00 0.00 53.44 52.03 3hm7 n ALA 285 Cb 0.11 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.58 3hm7 n ALA 285 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 3hm7 s LYS 286 N -1.18 4.36 0.25 0.00 2.20 -0.76 -4.71 119.74 119.90 3hm7 s LYS 286 Ca 0.41 1.67 -0.07 0.00 -0.36 0.00 0.00 55.97 57.63 3hm7 s LYS 286 Cb 0.22 -3.55 -0.02 0.00 -1.51 0.00 0.00 37.83 32.97 3hm7 s LYS 286 CO 0.28 -0.43 0.35 0.00 -0.36 0.00 0.00 175.35 175.19 3hm7 s ALA 288 N -3.90 1.79 0.82 0.00 0.00 -1.26 -2.73 121.76 116.48 3hm7 s ALA 288 Ca 0.30 -1.17 -0.13 0.00 0.00 0.00 0.00 51.96 50.97 3hm7 s ALA 288 Cb 0.02 -1.32 0.09 0.00 0.00 0.00 0.00 23.12 21.91 3hm7 s ALA 288 CO 0.12 -1.04 1.19 -2.14 0.00 0.00 0.00 175.76 173.89 3hm7 s PRO 289 N 1.48 1.58 0.79 0.00 0.02 -1.26 -5.02 135.00 132.59 3hm7 s PRO 289 Ca -0.03 1.69 -0.11 0.00 0.02 0.00 0.00 61.00 62.56 3hm7 s PRO 289 Cb -0.17 -1.78 0.06 0.00 0.02 0.00 0.00 34.50 32.63 3hm7 s PRO 289 CO -0.07 -2.24 1.09 -2.14 -0.33 0.00 0.00 177.00 173.31 3hm7 s PRO 290 N -4.25 2.18 0.54 5.54 0.02 -1.11 -5.02 135.00 132.91 3hm7 s PRO 290 Ca 0.71 0.73 -0.19 0.00 0.02 0.00 0.00 61.00 62.26 3hm7 s PRO 290 Cb -0.27 -1.92 -0.06 0.00 0.02 0.00 0.00 34.50 32.27 3hm7 s PRO 290 CO 0.52 -1.57 1.12 -0.51 -0.33 0.00 0.00 177.00 176.23 3hm7 s LEU 291 N -5.77 3.76 0.00 -5.54 1.43 -1.26 -4.93 118.68 106.36 3hm7 s LEU 291 Ca 0.60 2.15 0.01 0.00 -1.03 0.00 0.00 54.13 55.87 3hm7 s LEU 291 Cb -0.15 -4.58 0.01 0.00 0.03 0.00 0.00 46.19 41.51 3hm7 s LEU 291 CO 0.55 -1.18 0.12 0.54 0.23 0.00 0.00 176.35 176.60 3hm7 n ARG 292 N -1.28 1.26 -1.27 1.70 5.12 -1.26 -4.74 116.66 116.20 3hm7 n ARG 292 Ca 0.11 -1.21 -0.30 0.00 -1.93 0.00 0.00 57.85 54.52 3hm7 n ARG 292 Cb 0.51 0.16 0.12 0.00 -1.16 0.00 0.00 32.46 32.09 3hm7 n ARG 292 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 3hm7 s GLU 293 N -2.76 1.64 0.30 5.56 -1.05 -1.26 -0.10 118.70 121.02 3hm7 s GLU 293 Ca 0.09 0.89 -0.02 0.00 -0.15 0.00 0.00 54.97 55.78 3hm7 s GLU 293 Cb -0.01 -1.85 0.45 0.00 -0.44 0.00 0.00 34.13 32.29 3hm7 s GLU 293 CO 0.06 -2.00 1.95 -0.09 0.95 0.00 0.00 175.26 176.14 3hm7 h ARG 294 N -1.37 1.08 -0.30 -4.83 9.65 -1.96 -1.25 114.38 115.40 3hm7 h ARG 294 Ca -0.48 -0.07 -0.04 0.00 -1.10 0.00 0.00 59.98 58.30 3hm7 h ARG 294 Cb 1.27 -0.24 -0.02 0.00 -1.39 0.00 0.00 29.97 29.59 3hm7 h ARG 294 CO 0.54 0.72 0.02 0.37 2.80 0.00 0.00 179.97 184.42 3hm7 h GLN 295 N 1.12 0.45 -0.06 0.20 -0.00 -1.99 -1.55 115.11 113.28 3hm7 h GLN 295 Ca 0.33 -0.08 -0.19 0.00 -0.00 0.00 0.00 58.65 58.71 3hm7 h GLN 295 Cb -0.06 -0.07 -0.01 0.00 0.00 0.00 0.00 27.48 27.35 3hm7 h GLN 295 CO -0.08 0.46 -0.76 1.49 0.00 0.00 0.00 178.83 179.94 3hm7 h GLU 296 N 0.44 0.37 -0.15 1.69 4.57 -1.61 -1.52 114.58 118.37 3hm7 h GLU 296 Ca 0.10 -0.32 -0.14 0.00 -1.18 0.00 0.00 59.36 57.82 3hm7 h GLU 296 Cb 0.26 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 28.91 3hm7 h GLU 296 CO 0.00 0.97 -0.49 0.28 -1.18 0.00 0.00 179.01 178.59 3hm7 h VAL 297 N 0.25 1.33 -0.08 0.32 2.07 -1.03 -1.69 116.25 117.43 3hm7 h VAL 297 Ca -0.04 -1.72 -0.18 0.00 0.82 0.00 0.00 66.70 65.59 3hm7 h VAL 297 Cb 1.34 1.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.86 3hm7 h VAL 297 CO 0.13 0.52 -0.71 -0.08 0.02 0.00 0.00 177.57 177.45 3hm7 h GLU 298 N 0.32 0.38 -0.56 1.57 4.57 -1.23 -2.79 114.58 116.84 3hm7 h GLU 298 Ca 0.02 -0.30 -0.07 0.00 -1.18 0.00 0.00 59.36 57.82 3hm7 h GLU 298 Cb 0.98 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.61 3hm7 h GLU 298 CO 0.08 0.94 0.08 -0.44 -1.18 0.00 0.00 179.01 178.49 3hm7 h ASP 299 N 0.26 0.91 -0.95 1.04 3.45 -1.17 -2.93 116.42 117.04 3hm7 h ASP 299 Ca -0.03 -0.27 0.00 0.00 0.43 0.00 0.00 57.03 57.17 3hm7 h ASP 299 Cb 1.27 -0.24 -0.05 0.00 -0.56 0.00 0.00 39.33 39.75 3hm7 h ASP 299 CO 0.12 0.95 0.60 0.25 -1.57 0.00 0.00 179.24 179.59 3hm7 h LEU 300 N 0.84 1.11 -0.59 1.55 5.85 -1.19 -1.78 115.31 121.10 3hm7 h LEU 300 Ca 0.17 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 3hm7 h LEU 300 Cb 0.43 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 3hm7 h LEU 300 CO 0.01 0.83 0.29 -0.50 -0.34 0.00 0.00 178.44 178.73 3hm7 h TRP 301 N 1.30 0.84 -0.73 1.25 4.06 -1.44 -1.39 115.95 119.84 3hm7 h TRP 301 Ca 0.34 -0.04 0.03 0.00 2.06 0.00 0.00 58.89 61.28 3hm7 h TRP 301 Cb -0.10 -0.26 -0.04 0.00 -1.00 0.00 0.00 29.16 27.75 3hm7 h TRP 301 CO 0.00 0.64 0.48 -0.44 -3.56 0.00 0.00 178.44 175.56 3hm7 h ASP 302 N 0.80 0.78 -0.21 -3.49 3.45 -1.19 0.23 116.42 116.79 3hm7 h ASP 302 Ca 0.20 -0.01 -0.05 0.00 0.43 0.00 0.00 57.03 57.60 3hm7 h ASP 302 Cb 0.11 -0.18 -0.01 0.00 -0.56 0.00 0.00 39.33 38.69 3hm7 h ASP 302 CO -0.03 0.54 -0.06 1.23 -1.57 0.00 0.00 179.24 179.35 3hm7 h GLY 303 N 0.91 0.44 0.83 2.75 0.00 -1.04 -1.89 103.07 105.06 3hm7 h GLY 303 Ca 0.29 -0.37 0.02 0.00 0.00 0.00 0.00 47.33 47.26 3hm7 h GLY 303 CO -0.08 0.34 0.10 -2.00 0.00 0.00 0.00 176.54 174.90 3hm7 h LEU 304 N 0.12 0.12 -1.29 3.11 6.46 -0.80 0.53 115.31 123.57 3hm7 h LEU 304 Ca 0.05 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.82 3hm7 h LEU 304 Cb 0.52 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.43 3hm7 h LEU 304 CO 0.02 0.10 0.30 -0.03 -0.62 0.00 0.00 178.44 178.21 3hm7 h MET 305 N 0.22 0.79 0.00 1.25 4.05 -0.99 -1.76 114.93 118.48 3hm7 h MET 305 Ca 0.11 -0.09 0.00 0.00 -0.28 0.00 0.00 59.70 59.44 3hm7 h MET 305 Cb 0.06 -0.16 0.00 0.00 -0.80 0.00 0.00 31.60 30.70 3hm7 h MET 305 CO -0.10 0.59 0.00 0.00 0.23 0.00 0.00 176.91 177.63 3hm7 h ALA 306 N 1.53 1.00 0.00 0.39 0.00 -0.70 -3.47 119.26 118.01 3hm7 h ALA 306 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3hm7 h ALA 306 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3hm7 h ALA 306 CO -0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.63 3hm7 n GLY 307 N 0.58 0.99 0.00 0.00 0.00 -0.64 -4.99 105.19 101.13 3hm7 n GLY 307 Ca 0.03 -0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.17 3hm7 n GLY 307 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hm7 n GLU 308 N -2.02 0.29 -4.72 1.61 1.02 0.08 -4.65 120.64 112.26 3hm7 n GLU 308 Ca 0.00 0.07 -0.33 0.00 -0.02 0.00 0.00 57.16 56.88 3hm7 n GLU 308 Cb 0.00 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 29.78 3hm7 n GLU 308 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3hm7 s ILE 309 N -2.64 3.06 0.04 -3.67 1.01 -1.26 -4.90 121.20 112.83 3hm7 s ILE 309 Ca 0.21 -0.66 -0.16 0.00 0.00 0.00 0.00 60.65 60.04 3hm7 s ILE 309 Cb 0.16 -2.29 -0.31 0.00 0.01 0.00 0.00 42.46 40.03 3hm7 s ILE 309 CO 0.37 0.52 1.05 0.44 0.00 0.00 0.00 174.94 177.33 3hm7 h ASP 310 N 6.80 0.82 -5.17 3.58 5.19 -1.41 -3.49 116.42 122.75 3hm7 h ASP 310 Ca -0.27 -0.86 -0.04 0.00 -0.62 0.00 0.00 57.03 55.24 3hm7 h ASP 310 Cb 1.21 -0.26 -0.10 0.00 0.18 0.00 0.00 39.33 40.36 3hm7 h ASP 310 CO 0.56 1.61 -0.07 -1.48 -3.12 0.00 0.00 179.24 176.74 3hm7 s LEU 311 N -7.83 0.30 -0.03 1.55 0.05 -1.15 -4.64 118.68 106.93 3hm7 s LEU 311 Ca -0.10 -0.72 0.07 0.00 0.05 0.00 0.00 54.13 53.43 3hm7 s LEU 311 Cb 0.05 1.88 -0.02 0.00 -2.05 0.00 0.00 46.19 46.05 3hm7 s LEU 311 CO 0.92 -1.08 -0.25 -0.63 -0.55 0.00 0.00 176.35 174.76 3hm7 s ILE 312 N -3.95 2.02 0.25 1.48 -1.09 0.12 -3.16 121.20 116.86 3hm7 s ILE 312 Ca 0.15 -1.08 0.01 0.00 -2.23 0.00 0.00 60.65 57.51 3hm7 s ILE 312 Cb -0.00 -1.69 -0.04 0.00 -1.58 0.00 0.00 42.46 39.14 3hm7 s ILE 312 CO 0.03 0.57 0.13 -0.94 -1.23 0.00 0.00 174.94 173.49 3hm7 s SER 313 N -0.43 0.87 -0.06 3.58 1.04 -1.10 -4.64 113.70 112.96 3hm7 s SER 313 Ca 0.05 -1.43 0.16 0.00 0.48 0.00 0.00 55.95 55.20 3hm7 s SER 313 Cb -0.11 0.31 -0.22 0.00 0.10 0.00 0.00 66.02 66.09 3hm7 s SER 313 CO 0.01 -0.82 0.51 -1.54 0.98 0.00 0.00 173.24 172.38 3hm7 n SER 314 N -0.52 0.54 -3.71 7.02 3.41 -1.26 -4.08 113.62 115.03 3hm7 n SER 314 Ca 0.01 0.25 -0.30 0.00 -0.26 0.00 0.00 58.87 58.57 3hm7 n SER 314 Cb 0.66 0.46 0.04 0.00 -0.26 0.00 0.00 64.21 65.11 3hm7 n SER 314 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3hm7 n ASP 315 N -2.86 -4.60 -4.55 4.04 2.03 -0.69 -4.75 116.55 105.16 3hm7 n ASP 315 Ca -0.19 -1.01 -0.37 0.00 0.52 0.00 0.00 54.79 53.74 3hm7 n ASP 315 Cb 1.00 -3.38 -0.03 0.00 -0.72 0.00 0.00 41.12 37.99 3hm7 n ASP 315 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 3hm7 s HIS 316 N -3.53 1.50 -0.57 -0.67 5.65 -1.13 -4.54 115.29 112.00 3hm7 s HIS 316 Ca 0.40 1.01 0.04 0.00 0.25 0.00 0.00 55.06 56.76 3hm7 s HIS 316 Cb -0.14 -3.94 0.15 0.00 -1.18 0.00 0.00 32.58 27.46 3hm7 s HIS 316 CO 0.86 -2.34 0.34 0.45 -0.65 0.00 0.00 174.74 173.41 3hm7 s SER 317 N 9.23 4.31 0.18 9.88 0.15 -0.63 -1.16 113.70 135.66 3hm7 s SER 317 Ca 0.76 -3.28 -0.04 0.00 0.70 0.00 0.00 55.95 54.09 3hm7 s SER 317 Cb -0.14 -1.52 -0.05 0.00 -1.71 0.00 0.00 66.02 62.60 3hm7 s SER 317 CO 0.21 -0.18 0.42 -2.16 1.20 0.00 0.00 173.24 172.73 3hm7 s PRO 318 N -0.63 3.61 0.25 5.44 0.05 -1.26 -2.51 135.00 139.95 3hm7 s PRO 318 Ca 0.20 -0.11 -0.11 0.00 0.05 0.00 0.00 61.00 61.03 3hm7 s PRO 318 Cb -0.17 -2.80 -0.01 0.00 0.05 0.00 0.00 34.50 31.57 3hm7 s PRO 318 CO -0.07 0.40 0.44 -1.54 0.05 0.00 0.00 177.00 176.28 3hm7 s SER 319 N -2.71 -0.01 0.59 6.66 1.04 -1.26 -4.87 113.70 113.13 3hm7 s SER 319 Ca 0.41 -1.02 -0.19 0.00 0.48 0.00 0.00 55.95 55.64 3hm7 s SER 319 Cb -0.12 0.57 -0.04 0.00 0.10 0.00 0.00 66.02 66.54 3hm7 s SER 319 CO 0.26 -1.12 1.19 -0.76 0.98 0.00 0.00 173.24 173.80 3hm7 s LEU 320 N -3.05 3.66 0.19 2.42 1.43 -1.26 -4.93 118.68 117.14 3hm7 s LEU 320 Ca 0.25 2.34 -0.14 0.00 -1.03 0.00 0.00 54.13 55.55 3hm7 s LEU 320 Cb 0.00 -4.59 0.20 0.00 0.03 0.00 0.00 46.19 41.83 3hm7 s LEU 320 CO 0.10 -1.55 1.66 -0.65 0.23 0.00 0.00 176.35 176.14 3hm7 h PRO 321 N 0.88 0.05 0.00 1.29 0.11 -1.98 -1.21 132.00 131.13 3hm7 h PRO 321 Ca -0.50 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3hm7 h PRO 321 Cb 1.29 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3hm7 h PRO 321 CO 0.55 0.03 0.00 -0.56 -0.21 0.00 0.00 178.00 177.81 3hm7 h GLN 322 N 0.05 0.00 0.00 1.05 -0.00 -1.97 -1.15 115.11 113.08 3hm7 h GLN 322 Ca 0.27 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.89 3hm7 h GLN 322 Cb 0.41 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.89 3hm7 h GLN 322 CO -0.51 0.00 -0.12 1.98 -0.00 0.00 0.00 178.83 180.18 3hm7 h MET 323 N 0.00 0.00 -1.67 0.06 4.05 -1.58 -3.17 114.93 112.61 3hm7 h MET 323 Ca 0.00 0.00 -0.59 0.00 -0.28 0.00 0.00 59.70 58.83 3hm7 h MET 323 Cb 0.25 0.00 -0.22 0.00 -0.80 0.00 0.00 31.60 30.83 3hm7 h MET 323 CO 0.00 0.12 0.71 1.17 0.23 0.00 0.00 176.91 179.14 3hm7 n LYS 324 N -3.16 2.46 -3.73 0.39 3.00 -0.44 -3.58 118.16 113.11 3hm7 n LYS 324 Ca 0.02 -2.77 -0.16 0.00 -0.00 0.00 0.00 58.31 55.40 3hm7 n LYS 324 Cb 0.50 -2.12 -0.16 0.00 0.00 0.00 0.00 35.03 33.25 3hm7 n LYS 324 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 3hm7 s THR 325 N -3.70 -0.10 0.21 3.15 2.01 -1.20 -4.98 115.64 111.03 3hm7 s THR 325 Ca 0.53 0.29 -0.23 0.00 0.31 0.00 0.00 61.69 62.59 3hm7 s THR 325 Cb 0.40 -0.15 0.05 0.00 0.01 0.00 0.00 72.50 72.81 3hm7 s THR 325 CO -0.19 0.12 0.89 -0.83 -0.69 0.00 0.00 174.62 173.92 3hm7 s GLY 326 N 1.54 -0.11 0.15 4.40 0.00 -1.26 -4.75 107.32 107.29 3hm7 s GLY 326 Ca -0.04 -0.11 -0.12 0.00 0.00 0.00 0.00 44.72 44.45 3hm7 s GLY 326 CO -0.04 0.17 1.59 0.50 0.00 0.00 0.00 173.10 175.32 3hm7 h LYS 327 N 2.00 0.92 -5.10 2.90 1.57 -2.01 -3.47 116.57 113.39 3hm7 h LYS 327 Ca -0.24 -0.32 -0.52 0.00 -1.87 0.00 0.00 60.65 57.71 3hm7 h LYS 327 Cb 1.24 -0.07 -0.13 0.00 0.08 0.00 0.00 32.23 33.34 3hm7 h LYS 327 CO 0.27 0.97 -0.55 -0.08 -0.57 0.00 0.00 179.45 179.49 3hm7 s THR 328 N -4.93 0.81 0.39 -0.16 -1.32 -1.26 -5.04 115.64 104.13 3hm7 s THR 328 Ca -0.12 -2.00 0.14 0.00 -1.21 0.00 0.00 61.69 58.50 3hm7 s THR 328 Cb 0.12 -2.51 0.12 0.00 -1.51 0.00 0.00 72.50 68.72 3hm7 s THR 328 CO 0.84 0.00 1.88 -0.29 -2.21 0.00 0.00 174.62 174.83 3hm7 h ILE 329 N 1.92 1.19 -0.00 5.08 6.09 -1.91 -2.86 117.51 127.02 3hm7 h ILE 329 Ca -0.38 -1.09 -0.16 0.00 -1.37 0.00 0.00 64.86 61.86 3hm7 h ILE 329 Cb 1.26 1.60 -0.02 0.00 0.47 0.00 0.00 36.82 40.13 3hm7 h ILE 329 CO 0.62 0.31 -0.76 -0.26 -3.07 0.00 0.00 178.15 174.98 3hm7 h PHE 330 N 0.00 0.03 -0.10 2.19 0.04 -1.97 -3.23 116.94 113.90 3hm7 h PHE 330 Ca -0.00 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.75 3hm7 h PHE 330 Cb 0.57 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.71 3hm7 h PHE 330 CO 0.00 0.78 0.06 1.49 -0.60 0.00 0.00 178.31 180.04 3hm7 h GLU 331 N 0.01 0.14 -6.80 1.51 4.57 -1.90 -3.44 114.58 108.66 3hm7 h GLU 331 Ca -0.01 -0.01 -0.49 0.00 -1.18 0.00 0.00 59.36 57.67 3hm7 h GLU 331 Cb 1.35 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.90 3hm7 h GLU 331 CO 0.10 0.10 0.39 0.08 -1.18 0.00 0.00 179.01 178.50 3hm7 s VAL 332 N -5.17 3.87 -0.14 0.32 1.01 -1.22 -4.87 120.40 114.20 3hm7 s VAL 332 Ca -0.06 1.80 -0.29 0.00 0.00 0.00 0.00 61.98 63.43 3hm7 s VAL 332 Cb 0.17 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 3hm7 s VAL 332 CO 0.69 0.37 1.41 0.86 0.00 0.00 0.00 175.10 178.42 3hm7 s TRP 333 N -1.27 2.52 0.15 5.22 -0.00 -1.23 -5.01 118.94 119.31 3hm7 s TRP 333 Ca 0.45 0.72 -0.14 0.00 -0.00 0.00 0.00 56.10 57.12 3hm7 s TRP 333 Cb -0.27 -3.68 -0.07 0.00 -0.00 0.00 0.00 33.47 29.45 3hm7 s TRP 333 CO 0.33 -2.45 0.55 0.20 -0.00 0.00 0.00 176.95 175.59 3hm7 s GLY 334 N 2.59 2.46 0.00 5.86 0.00 -1.26 -4.78 107.32 112.19 3hm7 s GLY 334 Ca 0.62 -0.13 0.00 0.00 0.00 0.00 0.00 44.72 45.21 3hm7 s GLY 334 CO 0.21 0.15 0.00 0.61 0.00 0.00 0.00 173.10 174.07 3hm7 n GLY 335 N 0.77 2.84 3.12 0.20 0.00 0.77 -4.82 105.19 108.06 3hm7 n GLY 335 Ca -0.05 -0.63 -0.32 0.00 0.00 0.00 0.00 46.02 45.02 3hm7 n GLY 335 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hm7 s ILE 336 N -2.00 1.93 -0.27 -0.61 1.01 -1.04 -4.67 121.20 115.55 3hm7 s ILE 336 Ca 0.00 -0.88 -0.23 0.00 0.00 0.00 0.00 60.65 59.54 3hm7 s ILE 336 Cb 0.00 -1.74 -0.01 0.00 0.01 0.00 0.00 42.46 40.73 3hm7 s ILE 336 CO 0.00 0.52 0.75 0.00 0.00 0.00 0.00 174.94 176.21 3hm7 s ALA 337 N 1.10 3.60 0.00 9.38 0.00 -1.26 -1.61 121.76 132.97 3hm7 s ALA 337 Ca -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.62 3hm7 s ALA 337 Cb -0.14 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.78 3hm7 s ALA 337 CO -0.07 -0.97 0.32 0.41 0.00 0.00 0.00 175.76 175.45 3hm7 n GLY 338 N 4.03 0.70 0.00 0.00 0.00 -1.26 -4.59 105.19 104.07 3hm7 n GLY 338 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 3hm7 n GLY 338 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hm7 n GLN 340 N -0.91 0.63 0.00 0.00 7.27 -1.26 -4.39 117.38 118.72 3hm7 n GLN 340 Ca 0.16 0.02 0.08 0.00 0.07 0.00 0.00 57.00 57.33 3hm7 n GLN 340 Cb 0.07 -1.71 0.05 0.00 2.41 0.00 0.00 30.24 31.06 3hm7 n GLN 340 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 3hm7 n ASN 341 N -2.55 2.10 -0.03 1.69 5.03 -0.66 -4.01 115.26 116.82 3hm7 n ASN 341 Ca -0.03 -1.55 -0.10 0.00 0.87 0.00 0.00 54.58 53.77 3hm7 n ASN 341 Cb 0.60 0.14 -0.04 0.00 -1.02 0.00 0.00 39.78 39.46 3hm7 n ASN 341 CO 0.00 0.00 0.00 0.74 -1.83 0.00 0.00 177.26 176.17 3hm7 h THR 342 N 2.69 0.25 -0.52 3.41 2.02 -1.75 -0.19 112.91 118.81 3hm7 h THR 342 Ca 0.00 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.11 3hm7 h THR 342 Cb 0.62 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 3hm7 h THR 342 CO 0.00 0.00 0.05 0.25 0.37 0.00 0.00 175.52 176.19 3hm7 h LEU 343 N -0.37 0.86 -0.10 2.58 5.85 -1.83 -2.95 115.31 119.35 3hm7 h LEU 343 Ca 0.11 -0.28 0.04 0.00 0.84 0.00 0.00 57.88 58.59 3hm7 h LEU 343 Cb 0.55 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 3hm7 h LEU 343 CO -0.41 0.92 -0.16 0.00 -0.34 0.00 0.00 178.44 178.45 3hm7 h ALA 344 N 0.97 -0.11 -0.47 1.25 0.00 -1.53 -1.57 119.26 117.80 3hm7 h ALA 344 Ca 0.16 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.02 3hm7 h ALA 344 Cb 0.45 0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 3hm7 h ALA 344 CO 0.02 -0.63 -0.05 -0.24 0.00 0.00 0.00 179.25 178.35 3hm7 h VAL 345 N -0.22 1.25 -0.76 0.00 3.04 -1.15 -2.69 116.25 115.73 3hm7 h VAL 345 Ca 0.09 -1.10 0.00 0.00 -1.01 0.00 0.00 66.70 64.68 3hm7 h VAL 345 Cb 0.34 0.95 -0.04 0.00 -2.01 0.00 0.00 31.29 30.53 3hm7 h VAL 345 CO -0.23 0.38 0.49 0.24 -1.01 0.00 0.00 177.57 177.44 3hm7 h MET 346 N 0.75 1.01 -0.56 4.17 2.07 -1.26 0.27 114.93 121.38 3hm7 h MET 346 Ca 0.14 -0.07 -0.05 0.00 -2.07 0.00 0.00 59.70 57.64 3hm7 h MET 346 Cb 0.53 -0.22 -0.03 0.00 -1.87 0.00 0.00 31.60 30.01 3hm7 h MET 346 CO 0.03 0.68 0.14 1.25 1.07 0.00 0.00 176.91 180.08 3hm7 h LEU 347 N 1.03 0.81 0.00 1.22 5.85 -1.28 0.98 115.31 123.92 3hm7 h LEU 347 Ca 0.28 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.85 3hm7 h LEU 347 Cb -0.10 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 40.72 3hm7 h LEU 347 CO -0.06 0.79 -0.06 0.74 -0.34 0.00 0.00 178.44 179.52 3hm7 h THR 348 N 0.83 0.00 -0.35 1.05 2.02 -1.10 -2.37 112.91 112.99 3hm7 h THR 348 Ca 0.18 -0.82 -0.15 0.00 0.77 0.00 0.00 66.41 66.39 3hm7 h THR 348 Cb 0.30 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 66.70 3hm7 h THR 348 CO -0.00 0.00 -0.38 -0.33 0.37 0.00 0.00 175.52 175.18 3hm7 h GLU 349 N -0.82 0.84 0.00 6.66 4.39 -0.59 -0.68 114.58 124.37 3hm7 h GLU 349 Ca 0.00 -0.43 0.00 0.00 0.34 0.00 0.00 59.36 59.27 3hm7 h GLU 349 Cb 0.06 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.72 3hm7 h GLU 349 CO 0.00 1.07 -0.23 0.78 -1.16 0.00 0.00 179.01 179.47 3hm7 h GLY 350 N 0.87 0.00 0.67 -3.84 0.00 -0.94 -1.89 103.07 97.94 3hm7 h GLY 350 Ca 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 3hm7 h GLY 350 CO 0.09 0.00 -0.20 -1.82 0.00 0.00 0.00 176.54 174.61 3hm7 h TYR 351 N -0.64 -0.51 0.12 5.60 5.03 -1.50 0.29 116.97 125.36 3hm7 h TYR 351 Ca 0.00 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.29 3hm7 h TYR 351 Cb 0.23 0.17 0.00 0.00 1.55 0.00 0.00 36.73 38.68 3hm7 h TYR 351 CO -0.10 -0.19 -0.06 0.45 -1.32 0.00 0.00 178.16 176.95 3hm7 h HIS 352 N -0.89 -0.15 0.12 -3.82 3.86 -1.39 -2.92 115.15 109.96 3hm7 h HIS 352 Ca -0.06 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.14 3hm7 h HIS 352 Cb 0.56 0.05 0.00 0.00 1.06 0.00 0.00 27.41 29.08 3hm7 h HIS 352 CO 0.02 0.32 -0.06 -0.22 0.86 0.00 0.00 177.93 178.84 3hm7 h LYS 353 N -0.90 -0.15 -0.52 2.45 3.64 -1.22 -3.37 116.57 116.50 3hm7 h LYS 353 Ca -0.02 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3hm7 h LYS 353 Cb 0.53 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.39 3hm7 h LYS 353 CO 0.03 0.33 0.00 0.54 -2.27 0.00 0.00 179.45 178.07 3hm7 n ARG 354 N -4.89 3.01 -3.27 1.90 1.74 -0.71 -4.98 116.66 109.46 3hm7 n ARG 354 Ca -0.08 -2.48 -0.24 0.00 -0.77 0.00 0.00 57.85 54.28 3hm7 n ARG 354 Cb 0.28 -1.54 0.03 0.00 -1.02 0.00 0.00 32.46 30.21 3hm7 n ARG 354 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3hm7 n LYS 355 N 0.90 -5.16 -2.59 5.56 5.02 0.27 -4.91 118.16 117.26 3hm7 n LYS 355 Ca 0.19 0.78 -0.41 0.00 -2.02 0.00 0.00 58.31 56.86 3hm7 n LYS 355 Cb 0.62 -5.65 -0.05 0.00 -0.02 0.00 0.00 35.03 29.94 3hm7 n LYS 355 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3hm7 s MET 356 N -5.96 4.68 0.49 1.97 0.23 0.75 -4.93 119.30 116.53 3hm7 s MET 356 Ca 0.41 1.65 -0.22 0.00 -1.03 0.00 0.00 55.69 56.50 3hm7 s MET 356 Cb -0.19 -3.27 -0.06 0.00 -1.53 0.00 0.00 34.83 29.78 3hm7 s MET 356 CO 0.50 0.23 1.21 -2.14 -2.03 0.00 0.00 175.02 172.80 3hm7 s PRO 357 N -0.80 3.55 0.32 3.16 0.02 -1.26 -4.00 135.00 136.00 3hm7 s PRO 357 Ca 0.46 1.87 -0.00 0.00 0.02 0.00 0.00 61.00 63.35 3hm7 s PRO 357 Cb -0.28 -2.32 0.52 0.00 0.02 0.00 0.00 34.50 32.43 3hm7 s PRO 357 CO 0.35 -0.75 1.98 -0.07 -0.33 0.00 0.00 177.00 178.18 3hm7 h LEU 358 N 1.80 0.87 -1.19 -5.54 3.38 -1.97 -2.46 115.31 110.21 3hm7 h LEU 358 Ca -0.50 -0.02 0.11 0.00 0.09 0.00 0.00 57.88 57.56 3hm7 h LEU 358 Cb 1.26 -0.21 -0.07 0.00 0.09 0.00 0.00 40.66 41.73 3hm7 h LEU 358 CO 0.59 0.62 0.58 0.71 0.09 0.00 0.00 178.44 181.03 3hm7 h THR 359 N 1.02 0.94 0.00 0.22 1.35 -1.86 0.25 112.91 114.83 3hm7 h THR 359 Ca 0.29 -0.30 -0.10 0.00 -0.55 0.00 0.00 66.41 65.76 3hm7 h THR 359 Cb -0.07 -0.01 -0.01 0.00 -1.73 0.00 0.00 68.15 66.33 3hm7 h THR 359 CO -0.07 0.16 -0.47 -0.61 -0.25 0.00 0.00 175.52 174.28 3hm7 h GLN 360 N 0.87 0.00 0.00 4.72 4.15 -1.65 -1.61 115.11 121.59 3hm7 h GLN 360 Ca 0.43 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.73 3hm7 h GLN 360 Cb 0.48 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.15 3hm7 h GLN 360 CO -0.19 0.47 -0.56 0.97 -1.93 0.00 0.00 178.83 177.58 3hm7 h ILE 361 N 0.00 1.06 -0.25 2.39 2.10 -0.94 -1.90 117.51 119.97 3hm7 h ILE 361 Ca -0.00 -2.22 -0.03 0.00 1.08 0.00 0.00 64.86 63.68 3hm7 h ILE 361 Cb 0.89 2.33 -0.01 0.00 -1.09 0.00 0.00 36.82 38.94 3hm7 h ILE 361 CO 0.06 0.55 0.02 0.58 -1.08 0.00 0.00 178.15 178.28 3hm7 h VAL 362 N 0.00 1.24 -0.25 2.19 2.07 -1.17 -2.37 116.25 117.96 3hm7 h VAL 362 Ca -0.01 -0.83 0.05 0.00 0.82 0.00 0.00 66.70 66.73 3hm7 h VAL 362 Cb 1.29 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 32.30 3hm7 h VAL 362 CO 0.07 0.26 -0.07 -0.61 0.02 0.00 0.00 177.57 177.25 3hm7 h GLN 363 N 0.23 -0.01 0.00 1.57 4.15 -1.09 -0.68 115.11 119.28 3hm7 h GLN 363 Ca 0.07 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.36 3hm7 h GLN 363 Cb 0.37 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.04 3hm7 h GLN 363 CO 0.01 -0.01 -0.66 -0.07 -1.93 0.00 0.00 178.83 176.18 3hm7 h LEU 364 N -0.01 0.00 -0.46 -2.39 3.38 -1.41 0.97 115.31 115.39 3hm7 h LEU 364 Ca 0.12 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3hm7 h LEU 364 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3hm7 h LEU 364 CO -0.26 0.62 -0.58 0.18 0.09 0.00 0.00 178.44 178.49 3hm7 n LEU 365 N -3.24 1.27 0.09 1.67 4.32 -0.89 0.12 117.00 120.33 3hm7 n LEU 365 Ca 0.01 -0.63 0.00 0.00 -0.02 0.00 0.00 56.01 55.37 3hm7 n LEU 365 Cb 0.79 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.59 3hm7 n LEU 365 CO 0.42 0.26 0.00 -0.24 -1.22 0.00 0.00 177.39 176.61 3hm7 n SER 366 N -0.74 -0.20 -0.06 -1.43 2.88 -0.32 0.12 113.62 113.87 3hm7 n SER 366 Ca 0.05 0.30 -0.14 0.00 -1.33 0.00 0.00 58.87 57.76 3hm7 n SER 366 Cb 0.32 0.33 -0.12 0.00 -0.75 0.00 0.00 64.21 63.99 3hm7 n SER 366 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 3hm7 h THR 367 N 0.00 1.69 -0.45 2.46 2.02 -1.36 -2.31 112.91 114.97 3hm7 h THR 367 Ca 0.00 -2.05 -0.12 0.00 0.77 0.00 0.00 66.41 65.01 3hm7 h THR 367 Cb 0.00 3.08 -0.01 0.00 -1.74 0.00 0.00 68.15 69.48 3hm7 h THR 367 CO 0.00 0.53 -0.19 -0.33 0.37 0.00 0.00 175.52 175.90 3hm7 h GLU 368 N -0.87 0.88 -0.84 6.66 4.39 -1.05 0.11 114.58 123.86 3hm7 h GLU 368 Ca -0.00 -0.35 0.17 0.00 0.34 0.00 0.00 59.36 59.52 3hm7 h GLU 368 Cb 0.87 -0.04 -0.11 0.00 -0.10 0.00 0.00 28.75 29.37 3hm7 h GLU 368 CO 0.00 0.99 0.38 -1.35 -1.16 0.00 0.00 179.01 177.87 3hm7 h PRO 369 N 0.77 0.47 -0.25 2.33 0.11 -1.77 -0.60 132.00 133.06 3hm7 h PRO 369 Ca 0.11 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 66.15 3hm7 h PRO 369 Cb 0.73 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.72 3hm7 h PRO 369 CO 0.06 0.31 0.01 0.00 -0.21 0.00 0.00 178.00 178.17 3hm7 h ALA 370 N 1.61 0.33 -0.15 -0.75 0.00 -0.96 -3.22 119.26 116.13 3hm7 h ALA 370 Ca 0.48 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 3hm7 h ALA 370 Cb 0.79 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3hm7 h ALA 370 CO -0.44 0.05 0.06 0.87 0.00 0.00 0.00 179.25 179.80 3hm7 h LYS 371 N 0.21 0.21 0.00 0.00 1.57 -0.38 -1.07 116.57 117.12 3hm7 h LYS 371 Ca 0.07 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 3hm7 h LYS 371 Cb 0.39 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 3hm7 h LYS 371 CO 0.01 0.28 -0.04 -0.09 -0.57 0.00 0.00 179.45 179.04 3hm7 h ARG 372 N 0.09 0.00 -0.17 3.15 9.65 -1.21 -3.03 114.38 122.87 3hm7 h ARG 372 Ca 0.05 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.93 3hm7 h ARG 372 Cb 0.15 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.73 3hm7 h ARG 372 CO -0.01 0.04 0.00 1.19 2.80 0.00 0.00 179.97 184.00 3hm7 n PHE 373 N -4.36 0.21 -0.20 2.20 3.72 -1.17 -5.00 117.46 112.87 3hm7 n PHE 373 Ca -0.03 -0.27 0.00 0.00 -0.05 0.00 0.00 57.45 57.10 3hm7 n PHE 373 Cb 0.13 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.65 3hm7 n PHE 373 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hm7 n GLY 374 N 0.45 0.89 2.22 1.37 0.00 -0.95 -4.98 105.19 104.20 3hm7 n GLY 374 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 3hm7 n GLY 374 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3hm7 n LEU 375 N 0.00 6.39 -4.19 0.99 4.77 -0.45 -4.95 117.00 119.56 3hm7 n LEU 375 Ca 0.00 -4.55 -0.29 0.00 -0.03 0.00 0.00 56.01 51.15 3hm7 n LEU 375 Cb 0.00 -0.69 -0.16 0.00 -2.33 0.00 0.00 43.42 40.24 3hm7 n LEU 375 CO 0.00 1.79 -0.53 -0.47 -1.33 0.00 0.00 177.39 176.85 3hm7 s TYR 376 N -3.73 2.04 -0.37 -1.77 6.14 -1.23 -0.95 117.35 117.47 3hm7 s TYR 376 Ca 0.58 -0.61 0.08 0.00 0.64 0.00 0.00 57.07 57.76 3hm7 s TYR 376 Cb 0.46 -1.36 0.62 0.00 0.42 0.00 0.00 41.96 42.10 3hm7 s TYR 376 CO -0.01 -0.20 1.63 -0.35 0.64 0.00 0.00 175.55 177.26 3hm7 n PRO 377 N 3.07 3.25 0.02 4.97 -0.04 -1.26 -4.96 135.00 140.05 3hm7 n PRO 377 Ca -0.18 -2.53 -0.12 0.00 -0.04 0.00 0.00 63.50 60.62 3hm7 n PRO 377 Cb 0.52 -2.06 -0.08 0.00 -0.04 0.00 0.00 33.50 31.84 3hm7 n PRO 377 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 3hm7 h GLN 378 N 2.19 -0.00 -6.18 0.54 4.15 -1.93 -3.42 115.11 110.46 3hm7 h GLN 378 Ca 0.23 0.00 -0.53 0.00 0.77 0.00 0.00 58.65 59.12 3hm7 h GLN 378 Cb 2.08 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 29.71 3hm7 h GLN 378 CO 0.63 0.18 -0.55 0.15 -1.93 0.00 0.00 178.83 177.31 3hm7 s LYS 379 N -5.47 2.59 0.00 1.69 1.02 -0.13 -1.75 119.74 117.69 3hm7 s LYS 379 Ca -0.14 -1.30 0.00 0.00 0.02 0.00 0.00 55.97 54.54 3hm7 s LYS 379 Cb 0.04 -2.35 0.00 0.00 -0.52 0.00 0.00 37.83 35.00 3hm7 s LYS 379 CO 0.67 0.28 0.00 0.41 -0.92 0.00 0.00 175.35 175.78 3hm7 n GLY 380 N -1.12 0.73 3.09 -3.33 0.00 -1.26 -4.43 105.19 98.85 3hm7 n GLY 380 Ca -0.05 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.89 3hm7 n GLY 380 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hm7 s THR 381 N -2.34 0.28 -0.41 2.61 -4.23 -1.26 -4.41 115.64 105.87 3hm7 s THR 381 Ca 0.00 -1.70 0.01 0.00 -1.18 0.00 0.00 61.69 58.82 3hm7 s THR 381 Cb 0.00 -1.36 0.11 0.00 1.34 0.00 0.00 72.50 72.59 3hm7 s THR 381 CO 0.00 -0.91 0.17 -0.63 -0.54 0.00 0.00 174.62 172.71 3hm7 s ILE 382 N -3.52 2.82 0.09 2.99 1.01 -1.26 -4.81 121.20 118.53 3hm7 s ILE 382 Ca 0.04 -2.39 -0.16 0.00 0.00 0.00 0.00 60.65 58.14 3hm7 s ILE 382 Cb 0.05 -2.98 0.03 0.00 0.01 0.00 0.00 42.46 39.57 3hm7 s ILE 382 CO -0.08 -0.68 0.38 0.00 0.00 0.00 0.00 174.94 174.56 3hm7 s GLN 383 N 0.78 0.98 0.09 2.79 -2.07 -1.26 -5.07 119.66 115.91 3hm7 s GLN 383 Ca 0.11 -0.61 -0.31 0.00 -1.82 0.00 0.00 55.36 52.73 3hm7 s GLN 383 Cb -0.21 0.43 -0.10 0.00 -1.09 0.00 0.00 33.01 32.04 3hm7 s GLN 383 CO -0.05 -0.36 1.89 0.08 -1.32 0.00 0.00 175.29 175.53 3hm7 s VAL 384 N -3.32 2.71 0.00 3.63 1.01 -1.26 -1.99 120.40 121.18 3hm7 s VAL 384 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.01 3hm7 s VAL 384 Cb 0.01 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.37 3hm7 s VAL 384 CO -0.08 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.63 3hm7 n GLY 385 N 4.36 1.14 3.87 4.51 0.00 -0.15 -4.99 105.19 113.94 3hm7 n GLY 385 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 3hm7 n GLY 385 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hm7 s ALA 386 N -2.32 2.99 0.18 4.61 0.00 -0.84 -4.73 121.76 121.65 3hm7 s ALA 386 Ca 0.00 -0.19 -0.31 0.00 0.00 0.00 0.00 51.96 51.46 3hm7 s ALA 386 Cb 0.00 -3.06 -0.10 0.00 0.00 0.00 0.00 23.12 19.95 3hm7 s ALA 386 CO 0.00 -0.91 1.59 -2.00 0.00 0.00 0.00 175.76 174.44 3hm7 s GLU 387 N -5.25 4.20 -1.19 0.00 2.12 -0.72 -1.05 118.70 116.81 3hm7 s GLU 387 Ca 0.56 2.41 -0.09 0.00 0.36 0.00 0.00 54.97 58.21 3hm7 s GLU 387 Cb -0.11 -3.13 -0.07 0.00 0.26 0.00 0.00 34.13 31.08 3hm7 s GLU 387 CO 0.53 -0.62 2.39 0.00 -0.54 0.00 0.00 175.26 177.02 3hm7 n ALA 388 N 3.80 5.62 -3.90 6.30 0.00 -0.09 -4.76 120.51 127.49 3hm7 n ALA 388 Ca 0.14 -2.79 -0.33 0.00 0.00 0.00 0.00 53.44 50.45 3hm7 n ALA 388 Cb 0.38 -3.23 -0.14 0.00 0.00 0.00 0.00 19.45 16.45 3hm7 n ALA 388 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 3hm7 s SER 389 N 3.12 4.63 0.27 0.00 0.01 -1.26 -1.05 113.70 119.41 3hm7 s SER 389 Ca 0.52 -1.34 -0.09 0.00 1.31 0.00 0.00 55.95 56.35 3hm7 s SER 389 Cb 0.14 -1.62 -0.01 0.00 0.21 0.00 0.00 66.02 64.74 3hm7 s SER 389 CO -0.03 -0.22 0.44 0.72 0.41 0.00 0.00 173.24 174.56 3hm7 s PHE 390 N 1.16 0.63 -0.00 2.43 -0.71 -0.32 -1.11 117.98 120.06 3hm7 s PHE 390 Ca -0.07 -0.95 -0.00 0.00 -1.04 0.00 0.00 56.93 54.86 3hm7 s PHE 390 Cb -0.20 0.05 0.00 0.00 -1.21 0.00 0.00 43.02 41.66 3hm7 s PHE 390 CO -0.03 -1.00 0.01 -0.08 -1.34 0.00 0.00 175.22 172.77 3hm7 s THR 391 N -3.74 0.00 -0.21 -4.49 -1.32 0.15 -0.57 115.64 105.47 3hm7 s THR 391 Ca 0.26 -0.02 -0.09 0.00 -1.21 0.00 0.00 61.69 60.63 3hm7 s THR 391 Cb 0.00 -0.03 -0.05 0.00 -1.51 0.00 0.00 72.50 70.91 3hm7 s THR 391 CO 0.12 -0.01 0.12 -0.76 -2.21 0.00 0.00 174.62 171.88 3hm7 s LEU 392 N -0.03 4.05 -0.03 9.08 1.43 -0.06 -1.14 118.68 131.99 3hm7 s LEU 392 Ca -0.00 0.15 0.04 0.00 -1.03 0.00 0.00 54.13 53.28 3hm7 s LEU 392 Cb -0.00 -2.05 -0.00 0.00 0.03 0.00 0.00 46.19 44.16 3hm7 s LEU 392 CO -0.00 0.15 -0.14 -0.63 0.23 0.00 0.00 176.35 175.96 3hm7 s ILE 393 N 0.56 1.16 -0.48 -0.59 1.09 -0.39 -0.60 121.20 121.94 3hm7 s ILE 393 Ca 0.06 -0.57 -0.17 0.00 -1.10 0.00 0.00 60.65 58.87 3hm7 s ILE 393 Cb -0.12 -1.00 0.06 0.00 -1.06 0.00 0.00 42.46 40.34 3hm7 s ILE 393 CO 0.00 0.34 0.48 -0.62 -0.10 0.00 0.00 174.94 175.05 3hm7 s ASP 394 N 0.06 6.18 0.01 3.58 3.68 -0.49 -1.07 116.67 128.62 3hm7 s ASP 394 Ca -0.03 -1.08 -0.25 0.00 2.13 0.00 0.00 52.55 53.32 3hm7 s ASP 394 Cb -0.10 -2.23 -0.18 0.00 -1.45 0.00 0.00 42.92 38.97 3hm7 s ASP 394 CO 0.01 -0.73 1.32 -0.07 0.13 0.00 0.00 175.17 175.83 3hm7 h LEU 395 N 9.15 -0.17 -0.03 -1.34 3.38 -1.87 -2.45 115.31 121.99 3hm7 h LEU 395 Ca -0.28 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.43 3hm7 h LEU 395 Cb 1.10 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3hm7 h LEU 395 CO 0.90 0.19 0.00 0.59 0.09 0.00 0.00 178.44 180.21 3hm7 n ASN 396 N -5.02 0.14 -4.63 -0.43 3.02 -1.26 -2.02 115.26 105.06 3hm7 n ASN 396 Ca -0.09 0.52 -0.43 0.00 -0.03 0.00 0.00 54.58 54.55 3hm7 n ASN 396 Cb 0.22 -0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 38.81 3hm7 n ASN 396 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3hm7 s GLU 397 N -3.03 3.75 0.45 3.52 2.12 -1.10 -4.75 118.70 119.66 3hm7 s GLU 397 Ca 0.12 1.93 -0.08 0.00 0.36 0.00 0.00 54.97 57.30 3hm7 s GLU 397 Cb 0.16 -4.12 -0.05 0.00 0.26 0.00 0.00 34.13 30.38 3hm7 s GLU 397 CO 0.49 -1.36 0.79 -1.12 -0.54 0.00 0.00 175.26 173.52 3hm7 s SER 398 N 4.98 6.39 -0.02 -1.70 0.01 -1.26 -0.49 113.70 121.61 3hm7 s SER 398 Ca 0.80 1.05 -0.30 0.00 1.31 0.00 0.00 55.95 58.81 3hm7 s SER 398 Cb -0.30 -2.30 0.11 0.00 0.21 0.00 0.00 66.02 63.74 3hm7 s SER 398 CO 0.33 -0.50 1.15 -0.72 0.41 0.00 0.00 173.24 173.91 3hm7 s TYR 399 N -2.58 -0.11 -0.06 2.43 1.13 -0.21 -4.96 117.35 112.99 3hm7 s TYR 399 Ca 0.50 -0.03 0.03 0.00 -1.41 0.00 0.00 57.07 56.16 3hm7 s TYR 399 Cb -0.10 0.56 -0.03 0.00 -1.10 0.00 0.00 41.96 41.29 3hm7 s TYR 399 CO 0.39 -0.41 -0.12 0.99 -2.51 0.00 0.00 175.55 173.88 3hm7 s THR 400 N -2.69 3.22 -0.18 -3.49 2.01 -1.26 -1.05 115.64 112.20 3hm7 s THR 400 Ca 0.12 -0.66 -0.14 0.00 0.31 0.00 0.00 61.69 61.32 3hm7 s THR 400 Cb 0.02 -2.28 -0.04 0.00 0.01 0.00 0.00 72.50 70.20 3hm7 s THR 400 CO -0.03 0.59 0.31 -0.22 -0.69 0.00 0.00 174.62 174.58 3hm7 s LEU 401 N -0.68 4.20 0.32 4.42 2.96 -1.04 -4.98 118.68 123.88 3hm7 s LEU 401 Ca 0.10 0.48 0.03 0.00 -0.22 0.00 0.00 54.13 54.52 3hm7 s LEU 401 Cb -0.11 -2.39 -0.06 0.00 0.50 0.00 0.00 46.19 44.13 3hm7 s LEU 401 CO 0.01 0.04 0.08 0.54 -1.32 0.00 0.00 176.35 175.70 3hm7 s ASN 402 N 0.71 2.09 0.37 3.68 6.03 -1.26 -0.48 114.94 126.07 3hm7 s ASN 402 Ca 0.17 -1.42 0.17 0.00 -1.03 0.00 0.00 52.86 50.75 3hm7 s ASN 402 Cb -0.14 0.06 1.09 0.00 -3.03 0.00 0.00 41.25 39.23 3hm7 s ASN 402 CO 0.05 -0.68 1.70 0.00 -2.03 0.00 0.00 177.10 176.15 3hm7 h ALA 403 N 2.15 2.11 -0.12 3.54 0.00 -1.97 -0.51 119.26 124.45 3hm7 h ALA 403 Ca -0.39 0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3hm7 h ALA 403 Cb 1.25 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 3hm7 h ALA 403 CO 0.66 -0.63 -0.01 0.77 0.00 0.00 0.00 179.25 180.03 3hm7 h SER 404 N 0.37 0.16 0.51 0.00 0.02 -1.97 -2.41 113.55 110.22 3hm7 h SER 404 Ca 0.69 -0.01 -0.13 0.00 -0.84 0.00 0.00 61.79 61.49 3hm7 h SER 404 Cb 1.65 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 64.13 3hm7 h SER 404 CO -0.46 0.20 -0.59 0.44 -1.14 0.00 0.00 176.83 175.29 3hm7 h ASP 405 N 0.17 0.09 -3.63 3.07 5.19 -1.51 -3.46 116.42 116.35 3hm7 h ASP 405 Ca 0.04 -0.05 -0.51 0.00 -0.62 0.00 0.00 57.03 55.89 3hm7 h ASP 405 Cb 0.14 -0.03 0.02 0.00 0.18 0.00 0.00 39.33 39.64 3hm7 h ASP 405 CO 0.00 0.66 0.53 -0.76 -3.12 0.00 0.00 179.24 176.55 3hm7 s LEU 406 N -7.78 4.49 -0.01 1.55 1.43 -0.91 -4.94 118.68 112.51 3hm7 s LEU 406 Ca -0.02 2.26 0.22 0.00 -1.03 0.00 0.00 54.13 55.56 3hm7 s LEU 406 Cb 0.13 -3.62 0.65 0.00 0.03 0.00 0.00 46.19 43.38 3hm7 s LEU 406 CO 0.77 -0.29 1.54 -1.22 0.23 0.00 0.00 176.35 177.38 3hm7 n TYR 407 N 1.92 1.00 -0.98 0.29 4.02 -1.26 -4.90 117.16 117.24 3hm7 n TYR 407 Ca 0.02 -0.51 -0.31 0.00 -0.01 0.00 0.00 57.90 57.10 3hm7 n TYR 407 Cb 0.45 -0.01 0.13 0.00 -0.02 0.00 0.00 39.34 39.89 3hm7 n TYR 407 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 3hm7 s TYR 408 N -1.04 2.10 0.28 -0.72 2.02 -1.26 -4.44 117.35 114.30 3hm7 s TYR 408 Ca 0.49 1.63 -0.02 0.00 -0.37 0.00 0.00 57.07 58.80 3hm7 s TYR 408 Cb 0.26 -3.19 0.40 0.00 -0.40 0.00 0.00 41.96 39.03 3hm7 s TYR 408 CO 0.33 -2.36 1.86 -0.09 -1.57 0.00 0.00 175.55 173.72 3hm7 h ARG 409 N -1.54 0.91 -4.84 -0.62 9.65 -1.80 -3.38 114.38 112.76 3hm7 h ARG 409 Ca -0.44 -0.15 -0.67 0.00 -1.10 0.00 0.00 59.98 57.62 3hm7 h ARG 409 Cb 1.25 -0.16 -0.37 0.00 -1.39 0.00 0.00 29.97 29.31 3hm7 h ARG 409 CO 0.47 0.75 -0.79 -1.01 2.80 0.00 0.00 179.97 182.19 3hm7 s HIS 410 N -5.41 3.26 -0.86 2.20 3.76 -1.26 -5.03 115.29 111.95 3hm7 s HIS 410 Ca -0.10 -2.34 -0.11 0.00 -0.15 0.00 0.00 55.06 52.36 3hm7 s HIS 410 Cb 0.16 -1.97 -0.08 0.00 1.11 0.00 0.00 32.58 31.80 3hm7 s HIS 410 CO 0.80 -0.88 2.03 -0.35 -0.85 0.00 0.00 174.74 175.49 3hm7 n PRO 411 N 4.43 1.88 -3.74 8.40 -0.04 -1.26 -4.77 135.00 139.89 3hm7 n PRO 411 Ca -0.13 -1.57 -0.15 0.00 -0.04 0.00 0.00 63.50 61.62 3hm7 n PRO 411 Cb 0.42 -2.59 -0.15 0.00 -0.04 0.00 0.00 33.50 31.14 3hm7 n PRO 411 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3hm7 s ILE 412 N 3.92 -0.07 -0.18 0.52 -4.36 -1.26 -4.70 121.20 115.07 3hm7 s ILE 412 Ca 0.44 0.22 -0.27 0.00 -0.26 0.00 0.00 60.65 60.78 3hm7 s ILE 412 Cb 0.11 -0.19 0.07 0.00 1.25 0.00 0.00 42.46 43.71 3hm7 s ILE 412 CO 0.01 0.09 0.73 -0.55 0.24 0.00 0.00 174.94 175.46 3hm7 s SER 413 N 1.29 -0.69 0.60 4.36 0.15 -1.26 -4.73 113.70 113.41 3hm7 s SER 413 Ca -0.07 1.11 0.36 0.00 0.70 0.00 0.00 55.95 58.05 3hm7 s SER 413 Cb -0.12 1.05 1.89 0.00 -1.71 0.00 0.00 66.02 67.13 3hm7 s SER 413 CO -0.05 -0.39 2.21 1.55 1.20 0.00 0.00 173.24 177.76 3hm7 h PRO 414 N 4.13 0.00 0.00 5.44 0.13 -1.81 -2.10 132.00 137.78 3hm7 h PRO 414 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 3hm7 h PRO 414 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 3hm7 h PRO 414 CO 0.19 0.03 0.00 0.66 -0.23 0.00 0.00 178.00 178.65 3hm7 n TYR 415 N -3.36 0.03 -2.02 1.56 4.01 -1.26 -4.75 117.16 111.38 3hm7 n TYR 415 Ca -0.02 0.01 -0.42 0.00 -0.16 0.00 0.00 57.90 57.31 3hm7 n TYR 415 Cb 0.16 -0.52 -0.03 0.00 -0.31 0.00 0.00 39.34 38.64 3hm7 n TYR 415 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3hm7 s VAL 416 N -3.01 3.47 0.00 -0.72 1.01 -0.79 -1.89 120.40 118.46 3hm7 s VAL 416 Ca 0.08 0.70 0.00 0.00 0.00 0.00 0.00 61.98 62.77 3hm7 s VAL 416 Cb 0.11 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 33.04 3hm7 s VAL 416 CO 0.33 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.00 3hm7 n GLY 417 N 4.03 0.36 3.78 4.51 0.00 0.37 -5.01 105.19 113.24 3hm7 n GLY 417 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 3hm7 n GLY 417 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3hm7 s GLN 418 N -0.82 4.57 -0.40 1.61 2.00 -0.80 -4.84 119.66 120.98 3hm7 s GLN 418 Ca 0.00 1.27 -0.19 0.00 -2.00 0.00 0.00 55.36 54.44 3hm7 s GLN 418 Cb 0.00 -2.88 0.01 0.00 0.80 0.00 0.00 33.01 30.94 3hm7 s GLN 418 CO 0.00 0.33 0.56 0.50 -0.50 0.00 0.00 175.29 176.19 3hm7 s ARG 419 N -1.91 3.38 0.04 1.67 3.52 -1.26 -2.49 118.95 121.90 3hm7 s ARG 419 Ca 0.48 -0.36 0.01 0.00 -0.13 0.00 0.00 55.73 55.73 3hm7 s ARG 419 Cb -0.19 -3.90 -0.04 0.00 -1.56 0.00 0.00 34.95 29.26 3hm7 s ARG 419 CO 0.24 -0.85 0.13 -0.06 -0.81 0.00 0.00 175.30 173.95 3hm7 s PHE 420 N 2.55 3.34 -0.21 5.12 2.99 -0.21 -4.97 117.98 126.58 3hm7 s PHE 420 Ca 0.19 0.19 0.01 0.00 0.00 0.00 0.00 56.93 57.32 3hm7 s PHE 420 Cb -0.15 -1.71 0.05 0.00 0.00 0.00 0.00 43.02 41.21 3hm7 s PHE 420 CO 0.16 0.56 -0.07 0.50 -0.00 0.00 0.00 175.22 176.37 3hm7 s ARG 421 N -2.22 1.76 0.00 0.44 3.52 -1.26 -1.04 118.95 120.14 3hm7 s ARG 421 Ca 0.29 -0.87 0.00 0.00 -0.13 0.00 0.00 55.73 55.02 3hm7 s ARG 421 Cb -0.12 -2.45 0.00 0.00 -1.56 0.00 0.00 34.95 30.82 3hm7 s ARG 421 CO 0.21 -0.51 0.00 0.41 -0.81 0.00 0.00 175.30 174.60 3hm7 n GLY 422 N 4.70 1.93 3.68 8.12 0.00 0.35 -3.86 105.19 120.12 3hm7 n GLY 422 Ca -0.13 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 3hm7 n GLY 422 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hm7 s LYS 423 N -0.31 2.78 -0.17 1.61 2.20 -0.94 -4.68 119.74 120.22 3hm7 s LYS 423 Ca 0.00 -0.62 -0.22 0.00 -0.36 0.00 0.00 55.97 54.77 3hm7 s LYS 423 Cb 0.00 -2.66 -0.03 0.00 -1.51 0.00 0.00 37.83 33.63 3hm7 s LYS 423 CO 0.00 0.62 0.66 0.54 -0.36 0.00 0.00 175.35 176.81 3hm7 s VAL 424 N -1.10 5.01 -0.22 4.02 0.11 -1.26 -1.40 120.40 125.56 3hm7 s VAL 424 Ca 0.20 1.27 0.08 0.00 -2.93 0.00 0.00 61.98 60.60 3hm7 s VAL 424 Cb -0.12 -3.98 -0.21 0.00 -1.53 0.00 0.00 36.38 30.55 3hm7 s VAL 424 CO 0.11 0.13 -0.03 0.29 -3.33 0.00 0.00 175.10 172.26 3hm7 n LYS 425 N 4.85 0.67 -3.91 1.54 4.76 0.23 -4.64 118.16 121.66 3hm7 n LYS 425 Ca -0.01 0.10 -0.10 0.00 -2.87 0.00 0.00 58.31 55.43 3hm7 n LYS 425 Cb 0.50 -1.55 -0.11 0.00 -1.84 0.00 0.00 35.03 32.03 3hm7 n LYS 425 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 3hm7 s HIS 426 N -2.51 0.11 -0.06 2.13 3.76 -1.10 -0.54 115.29 117.08 3hm7 s HIS 426 Ca -0.23 -0.24 -0.02 0.00 -0.15 0.00 0.00 55.06 54.43 3hm7 s HIS 426 Cb 0.08 -0.09 0.03 0.00 1.11 0.00 0.00 32.58 33.70 3hm7 s HIS 426 CO 0.71 -0.18 0.03 0.99 -0.85 0.00 0.00 174.74 175.44 3hm7 s THR 427 N -1.07 0.15 -0.22 1.30 2.01 -0.75 -0.88 115.64 116.18 3hm7 s THR 427 Ca -0.12 0.25 -0.07 0.00 0.31 0.00 0.00 61.69 62.06 3hm7 s THR 427 Cb -0.07 -0.36 -0.03 0.00 0.01 0.00 0.00 72.50 72.05 3hm7 s THR 427 CO 0.00 0.21 0.06 -0.63 -0.69 0.00 0.00 174.62 173.57 3hm7 s ILE 428 N 2.07 4.40 -0.24 1.82 1.09 0.27 -1.36 121.20 129.24 3hm7 s ILE 428 Ca 0.05 -0.15 0.02 0.00 -1.10 0.00 0.00 60.65 59.46 3hm7 s ILE 428 Cb -0.12 -3.02 0.04 0.00 -1.06 0.00 0.00 42.46 38.30 3hm7 s ILE 428 CO -0.04 0.38 -0.13 0.00 -0.10 0.00 0.00 174.94 175.05 3hm7 n GLN 430 N 4.52 -5.97 0.00 0.00 6.02 -0.92 -2.06 117.38 118.97 3hm7 n GLN 430 Ca -0.16 0.68 0.00 0.00 -0.01 0.00 0.00 57.00 57.50 3hm7 n GLN 430 Cb 0.45 -5.52 0.00 0.00 1.02 0.00 0.00 30.24 26.19 3hm7 n GLN 430 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3hm7 n GLY 431 N -1.66 2.79 3.71 1.08 0.00 -0.22 -4.23 105.19 106.66 3hm7 n GLY 431 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.50 3hm7 n GLY 431 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hm7 s LYS 432 N -0.09 4.52 -0.60 1.61 2.20 -0.87 -4.89 119.74 121.62 3hm7 s LYS 432 Ca 0.00 1.56 -0.27 0.00 -0.36 0.00 0.00 55.97 56.90 3hm7 s LYS 432 Cb 0.00 -3.41 0.00 0.00 -1.51 0.00 0.00 37.83 32.91 3hm7 s LYS 432 CO 0.00 -0.11 1.60 -1.58 -0.36 0.00 0.00 175.35 174.90 3hm7 s HIS 433 N 0.92 1.99 -0.08 4.03 5.65 -1.26 -0.71 115.29 125.83 3hm7 s HIS 433 Ca 0.54 0.51 0.18 0.00 0.25 0.00 0.00 55.06 56.54 3hm7 s HIS 433 Cb -0.25 -4.30 -0.26 0.00 -1.18 0.00 0.00 32.58 26.59 3hm7 s HIS 433 CO 0.29 -2.21 0.28 1.55 -0.65 0.00 0.00 174.74 174.00 3hm7 n VAL 434 N 6.95 0.45 -3.75 0.89 3.14 -0.46 -4.95 118.33 120.60 3hm7 n VAL 434 Ca 0.15 -0.55 -0.13 0.00 -2.96 0.00 0.00 64.34 60.85 3hm7 n VAL 434 Cb 0.50 -0.16 -0.11 0.00 -1.06 0.00 0.00 33.84 33.01 3hm7 n VAL 434 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 3hm7 s TYR 435 N -2.98 -0.38 -0.04 1.45 5.04 -0.94 -4.99 117.35 114.52 3hm7 s TYR 435 Ca -0.08 0.92 0.01 0.00 -2.44 0.00 0.00 57.07 55.48 3hm7 s TYR 435 Cb 0.09 0.13 0.02 0.00 0.35 0.00 0.00 41.96 42.56 3hm7 s TYR 435 CO 0.76 -0.19 -0.02 -1.14 -1.34 0.00 0.00 175.55 173.62 3hm7 s GLN 436 N 0.26 0.54 -0.38 4.97 0.74 -1.26 -1.81 119.66 122.71 3hm7 s GLN 436 Ca -0.01 -0.01 -0.29 0.00 0.05 0.00 0.00 55.36 55.11 3hm7 s GLN 436 Cb -0.03 -0.65 0.02 0.00 1.10 0.00 0.00 33.01 33.45 3hm7 s GLN 436 CO -0.00 -0.11 1.16 0.34 -0.55 0.00 0.00 175.29 176.13 3hm7 s ASP 437 N 0.99 6.73 0.00 6.67 2.15 0.30 -5.02 116.67 128.50 3hm7 s ASP 437 Ca -0.10 0.85 0.00 0.00 0.43 0.00 0.00 52.55 53.73 3hm7 s ASP 437 Cb -0.14 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.94 3hm7 s ASP 437 CO -0.01 -1.09 0.00 1.41 -0.17 0.00 0.00 175.17 175.31