#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hm7 h ARG 3 N 0.00 0.32 -6.74 1.97 2.43 -1.70 -3.45 114.38 107.21 3hm7 h ARG 3 Ca 0.00 -0.37 -0.68 0.00 -0.81 0.00 0.00 59.98 58.12 3hm7 h ARG 3 Cb 0.00 0.11 -0.20 0.00 -0.42 0.00 0.00 29.97 29.46 3hm7 h ARG 3 CO 0.00 1.07 -0.82 -0.06 -1.51 0.00 0.00 179.97 178.65 3hm7 s PHE 4 N -3.18 2.49 0.18 2.20 0.08 -0.93 -5.00 117.98 113.82 3hm7 s PHE 4 Ca -0.05 -0.29 -0.10 0.00 0.12 0.00 0.00 56.93 56.62 3hm7 s PHE 4 Cb 0.09 -1.35 0.08 0.00 -0.57 0.00 0.00 43.02 41.28 3hm7 s PHE 4 CO 0.86 0.35 1.68 -0.44 -0.10 0.00 0.00 175.22 177.56 3hm7 h ASP 5 N 3.90 1.01 -5.01 1.36 3.32 -1.45 -3.40 116.42 116.14 3hm7 h ASP 5 Ca -0.50 -0.26 -0.06 0.00 0.02 0.00 0.00 57.03 56.23 3hm7 h ASP 5 Cb 1.17 -0.27 -0.16 0.00 0.22 0.00 0.00 39.33 40.28 3hm7 h ASP 5 CO 0.45 1.02 0.05 -0.22 -1.72 0.00 0.00 179.24 178.82 3hm7 s LEU 6 N -9.48 -0.14 -0.04 1.55 2.96 -1.17 -4.32 118.68 108.05 3hm7 s LEU 6 Ca -0.12 0.24 -0.01 0.00 -0.22 0.00 0.00 54.13 54.01 3hm7 s LEU 6 Cb 0.14 2.17 0.03 0.00 0.50 0.00 0.00 46.19 49.03 3hm7 s LEU 6 CO 0.84 -0.71 0.07 -0.51 -1.32 0.00 0.00 176.35 174.72 3hm7 s ILE 7 N -2.30 -0.08 -0.09 6.68 2.07 -0.22 -0.10 121.20 127.16 3hm7 s ILE 7 Ca -0.06 0.27 -0.21 0.00 -1.41 0.00 0.00 60.65 59.23 3hm7 s ILE 7 Cb -0.01 -0.14 -0.04 0.00 0.13 0.00 0.00 42.46 42.40 3hm7 s ILE 7 CO -0.00 0.11 0.62 -0.63 -1.91 0.00 0.00 174.94 173.12 3hm7 s ILE 8 N 1.41 5.09 -0.06 2.00 -1.09 -0.16 -1.84 121.20 126.56 3hm7 s ILE 8 Ca -0.05 1.26 0.06 0.00 -2.23 0.00 0.00 60.65 59.68 3hm7 s ILE 8 Cb -0.12 -3.96 -0.01 0.00 -1.58 0.00 0.00 42.46 36.79 3hm7 s ILE 8 CO -0.04 0.27 -0.23 -0.13 -1.23 0.00 0.00 174.94 173.58 3hm7 s ARG 9 N 0.82 2.36 -0.01 2.79 0.52 -1.01 -1.48 118.95 122.93 3hm7 s ARG 9 Ca 0.33 -0.82 0.00 0.00 -0.52 0.00 0.00 55.73 54.71 3hm7 s ARG 9 Cb -0.17 -2.00 0.00 0.00 0.52 0.00 0.00 34.95 33.30 3hm7 s ARG 9 CO 0.15 0.34 0.00 0.43 0.02 0.00 0.00 175.30 176.24 3hm7 n SER 10 N 3.02 -3.23 -4.89 0.23 7.64 -1.25 -1.05 113.62 114.08 3hm7 n SER 10 Ca -0.18 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.46 3hm7 n SER 10 Cb 0.52 -0.74 0.07 0.00 -1.01 0.00 0.00 64.21 63.05 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 -2.05 4.86 -0.24 6.43 1.04 -1.21 -3.95 113.70 118.58 3hm7 s SER 11 Ca 0.00 0.21 -0.17 0.00 0.48 0.00 0.00 55.95 56.47 3hm7 s SER 11 Cb 0.00 -0.89 -0.03 0.00 0.10 0.00 0.00 66.02 65.20 3hm7 s SER 11 CO 0.00 -1.51 0.48 -0.89 0.98 0.00 0.00 173.24 172.29 3hm7 s THR 12 N -3.10 5.11 -0.15 2.02 2.01 -1.01 -2.51 115.64 118.00 3hm7 s THR 12 Ca 0.60 0.82 -0.29 0.00 0.31 0.00 0.00 61.69 63.13 3hm7 s THR 12 Cb -0.10 -3.79 -0.02 0.00 0.01 0.00 0.00 72.50 68.60 3hm7 s THR 12 CO 0.43 0.14 1.26 -0.69 -0.69 0.00 0.00 174.62 175.07 3hm7 s VAL 13 N 2.01 4.27 -0.14 3.82 1.01 0.49 0.39 120.40 132.24 3hm7 s VAL 13 Ca 0.20 1.54 -0.03 0.00 0.00 0.00 0.00 61.98 63.69 3hm7 s VAL 13 Cb -0.15 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.20 3hm7 s VAL 13 CO 0.09 -0.12 -0.03 0.68 0.00 0.00 0.00 175.10 175.72 3hm7 s VAL 14 N 3.36 3.98 0.14 2.92 -7.23 0.30 -1.90 120.40 121.99 3hm7 s VAL 14 Ca 0.55 -0.34 0.00 0.00 -1.81 0.00 0.00 61.98 60.39 3hm7 s VAL 14 Cb -0.22 -2.73 -0.00 0.00 0.56 0.00 0.00 36.38 33.99 3hm7 s VAL 14 CO 0.16 0.52 0.00 0.35 -0.31 0.00 0.00 175.10 175.81 3hm7 n THR 15 N 3.23 0.00 0.29 5.32 -2.24 0.41 -4.13 114.28 117.17 3hm7 n THR 15 Ca -0.18 -0.69 0.18 0.00 -2.27 0.00 0.00 64.05 61.10 3hm7 n THR 15 Cb 0.53 0.14 0.86 0.00 -2.10 0.00 0.00 70.33 69.76 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 -1.88 -3.34 114.58 112.68 3hm7 h GLU 16 Ca -0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.31 3hm7 h GLU 16 Cb 0.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.61 3hm7 h GLU 16 CO 0.20 0.03 -0.65 0.25 0.07 0.00 0.00 179.01 178.90 3hm7 n THR 17 N -3.18 0.00 -3.82 -1.06 -2.24 -1.26 -4.51 114.28 98.21 3hm7 n THR 17 Ca -0.01 -0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.68 3hm7 n THR 17 Cb 0.22 0.33 -0.04 0.00 -2.10 0.00 0.00 70.33 68.74 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 -1.31 0.03 0.03 4.28 -1.32 -1.25 -5.03 115.64 111.06 3hm7 s THR 18 Ca 0.00 -0.98 0.04 0.00 -1.21 0.00 0.00 61.69 59.54 3hm7 s THR 18 Cb 0.00 -1.74 -0.02 0.00 -1.51 0.00 0.00 72.50 69.24 3hm7 s THR 18 CO 0.00 -0.12 -0.13 0.42 -2.21 0.00 0.00 174.62 172.58 3hm7 s THR 19 N -3.91 0.99 -0.07 5.08 -4.23 -1.26 -0.45 115.64 111.78 3hm7 s THR 19 Ca 0.12 -0.90 -0.30 0.00 -1.18 0.00 0.00 61.69 59.44 3hm7 s THR 19 Cb -0.01 -0.90 0.10 0.00 1.34 0.00 0.00 72.50 73.04 3hm7 s THR 19 CO -0.00 -0.00 0.85 -0.72 -0.54 0.00 0.00 174.62 174.21 3hm7 s TYR 20 N -0.79 -0.47 -0.08 3.99 -0.85 -0.80 -5.01 117.35 113.34 3hm7 s TYR 20 Ca 0.01 0.69 -0.23 0.00 -0.52 0.00 0.00 57.07 57.02 3hm7 s TYR 20 Cb -0.07 0.46 -0.04 0.00 0.38 0.00 0.00 41.96 42.69 3hm7 s TYR 20 CO 0.01 -0.50 0.69 1.03 -1.52 0.00 0.00 175.55 175.26 3hm7 s ARG 21 N -1.69 4.42 0.15 -3.49 1.81 -1.26 -0.38 118.95 118.51 3hm7 s ARG 21 Ca -0.03 0.85 -0.24 0.00 -1.72 0.00 0.00 55.73 54.58 3hm7 s ARG 21 Cb -0.00 -3.45 0.07 0.00 -0.45 0.00 0.00 34.95 31.11 3hm7 s ARG 21 CO 0.01 0.05 0.71 0.00 -0.68 0.00 0.00 175.30 175.39 3hm7 s ALA 22 N 0.86 -1.58 -0.08 2.13 0.00 -1.05 -4.45 121.76 117.59 3hm7 s ALA 22 Ca 0.36 0.42 -0.04 0.00 0.00 0.00 0.00 51.96 52.71 3hm7 s ALA 22 Cb -0.17 0.76 -0.04 0.00 0.00 0.00 0.00 23.12 23.67 3hm7 s ALA 22 CO 0.17 -0.82 0.08 -0.51 0.00 0.00 0.00 175.76 174.68 3hm7 s ASP 23 N -2.74 5.83 -0.14 0.00 -0.00 -0.10 -3.62 116.67 115.90 3hm7 s ASP 23 Ca 0.05 0.28 0.01 0.00 -0.00 0.00 0.00 52.55 52.89 3hm7 s ASP 23 Cb -0.02 -1.77 0.02 0.00 -0.00 0.00 0.00 42.92 41.15 3hm7 s ASP 23 CO -0.07 0.37 -0.16 -0.69 -0.00 0.00 0.00 175.17 174.61 3hm7 s VAL 24 N -1.02 1.66 -0.18 -1.27 1.01 -0.55 -0.67 120.40 119.38 3hm7 s VAL 24 Ca 0.16 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.40 3hm7 s VAL 24 Cb -0.12 -1.52 -0.02 0.00 0.00 0.00 0.00 36.38 34.72 3hm7 s VAL 24 CO 0.06 0.47 -0.04 0.00 0.00 0.00 0.00 175.10 175.59 3hm7 s ALA 25 N 1.19 2.94 -0.15 5.51 0.00 0.84 -0.98 121.76 131.11 3hm7 s ALA 25 Ca -0.01 -0.93 -0.07 0.00 0.00 0.00 0.00 51.96 50.95 3hm7 s ALA 25 Cb -0.14 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 21.34 3hm7 s ALA 25 CO -0.06 0.01 0.10 0.42 0.00 0.00 0.00 175.76 176.23 3hm7 s ILE 26 N 0.72 5.11 -0.15 0.00 1.01 0.86 -0.29 121.20 128.46 3hm7 s ILE 26 Ca -0.02 0.07 -0.04 0.00 0.00 0.00 0.00 60.65 60.66 3hm7 s ILE 26 Cb -0.14 -3.26 0.07 0.00 0.01 0.00 0.00 42.46 39.14 3hm7 s ILE 26 CO 0.02 0.54 0.22 -0.13 0.00 0.00 0.00 174.94 175.59 3hm7 s ARG 27 N -0.37 0.13 -1.33 2.79 1.81 -0.62 -1.14 118.95 120.23 3hm7 s ARG 27 Ca 0.10 0.49 -0.04 0.00 -1.72 0.00 0.00 55.73 54.56 3hm7 s ARG 27 Cb -0.12 -0.55 0.02 0.00 -0.45 0.00 0.00 34.95 33.86 3hm7 s ARG 27 CO 0.01 -0.43 0.93 0.09 -0.68 0.00 0.00 175.30 175.22 3hm7 n ASN 28 N 5.33 -3.11 0.00 0.23 5.03 -1.26 -3.05 115.26 118.43 3hm7 n ASN 28 Ca -0.05 -0.70 0.00 0.00 0.87 0.00 0.00 54.58 54.69 3hm7 n ASN 28 Cb 0.50 -4.52 0.00 0.00 -1.02 0.00 0.00 39.78 34.74 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 -1.56 1.50 3.51 7.41 0.00 -1.26 -4.99 105.19 109.80 3hm7 n GLY 29 Ca -0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 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 -3.18 2.67 -0.02 -0.61 -4.36 -1.17 -0.08 121.20 114.46 3hm7 s ILE 30 Ca 0.00 -2.29 -0.30 0.00 -0.26 0.00 0.00 60.65 57.80 3hm7 s ILE 30 Cb 0.00 -2.44 -0.04 0.00 1.25 0.00 0.00 42.46 41.23 3hm7 s ILE 30 CO 0.00 -0.38 1.14 -0.69 0.24 0.00 0.00 174.94 175.25 3hm7 s VAL 31 N -2.48 4.37 -0.24 8.37 1.01 0.14 -1.59 120.40 130.00 3hm7 s VAL 31 Ca 0.31 1.69 0.03 0.00 0.00 0.00 0.00 61.98 64.00 3hm7 s VAL 31 Cb -0.05 -4.09 -0.16 0.00 0.00 0.00 0.00 36.38 32.09 3hm7 s VAL 31 CO 0.16 0.06 -0.20 -0.24 0.00 0.00 0.00 175.10 174.88 3hm7 n SER 32 N 4.63 2.07 -3.69 3.32 2.88 0.60 -0.95 113.62 122.47 3hm7 n SER 32 Ca 0.09 -0.12 -0.11 0.00 -1.33 0.00 0.00 58.87 57.40 3hm7 n SER 32 Cb 0.47 -0.31 -0.10 0.00 -0.75 0.00 0.00 64.21 63.53 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 -2.47 -1.21 -0.14 -1.46 0.00 -1.11 -4.84 121.76 110.52 3hm7 s ALA 33 Ca -0.31 1.58 -0.01 0.00 0.00 0.00 0.00 51.96 53.23 3hm7 s ALA 33 Cb 0.08 -0.94 -0.02 0.00 0.00 0.00 0.00 23.12 22.24 3hm7 s ALA 33 CO 0.56 -0.27 -0.11 0.42 0.00 0.00 0.00 175.76 176.36 3hm7 s ILE 34 N 0.99 3.19 0.17 0.00 1.01 -1.26 -0.11 121.20 125.19 3hm7 s ILE 34 Ca -0.06 -0.60 0.02 0.00 0.00 0.00 0.00 60.65 60.01 3hm7 s ILE 34 Cb -0.06 -2.36 -0.05 0.00 0.01 0.00 0.00 42.46 40.00 3hm7 s ILE 34 CO -0.09 0.51 -0.02 0.42 0.00 0.00 0.00 174.94 175.76 3hm7 s THR 35 N 0.46 0.79 0.65 2.92 -4.23 0.16 -4.99 115.64 111.40 3hm7 s THR 35 Ca -0.08 -1.99 -0.17 0.00 -1.18 0.00 0.00 61.69 58.27 3hm7 s THR 35 Cb -0.15 -2.05 -0.00 0.00 1.34 0.00 0.00 72.50 71.63 3hm7 s THR 35 CO 0.04 -0.55 1.21 -1.83 -0.54 0.00 0.00 174.62 172.95 3hm7 s GLU 36 N -3.87 2.63 -0.09 3.99 -1.05 -1.26 -0.93 118.70 118.12 3hm7 s GLU 36 Ca 0.22 1.79 -0.29 0.00 -0.15 0.00 0.00 54.97 56.53 3hm7 s GLU 36 Cb 0.05 -1.89 -0.07 0.00 -0.44 0.00 0.00 34.13 31.79 3hm7 s GLU 36 CO 0.03 -1.46 1.97 -2.14 0.95 0.00 0.00 175.26 174.60 3hm7 s PRO 37 N -3.60 3.79 0.00 -4.83 0.02 -1.26 -2.22 135.00 126.89 3hm7 s PRO 37 Ca 0.76 2.26 0.00 0.00 0.02 0.00 0.00 61.00 64.04 3hm7 s PRO 37 Cb -0.30 -4.19 0.00 0.00 0.02 0.00 0.00 34.50 30.03 3hm7 s PRO 37 CO 0.39 -1.35 0.00 0.41 -0.33 0.00 0.00 177.00 176.12 3hm7 n GLY 38 N 4.90 0.52 0.24 0.52 0.00 -1.26 -4.98 105.19 105.13 3hm7 n GLY 38 Ca 0.22 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.35 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 0.00 -3.21 1.61 0.87 -1.81 -3.43 113.55 107.59 3hm7 h SER 39 Ca 0.00 0.00 -0.59 0.00 -1.23 0.00 0.00 61.79 59.97 3hm7 h SER 39 Cb 0.00 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 61.88 3hm7 h SER 39 CO 0.00 0.19 -0.26 -0.63 -0.53 0.00 0.00 176.83 175.60 3hm7 s ILE 40 N -4.04 5.23 0.28 2.23 1.01 -1.26 -5.04 121.20 119.61 3hm7 s ILE 40 Ca -0.02 0.70 -0.29 0.00 0.00 0.00 0.00 60.65 61.04 3hm7 s ILE 40 Cb 0.12 -3.68 -0.14 0.00 0.01 0.00 0.00 42.46 38.77 3hm7 s ILE 40 CO 0.62 0.42 1.07 -1.20 0.00 0.00 0.00 174.94 175.85 3hm7 n SER 41 N 3.16 1.49 0.29 3.58 7.64 -1.26 -4.89 113.62 123.63 3hm7 n SER 41 Ca -0.11 1.18 0.17 0.00 1.01 0.00 0.00 58.87 61.12 3hm7 n SER 41 Cb 0.52 -1.30 0.81 0.00 -1.01 0.00 0.00 64.21 63.23 3hm7 n SER 41 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 3hm7 h SER 42 N 2.29 0.00 -1.19 6.43 0.87 -1.95 -2.62 113.55 117.39 3hm7 h SER 42 Ca -0.41 0.00 -0.69 0.00 -1.23 0.00 0.00 61.79 59.46 3hm7 h SER 42 Cb 1.33 0.00 -0.29 0.00 -0.44 0.00 0.00 62.40 63.00 3hm7 h SER 42 CO 0.62 0.04 0.87 0.47 -0.53 0.00 0.00 176.83 178.31 3hm7 n ASP 43 N -3.19 7.62 -0.05 6.23 9.92 -1.26 -4.49 116.55 131.33 3hm7 n ASP 43 Ca -0.01 -3.80 0.01 0.00 -0.53 0.00 0.00 54.79 50.47 3hm7 n ASP 43 Cb 0.25 -0.98 0.02 0.00 -0.64 0.00 0.00 41.12 39.76 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 -0.84 1.30 0.00 -2.24 9.92 -0.99 -4.28 116.55 119.43 3hm7 n ASP 44 Ca 0.61 -1.85 0.00 0.00 -0.53 0.00 0.00 54.79 53.02 3hm7 n ASP 44 Cb 0.58 -0.07 0.00 0.00 -0.64 0.00 0.00 41.12 40.99 3hm7 n ASP 44 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3hm7 n GLY 45 N -0.44 3.50 3.77 0.44 0.00 -1.26 -1.88 105.19 109.32 3hm7 n GLY 45 Ca 0.02 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.55 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 -2.29 4.17 -0.01 1.61 0.02 -1.26 -4.83 135.00 132.40 3hm7 s PRO 46 Ca 0.00 2.48 0.05 0.00 0.02 0.00 0.00 61.00 63.55 3hm7 s PRO 46 Cb 0.00 -3.01 -0.01 0.00 0.02 0.00 0.00 34.50 31.50 3hm7 s PRO 46 CO 0.00 -0.47 -0.15 0.00 -0.33 0.00 0.00 177.00 176.05 3hm7 s ALA 47 N -0.87 1.25 -0.23 -1.55 0.00 -1.26 -1.05 121.76 118.05 3hm7 s ALA 47 Ca 0.54 -0.64 -0.13 0.00 0.00 0.00 0.00 51.96 51.74 3hm7 s ALA 47 Cb -0.45 -0.33 -0.05 0.00 0.00 0.00 0.00 23.12 22.29 3hm7 s ALA 47 CO 0.57 0.30 0.26 0.42 0.00 0.00 0.00 175.76 177.31 3hm7 s ILE 48 N -0.29 5.29 -0.50 0.00 -1.09 -0.77 -4.97 121.20 118.87 3hm7 s ILE 48 Ca 0.05 0.38 -0.28 0.00 -2.23 0.00 0.00 60.65 58.57 3hm7 s ILE 48 Cb -0.06 -3.59 0.01 0.00 -1.58 0.00 0.00 42.46 37.24 3hm7 s ILE 48 CO -0.00 0.29 1.42 -0.62 -1.23 0.00 0.00 174.94 174.79 3hm7 s ASP 49 N 1.16 6.20 -0.31 3.58 3.68 -1.26 -2.42 116.67 127.31 3hm7 s ASP 49 Ca 0.12 0.50 0.08 0.00 2.13 0.00 0.00 52.55 55.38 3hm7 s ASP 49 Cb -0.14 -2.54 0.53 0.00 -1.45 0.00 0.00 42.92 39.31 3hm7 s ASP 49 CO 0.07 -1.61 1.51 0.61 0.13 0.00 0.00 175.17 175.88 3hm7 n GLY 50 N 5.19 4.83 3.68 2.66 0.00 -0.22 -4.97 105.19 116.36 3hm7 n GLY 50 Ca 0.14 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.53 3hm7 n GLY 50 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hm7 s THR 51 N -3.24 3.46 0.00 2.61 2.01 -1.25 -2.66 115.64 116.57 3hm7 s THR 51 Ca 0.46 0.77 0.00 0.00 0.31 0.00 0.00 61.69 63.23 3hm7 s THR 51 Cb 0.41 -3.50 0.00 0.00 0.01 0.00 0.00 72.50 69.43 3hm7 s THR 51 CO 0.01 -0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.52 3hm7 n GLY 52 N 3.93 0.69 3.45 4.40 0.00 -1.26 -5.05 105.19 111.35 3hm7 n GLY 52 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 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 2.53 -0.12 0.99 1.43 -1.09 -4.70 118.68 117.72 3hm7 s LEU 53 Ca 0.00 -0.94 -0.03 0.00 -1.03 0.00 0.00 54.13 52.14 3hm7 s LEU 53 Cb 0.00 -1.16 -0.03 0.00 0.03 0.00 0.00 46.19 45.03 3hm7 s LEU 53 CO 0.00 0.08 -0.01 -1.00 0.23 0.00 0.00 176.35 175.65 3hm7 s HIS 54 N -2.08 3.10 -0.43 0.29 3.76 0.58 -2.42 115.29 118.09 3hm7 s HIS 54 Ca 0.25 -0.02 -0.15 0.00 -0.15 0.00 0.00 55.06 54.99 3hm7 s HIS 54 Cb -0.07 -1.88 0.04 0.00 1.11 0.00 0.00 32.58 31.79 3hm7 s HIS 54 CO 0.13 0.23 0.34 -1.17 -0.85 0.00 0.00 174.74 173.42 3hm7 s LEU 55 N -0.27 5.26 0.15 0.89 2.96 0.16 -0.84 118.68 126.99 3hm7 s LEU 55 Ca 0.05 -1.02 -0.02 0.00 -0.22 0.00 0.00 54.13 52.92 3hm7 s LEU 55 Cb -0.12 -2.18 -0.05 0.00 0.50 0.00 0.00 46.19 44.34 3hm7 s LEU 55 CO 0.02 -0.53 0.35 -0.36 -1.32 0.00 0.00 176.35 174.51 3hm7 s PHE 56 N 1.70 3.49 0.51 5.38 2.99 -0.57 -0.54 117.98 130.95 3hm7 s PHE 56 Ca 0.05 0.39 -0.21 0.00 0.00 0.00 0.00 56.93 57.17 3hm7 s PHE 56 Cb -0.21 -1.88 -0.06 0.00 0.00 0.00 0.00 43.02 40.87 3hm7 s PHE 56 CO 0.09 0.45 1.15 -2.14 -0.00 0.00 0.00 175.22 174.77 3hm7 s PRO 57 N -2.91 3.49 0.09 0.24 0.02 -1.26 -1.31 135.00 133.35 3hm7 s PRO 57 Ca 0.39 1.70 -0.34 0.00 0.02 0.00 0.00 61.00 62.76 3hm7 s PRO 57 Cb -0.12 -2.16 -0.13 0.00 0.02 0.00 0.00 34.50 32.11 3hm7 s PRO 57 CO 0.27 -0.76 1.65 0.41 -0.33 0.00 0.00 177.00 178.25 3hm7 n GLY 58 N 0.30 1.19 3.76 0.52 0.00 0.26 -4.68 105.19 106.54 3hm7 n GLY 58 Ca 0.10 0.71 -0.39 0.00 0.00 0.00 0.00 46.02 46.45 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 1.79 3.76 -0.29 1.61 1.00 -0.69 -4.55 119.30 121.94 3hm7 s MET 59 Ca 0.83 2.16 -0.01 0.00 0.00 0.00 0.00 55.69 58.67 3hm7 s MET 59 Cb -0.70 -2.61 0.05 0.00 0.00 0.00 0.00 34.83 31.57 3hm7 s MET 59 CO 0.42 -0.66 -0.03 0.08 0.00 0.00 0.00 175.02 174.83 3hm7 s VAL 60 N -1.30 2.77 -0.41 -6.03 1.01 0.13 -1.64 120.40 114.93 3hm7 s VAL 60 Ca 0.61 -1.43 -0.12 0.00 0.00 0.00 0.00 61.98 61.03 3hm7 s VAL 60 Cb -0.38 -2.59 0.05 0.00 0.00 0.00 0.00 36.38 33.46 3hm7 s VAL 60 CO 0.48 -0.07 0.28 -0.62 0.00 0.00 0.00 175.10 175.17 3hm7 s ASP 61 N 1.22 5.89 0.00 3.32 -1.08 -0.43 -4.48 116.67 121.10 3hm7 s ASP 61 Ca -0.06 -1.16 0.29 0.00 -0.52 0.00 0.00 52.55 51.09 3hm7 s ASP 61 Cb -0.20 -2.08 1.24 0.00 -1.46 0.00 0.00 42.92 40.42 3hm7 s ASP 61 CO -0.02 -0.49 1.87 1.33 0.52 0.00 0.00 175.17 178.38 3hm7 n VAL 62 N 5.06 0.00 -3.62 1.11 0.24 -1.26 -0.42 118.33 119.44 3hm7 n VAL 62 Ca -0.11 -0.05 -0.29 0.00 -2.04 0.00 0.00 64.34 61.84 3hm7 n VAL 62 Cb 0.45 -0.15 -0.14 0.00 -1.47 0.00 0.00 33.84 32.54 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 -2.52 1.29 0.06 6.34 5.65 -1.26 -4.47 115.29 120.38 3hm7 s HIS 63 Ca 0.28 -1.76 0.02 0.00 0.25 0.00 0.00 55.06 53.85 3hm7 s HIS 63 Cb 0.20 -1.41 -0.03 0.00 -1.18 0.00 0.00 32.58 30.16 3hm7 s HIS 63 CO 0.48 -0.83 -0.08 0.14 -0.65 0.00 0.00 174.74 173.80 3hm7 s VAL 64 N 1.19 0.64 -0.37 0.89 -7.23 -1.13 -1.72 120.40 112.68 3hm7 s VAL 64 Ca 0.14 -1.25 0.03 0.00 -1.81 0.00 0.00 61.98 59.09 3hm7 s VAL 64 Cb -0.21 -0.84 0.10 0.00 0.56 0.00 0.00 36.38 35.99 3hm7 s VAL 64 CO -0.13 -0.45 0.09 -1.00 -0.31 0.00 0.00 175.10 173.31 3hm7 s HIS 65 N -1.74 3.69 -0.99 2.82 3.76 -0.50 -0.81 115.29 121.52 3hm7 s HIS 65 Ca -0.05 -2.98 0.23 0.00 -0.15 0.00 0.00 55.06 52.11 3hm7 s HIS 65 Cb -0.07 -2.94 0.19 0.00 1.11 0.00 0.00 32.58 30.86 3hm7 s HIS 65 CO -0.00 -0.93 1.19 1.19 -0.85 0.00 0.00 174.74 175.34 3hm7 n PHE 66 N 4.15 0.01 -0.90 1.40 3.72 -1.26 -4.56 117.46 120.02 3hm7 n PHE 66 Ca 0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.44 3hm7 n PHE 66 Cb 0.41 -0.15 0.00 0.00 -0.94 0.00 0.00 39.48 38.80 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 -1.51 -3.80 -4.71 4.37 5.03 -1.26 -0.96 115.26 112.42 3hm7 n ASN 67 Ca 0.05 0.00 -0.37 0.00 0.87 0.00 0.00 54.58 55.13 3hm7 n ASN 67 Cb 0.34 -2.48 -0.07 0.00 -1.02 0.00 0.00 39.78 36.55 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 -1.28 4.24 0.64 3.52 2.12 -1.26 -2.09 118.70 124.59 3hm7 s GLU 68 Ca 0.00 0.13 0.01 0.00 0.36 0.00 0.00 54.97 55.46 3hm7 s GLU 68 Cb 0.00 -3.46 0.09 0.00 0.26 0.00 0.00 34.13 31.02 3hm7 s GLU 68 CO 0.00 0.16 0.89 -1.25 -0.54 0.00 0.00 175.26 174.52 3hm7 s PRO 69 N 0.71 2.06 0.00 4.30 0.04 -1.26 -4.87 135.00 135.98 3hm7 s PRO 69 Ca 0.17 -1.02 0.00 0.00 0.04 0.00 0.00 61.00 60.19 3hm7 s PRO 69 Cb -0.14 -2.41 0.00 0.00 0.04 0.00 0.00 34.50 31.99 3hm7 s PRO 69 CO 0.05 -1.12 0.00 0.41 0.04 0.00 0.00 177.00 176.38 3hm7 n GLY 70 N -2.60 2.75 2.20 0.56 0.00 -1.24 -1.05 105.19 105.82 3hm7 n GLY 70 Ca 0.12 -0.67 -0.25 0.00 0.00 0.00 0.00 46.02 45.23 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 3.51 -0.09 1.61 1.74 -0.89 -4.77 116.66 117.78 3hm7 n ARG 71 Ca 0.00 -4.28 0.17 0.00 -0.77 0.00 0.00 57.85 52.97 3hm7 n ARG 71 Cb 0.00 -2.25 0.58 0.00 -1.02 0.00 0.00 32.46 29.77 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 2.37 0.78 0.00 0.55 2.02 -1.72 -1.20 112.91 115.71 3hm7 h THR 72 Ca 0.34 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.43 3hm7 h THR 72 Cb 1.31 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.24 3hm7 h THR 72 CO 0.78 0.04 0.00 -0.62 0.37 0.00 0.00 175.52 176.10 3hm7 n GLU 73 N -4.43 0.72 0.01 6.66 -0.58 -1.26 -2.14 120.64 119.62 3hm7 n GLU 73 Ca 0.12 0.00 -0.22 0.00 -0.42 0.00 0.00 57.16 56.64 3hm7 n GLU 73 Cb 0.55 -1.32 -0.14 0.00 -0.57 0.00 0.00 31.44 29.96 3hm7 n GLU 73 CO 0.00 0.00 0.00 -1.49 -0.48 0.00 0.00 177.13 175.16 3hm7 h TRP 74 N 0.00 0.49 0.00 -0.32 4.06 -1.54 -3.45 115.95 115.19 3hm7 h TRP 74 Ca 0.00 -0.36 0.00 0.00 2.06 0.00 0.00 58.89 60.59 3hm7 h TRP 74 Cb 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 29.16 28.14 3hm7 h TRP 74 CO 0.00 1.64 0.00 0.39 -3.56 0.00 0.00 178.44 176.91 3hm7 n GLU 75 N -3.77 0.00 0.00 0.49 -0.58 -0.94 -4.53 120.64 111.30 3hm7 n GLU 75 Ca -0.27 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.47 3hm7 n GLU 75 Cb 0.96 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.83 3hm7 n GLU 75 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hm7 n GLY 76 N 1.15 0.96 0.22 0.62 0.00 -0.13 -4.47 105.19 103.53 3hm7 n GLY 76 Ca 0.00 -1.69 0.08 0.00 0.00 0.00 0.00 46.02 44.41 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 0.00 0.31 1.61 0.04 -1.90 -1.66 116.94 115.34 3hm7 h PHE 77 Ca 0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 3hm7 h PHE 77 Cb 0.00 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.15 3hm7 h PHE 77 CO 0.00 0.26 -0.15 0.00 -0.60 0.00 0.00 178.31 177.82 3hm7 h ALA 78 N 1.74 -0.42 0.00 2.45 0.00 -1.87 -2.81 119.26 118.34 3hm7 h ALA 78 Ca -0.00 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.64 3hm7 h ALA 78 Cb 0.65 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 3hm7 h ALA 78 CO 0.03 -0.42 -0.63 0.66 0.00 0.00 0.00 179.25 178.90 3hm7 h SER 79 N -1.06 0.00 0.19 0.00 4.64 -1.78 -1.96 113.55 113.58 3hm7 h SER 79 Ca -0.04 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.27 3hm7 h SER 79 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.51 3hm7 h SER 79 CO 0.07 0.63 -0.09 1.23 -0.87 0.00 0.00 176.83 177.80 3hm7 h GLY 80 N 2.06 -0.27 2.00 -0.77 0.00 -1.42 -1.91 103.07 102.76 3hm7 h GLY 80 Ca -0.01 0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.42 3hm7 h GLY 80 CO 0.08 -0.10 0.00 1.48 0.00 0.00 0.00 176.54 178.00 3hm7 h SER 81 N -0.39 0.00 -0.29 0.19 4.64 -1.51 -2.82 113.55 113.37 3hm7 h SER 81 Ca -0.03 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.23 3hm7 h SER 81 Cb 0.30 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.38 3hm7 h SER 81 CO 0.04 0.00 -0.08 0.50 -0.87 0.00 0.00 176.83 176.43 3hm7 h LYS 82 N 0.00 0.57 -0.90 4.77 3.64 -1.19 -2.92 116.57 120.54 3hm7 h LYS 82 Ca 0.00 -0.22 -0.01 0.00 -1.27 0.00 0.00 60.65 59.15 3hm7 h LYS 82 Cb 0.69 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.44 3hm7 h LYS 82 CO 0.00 0.77 0.53 0.77 -2.27 0.00 0.00 179.45 179.25 3hm7 h SER 83 N 0.33 1.10 -0.29 4.20 0.02 -1.11 -2.71 113.55 115.10 3hm7 h SER 83 Ca 0.07 -0.08 -0.08 0.00 -0.84 0.00 0.00 61.79 60.87 3hm7 h SER 83 Cb 0.56 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 3hm7 h SER 83 CO 0.03 0.86 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.38 3hm7 h LEU 84 N 1.25 0.61 -0.87 5.07 3.38 -1.51 -2.63 115.31 120.62 3hm7 h LEU 84 Ca 0.32 -0.40 0.07 0.00 0.09 0.00 0.00 57.88 57.96 3hm7 h LEU 84 Cb -0.03 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.49 3hm7 h LEU 84 CO -0.06 0.87 0.53 0.00 0.09 0.00 0.00 178.44 179.88 3hm7 h ALA 85 N 0.75 1.20 0.00 1.53 0.00 -1.48 0.47 119.26 121.74 3hm7 h ALA 85 Ca 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3hm7 h ALA 85 Cb 0.64 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3hm7 h ALA 85 CO 0.04 0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.54 3hm7 h ALA 86 N 1.42 1.00 -0.04 0.00 0.00 -1.25 -2.81 119.26 117.58 3hm7 h ALA 86 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3hm7 h ALA 86 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3hm7 h ALA 86 CO -0.19 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.47 3hm7 n GLY 87 N -0.54 -0.03 0.75 0.00 0.00 -0.30 -4.71 105.19 100.36 3hm7 n GLY 87 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 0.69 0.79 3.67 -0.02 0.00 -0.01 -4.54 105.19 105.77 3hm7 n GLY 88 Ca 0.08 -0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.50 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 5.33 -0.15 1.61 1.01 0.14 -1.70 120.40 124.65 3hm7 s VAL 89 Ca 0.00 0.27 0.09 0.00 0.00 0.00 0.00 61.98 62.35 3hm7 s VAL 89 Cb 0.00 -3.54 -0.13 0.00 0.00 0.00 0.00 36.38 32.71 3hm7 s VAL 89 CO 0.00 0.33 0.26 0.35 0.00 0.00 0.00 175.10 176.05 3hm7 n THR 90 N 4.26 0.00 -4.35 3.92 -2.24 -0.65 -3.41 114.28 111.80 3hm7 n THR 90 Ca -0.14 -0.24 -0.19 0.00 -2.27 0.00 0.00 64.05 61.21 3hm7 n THR 90 Cb 0.52 0.53 -0.15 0.00 -2.10 0.00 0.00 70.33 69.13 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 -2.37 0.71 0.03 4.28 2.01 -1.03 -0.79 115.64 118.48 3hm7 s THR 91 Ca -0.01 -0.35 0.02 0.00 0.31 0.00 0.00 61.69 61.66 3hm7 s THR 91 Cb 0.06 -0.62 -0.02 0.00 0.01 0.00 0.00 72.50 71.93 3hm7 s THR 91 CO 0.38 0.22 -0.07 -0.72 -0.69 0.00 0.00 174.62 173.73 3hm7 s TYR 92 N 0.04 0.63 -0.36 4.92 -0.85 -0.74 -1.31 117.35 119.68 3hm7 s TYR 92 Ca -0.00 -0.38 -0.11 0.00 -0.52 0.00 0.00 57.07 56.05 3hm7 s TYR 92 Cb -0.06 -0.39 0.02 0.00 0.38 0.00 0.00 41.96 41.91 3hm7 s TYR 92 CO 0.00 -0.06 0.20 -0.06 -1.52 0.00 0.00 175.55 174.12 3hm7 s PHE 93 N -1.02 3.23 -0.12 -3.49 0.08 0.45 -0.56 117.98 116.55 3hm7 s PHE 93 Ca -0.06 -0.79 -0.30 0.00 0.12 0.00 0.00 56.93 55.90 3hm7 s PHE 93 Cb -0.08 -2.43 -0.02 0.00 -0.57 0.00 0.00 43.02 39.92 3hm7 s PHE 93 CO 0.00 -0.58 1.10 0.34 -0.10 0.00 0.00 175.22 175.98 3hm7 s ASP 94 N 1.59 7.13 0.67 1.36 3.68 -0.43 -2.82 116.67 127.84 3hm7 s ASP 94 Ca 0.03 1.61 -0.15 0.00 2.13 0.00 0.00 52.55 56.17 3hm7 s ASP 94 Cb -0.19 -2.55 0.01 0.00 -1.45 0.00 0.00 42.92 38.74 3hm7 s ASP 94 CO 0.07 -0.56 1.14 -0.04 0.13 0.00 0.00 175.17 175.91 3hm7 s MET 95 N 2.42 2.67 0.00 4.34 -1.94 0.01 -1.11 119.30 125.69 3hm7 s MET 95 Ca 0.51 1.50 0.31 0.00 -1.71 0.00 0.00 55.69 56.29 3hm7 s MET 95 Cb -0.20 -1.92 1.60 0.00 2.01 0.00 0.00 34.83 36.32 3hm7 s MET 95 CO 0.17 -1.37 2.08 -0.35 -0.01 0.00 0.00 175.02 175.54 3hm7 n PRO 96 N -2.42 0.68 -4.48 2.03 -0.04 -1.26 -4.83 135.00 124.69 3hm7 n PRO 96 Ca 0.11 -0.06 -0.26 0.00 -0.04 0.00 0.00 63.50 63.26 3hm7 n PRO 96 Cb 0.51 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 3hm7 n PRO 96 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 3hm7 s LEU 97 N -2.35 2.83 0.00 1.53 2.34 -1.26 -1.53 118.68 120.23 3hm7 s LEU 97 Ca 0.35 -1.15 0.00 0.00 0.06 0.00 0.00 54.13 53.39 3hm7 s LEU 97 Cb 0.21 -1.10 0.00 0.00 -0.56 0.00 0.00 46.19 44.74 3hm7 s LEU 97 CO 0.43 -0.24 0.00 0.59 -1.06 0.00 0.00 176.35 176.07 3hm7 n ASN 98 N -0.87 0.00 -4.64 1.48 5.03 -1.26 -4.74 115.26 110.27 3hm7 n ASN 98 Ca -0.05 0.00 -0.48 0.00 0.87 0.00 0.00 54.58 54.92 3hm7 n ASN 98 Cb 0.63 0.00 -0.05 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 1.04 2.58 -3.85 6.41 2.88 -1.26 -4.09 113.62 117.33 3hm7 n SER 99 Ca 0.00 1.09 -0.26 0.00 -1.33 0.00 0.00 58.87 58.37 3hm7 n SER 99 Cb 0.00 -1.34 -0.17 0.00 -0.75 0.00 0.00 64.21 61.95 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 0.92 2.15 0.80 -3.46 2.47 -0.21 -2.60 114.94 115.00 3hm7 s ASN 100 Ca 0.82 -0.32 -0.13 0.00 0.42 0.00 0.00 52.86 53.64 3hm7 s ASN 100 Cb -0.78 -0.71 0.08 0.00 -1.45 0.00 0.00 41.25 38.38 3hm7 s ASN 100 CO 0.42 -0.16 1.17 -2.84 -3.72 0.00 0.00 177.10 171.97 3hm7 s PRO 101 N 1.79 1.78 0.86 0.43 0.02 -1.26 -3.65 135.00 134.97 3hm7 s PRO 101 Ca 0.04 1.62 -0.12 0.00 0.02 0.00 0.00 61.00 62.57 3hm7 s PRO 101 Cb -0.13 -1.81 0.11 0.00 0.02 0.00 0.00 34.50 32.69 3hm7 s PRO 101 CO -0.07 -2.08 1.10 -2.14 -0.33 0.00 0.00 177.00 173.48 3hm7 s PRO 102 N -4.27 1.52 -1.17 5.54 0.02 -1.07 -4.85 135.00 130.72 3hm7 s PRO 102 Ca 0.70 0.69 -0.17 0.00 0.02 0.00 0.00 61.00 62.25 3hm7 s PRO 102 Cb -0.26 -1.85 -0.05 0.00 0.02 0.00 0.00 34.50 32.37 3hm7 s PRO 102 CO 0.51 -2.02 2.14 2.41 -0.33 0.00 0.00 177.00 179.70 3hm7 n THR 103 N -3.72 2.80 -0.08 0.99 -1.04 -0.58 -4.41 114.28 108.24 3hm7 n THR 103 Ca 0.07 -2.37 -0.11 0.00 -2.04 0.00 0.00 64.05 59.60 3hm7 n THR 103 Cb 0.56 -2.48 -0.15 0.00 -1.82 0.00 0.00 70.33 66.44 3hm7 n THR 103 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 3hm7 n ILE 104 N 5.35 1.47 -4.34 12.58 2.08 -1.26 -1.77 119.36 133.48 3hm7 n ILE 104 Ca 0.52 -0.80 -0.18 0.00 0.56 0.00 0.00 62.75 62.85 3hm7 n ILE 104 Cb 0.38 -0.77 -0.10 0.00 -0.75 0.00 0.00 39.64 38.40 3hm7 n ILE 104 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 3hm7 s THR 105 N -2.52 1.50 0.29 1.39 -1.32 -1.26 -4.81 115.64 108.92 3hm7 s THR 105 Ca -0.12 -2.14 0.01 0.00 -1.21 0.00 0.00 61.69 58.23 3hm7 s THR 105 Cb 0.07 -2.11 0.29 0.00 -1.51 0.00 0.00 72.50 69.23 3hm7 s THR 105 CO 0.80 -0.54 1.87 -0.09 -2.21 0.00 0.00 174.62 174.45 3hm7 h ARG 106 N 2.54 0.98 -0.41 7.08 9.65 -1.87 -1.73 114.38 130.61 3hm7 h ARG 106 Ca -0.38 -0.06 -0.01 0.00 -1.10 0.00 0.00 59.98 58.43 3hm7 h ARG 106 Cb 1.22 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 29.56 3hm7 h ARG 106 CO 0.64 0.65 0.23 1.49 2.80 0.00 0.00 179.97 185.77 3hm7 h GLU 107 N 1.01 0.57 0.00 0.20 4.81 -1.97 -1.98 114.58 117.22 3hm7 h GLU 107 Ca 0.45 -0.06 -0.07 0.00 -0.13 0.00 0.00 59.36 59.55 3hm7 h GLU 107 Cb 0.38 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.63 3hm7 h GLU 107 CO -0.21 0.45 -0.33 1.49 -0.73 0.00 0.00 179.01 179.68 3hm7 h GLU 108 N 0.54 0.00 -0.14 1.92 4.57 -1.74 -2.31 114.58 117.42 3hm7 h GLU 108 Ca 0.15 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.31 3hm7 h GLU 108 Cb 0.04 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.63 3hm7 h GLU 108 CO -0.02 0.33 0.02 1.25 -1.18 0.00 0.00 179.01 179.41 3hm7 h LEU 109 N 0.00 0.23 -1.14 1.64 5.85 -1.14 -3.12 115.31 117.63 3hm7 h LEU 109 Ca -0.00 -0.28 0.05 0.00 0.84 0.00 0.00 57.88 58.49 3hm7 h LEU 109 Cb 0.62 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.53 3hm7 h LEU 109 CO 0.04 0.45 0.59 0.44 -0.34 0.00 0.00 178.44 179.62 3hm7 h ASP 110 N 0.00 0.93 -0.13 1.25 3.45 -0.82 0.22 116.42 121.32 3hm7 h ASP 110 Ca 0.04 0.00 -0.10 0.00 0.43 0.00 0.00 57.03 57.41 3hm7 h ASP 110 Cb 0.32 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 38.88 3hm7 h ASP 110 CO 0.00 0.61 -0.22 0.11 -1.57 0.00 0.00 179.24 178.18 3hm7 h LYS 111 N 1.07 0.56 -0.04 3.56 1.57 -1.53 -2.42 116.57 119.33 3hm7 h LYS 111 Ca 0.38 -0.21 -0.20 0.00 -1.87 0.00 0.00 60.65 58.75 3hm7 h LYS 111 Cb 0.13 -0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.42 3hm7 h LYS 111 CO -0.13 0.74 -0.76 -0.22 -0.57 0.00 0.00 179.45 178.51 3hm7 h LYS 112 N 0.50 0.59 -0.82 3.15 3.64 -1.24 -3.12 116.57 119.26 3hm7 h LYS 112 Ca 0.08 -0.58 0.15 0.00 -1.27 0.00 0.00 60.65 59.03 3hm7 h LYS 112 Cb 0.65 0.15 -0.09 0.00 -0.41 0.00 0.00 32.23 32.53 3hm7 h LYS 112 CO 0.05 1.19 0.39 -0.09 -2.27 0.00 0.00 179.45 178.72 3hm7 h ARG 113 N 0.21 0.54 -0.02 1.90 9.65 -0.50 -1.16 114.38 125.00 3hm7 h ARG 113 Ca -0.08 -0.03 -0.16 0.00 -1.10 0.00 0.00 59.98 58.60 3hm7 h ARG 113 Cb 1.42 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 29.87 3hm7 h ARG 113 CO 0.15 0.36 -0.73 1.96 2.80 0.00 0.00 179.97 184.51 3hm7 h GLN 114 N 0.56 0.12 0.00 0.20 4.20 -1.50 -1.48 115.11 117.20 3hm7 h GLN 114 Ca 0.45 -0.11 -0.14 0.00 0.06 0.00 0.00 58.65 58.91 3hm7 h GLN 114 Cb 0.66 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.44 3hm7 h GLN 114 CO -0.38 0.79 -0.67 -0.07 -0.67 0.00 0.00 178.83 177.84 3hm7 h LEU 115 N 0.08 0.00 -0.11 1.46 3.38 -1.32 -2.64 115.31 116.15 3hm7 h LEU 115 Ca -0.02 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 3hm7 h LEU 115 Cb 1.29 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.04 3hm7 h LEU 115 CO 0.10 0.67 -0.44 0.00 0.09 0.00 0.00 178.44 178.86 3hm7 h ALA 116 N 1.33 0.21 -0.00 1.53 0.00 -1.18 -1.90 119.26 119.26 3hm7 h ALA 116 Ca -0.01 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3hm7 h ALA 116 Cb 1.27 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 3hm7 h ALA 116 CO 0.09 0.34 0.07 -0.97 0.00 0.00 0.00 179.25 178.78 3hm7 h ASN 117 N 0.09 0.00 0.00 0.00 -1.24 -1.20 -0.91 115.58 112.32 3hm7 h ASN 117 Ca -0.02 0.00 -0.38 0.00 0.71 0.00 0.00 56.30 56.61 3hm7 h ASN 117 Cb 1.08 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 40.06 3hm7 h ASN 117 CO 0.09 0.00 -2.42 1.21 -1.29 0.00 0.00 177.43 175.02 3hm7 n GLU 118 N -3.05 0.62 -0.04 6.67 2.13 -1.00 -4.80 120.64 121.17 3hm7 n GLU 118 Ca -0.03 0.15 -0.01 0.00 0.66 0.00 0.00 57.16 57.93 3hm7 n GLU 118 Cb 0.14 -1.49 -0.09 0.00 0.27 0.00 0.00 31.44 30.26 3hm7 n GLU 118 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 3hm7 n LYS 119 N -3.31 1.49 -2.30 5.31 4.01 -0.72 -5.00 118.16 117.65 3hm7 n LYS 119 Ca -0.45 -0.04 -0.42 0.00 -0.51 0.00 0.00 58.31 56.89 3hm7 n LYS 119 Cb 0.96 -1.29 -0.03 0.00 -0.51 0.00 0.00 35.03 34.16 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 -4.05 6.94 0.10 4.39 0.15 -0.36 -4.06 113.70 116.81 3hm7 s SER 120 Ca -0.05 2.13 -0.02 0.00 0.70 0.00 0.00 55.95 58.70 3hm7 s SER 120 Cb 0.05 -2.58 -0.20 0.00 -1.71 0.00 0.00 66.02 61.59 3hm7 s SER 120 CO 0.49 -0.59 1.22 0.25 1.20 0.00 0.00 173.24 175.81 3hm7 h LEU 121 N 7.22 0.39-10.07 3.45 5.85 -1.82 -3.47 115.31 116.85 3hm7 h LEU 121 Ca -0.40 -0.38 -0.60 0.00 0.84 0.00 0.00 57.88 57.34 3hm7 h LEU 121 Cb 1.20 -0.12 -0.08 0.00 0.37 0.00 0.00 40.66 42.02 3hm7 h LEU 121 CO 0.85 1.25 -0.44 0.68 -0.34 0.00 0.00 178.44 180.44 3hm7 s VAL 122 N -2.87 1.86 0.54 1.05 -7.23 -1.26 -4.97 120.40 107.51 3hm7 s VAL 122 Ca -0.04 -1.70 -0.18 0.00 -1.81 0.00 0.00 61.98 58.25 3hm7 s VAL 122 Cb 0.08 -2.56 -0.06 0.00 0.56 0.00 0.00 36.38 34.40 3hm7 s VAL 122 CO 0.87 0.00 1.05 -0.62 -0.31 0.00 0.00 175.10 176.09 3hm7 s ASP 123 N -4.01 6.06 0.04 4.85 3.68 0.03 -4.95 116.67 122.37 3hm7 s ASP 123 Ca 0.31 1.91 0.03 0.00 2.13 0.00 0.00 52.55 56.93 3hm7 s ASP 123 Cb 0.02 -2.55 -0.02 0.00 -1.45 0.00 0.00 42.92 38.91 3hm7 s ASP 123 CO 0.18 -0.98 -0.08 -0.72 0.13 0.00 0.00 175.17 173.69 3hm7 s TYR 124 N -2.15 0.73 0.35 -5.34 -0.85 -1.26 -1.80 117.35 107.04 3hm7 s TYR 124 Ca 0.66 -0.44 0.03 0.00 -0.52 0.00 0.00 57.07 56.81 3hm7 s TYR 124 Cb -0.17 -0.44 -0.04 0.00 0.38 0.00 0.00 41.96 41.69 3hm7 s TYR 124 CO 0.27 -0.05 0.11 1.03 -1.52 0.00 0.00 175.55 175.39 3hm7 s ARG 125 N -1.39 1.75 -0.03 -3.49 1.81 0.27 -4.91 118.95 112.96 3hm7 s ARG 125 Ca -0.07 -2.02 0.03 0.00 -1.72 0.00 0.00 55.73 51.95 3hm7 s ARG 125 Cb -0.09 -0.55 0.00 0.00 -0.45 0.00 0.00 34.95 33.86 3hm7 s ARG 125 CO 0.01 -0.38 -0.11 -0.06 -0.68 0.00 0.00 175.30 174.08 3hm7 s PHE 126 N -3.36 1.12 0.13 -0.53 0.40 -1.26 -1.31 117.98 113.16 3hm7 s PHE 126 Ca 0.31 -0.29 -0.30 0.00 -0.60 0.00 0.00 56.93 56.05 3hm7 s PHE 126 Cb 0.05 -0.78 -0.06 0.00 0.51 0.00 0.00 43.02 42.74 3hm7 s PHE 126 CO 0.15 -0.11 0.96 -1.58 0.70 0.00 0.00 175.22 175.34 3hm7 s TRP 127 N 0.14 3.84 0.62 0.36 0.52 -0.27 -2.29 118.94 121.85 3hm7 s TRP 127 Ca -0.03 1.81 -0.09 0.00 0.02 0.00 0.00 56.10 57.82 3hm7 s TRP 127 Cb -0.09 -3.04 -0.01 0.00 -1.15 0.00 0.00 33.47 29.18 3hm7 s TRP 127 CO 0.01 0.24 0.98 0.20 0.02 0.00 0.00 176.95 178.40 3hm7 s GLY 128 N -0.16 1.61 -0.09 0.98 0.00 0.31 -3.99 107.32 105.97 3hm7 s GLY 128 Ca 0.46 -0.43 -0.00 0.00 0.00 0.00 0.00 44.72 44.75 3hm7 s GLY 128 CO 0.30 -0.14 -0.07 -0.32 0.00 0.00 0.00 173.10 172.88 3hm7 s GLY 129 N -4.27 1.69 -0.31 0.20 0.00 -0.73 -0.03 107.32 103.88 3hm7 s GLY 129 Ca 0.55 -0.87 -0.06 0.00 0.00 0.00 0.00 44.72 44.33 3hm7 s GLY 129 CO 0.49 -0.49 0.08 -2.27 0.00 0.00 0.00 173.10 170.91 3hm7 s LEU 130 N -0.44 3.95 0.17 0.66 2.96 -0.96 -4.77 118.68 120.26 3hm7 s LEU 130 Ca 0.06 -0.88 0.07 0.00 -0.22 0.00 0.00 54.13 53.17 3hm7 s LEU 130 Cb -0.12 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.67 3hm7 s LEU 130 CO 0.02 -0.23 -0.14 0.68 -1.32 0.00 0.00 176.35 175.35 3hm7 s VAL 131 N 1.45 1.59 0.37 1.68 -7.23 -1.26 -4.27 120.40 112.72 3hm7 s VAL 131 Ca 0.01 -2.05 0.30 0.00 -1.81 0.00 0.00 61.98 58.43 3hm7 s VAL 131 Cb -0.18 -1.88 0.45 0.00 0.56 0.00 0.00 36.38 35.33 3hm7 s VAL 131 CO 0.02 -0.54 1.18 -2.65 -0.31 0.00 0.00 175.10 172.80 3hm7 n PRO 132 N -0.07 -0.02 0.00 4.82 -0.02 -1.26 -2.49 135.00 135.96 3hm7 n PRO 132 Ca -0.11 0.90 -0.15 0.00 -2.02 0.00 0.00 63.50 62.12 3hm7 n PRO 132 Cb 0.59 -1.87 -0.14 0.00 -0.02 0.00 0.00 33.50 32.06 3hm7 n PRO 132 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3hm7 h GLY 133 N 0.00 0.17 -3.23 -1.23 0.00 -1.97 -3.43 103.07 93.37 3hm7 h GLY 133 Ca 0.68 -0.42 -0.31 0.00 0.00 0.00 0.00 47.33 47.28 3hm7 h GLY 133 CO -0.22 0.37 0.39 1.16 0.00 0.00 0.00 176.54 178.24 3hm7 n ASN 134 N -3.29 3.52 0.14 0.19 6.94 -1.04 -4.59 115.26 117.14 3hm7 n ASN 134 Ca -0.23 -3.00 0.15 0.00 -0.02 0.00 0.00 54.58 51.48 3hm7 n ASN 134 Cb 1.05 -0.71 0.71 0.00 -2.36 0.00 0.00 39.78 38.46 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 0.77 0.77 0.00 1.53 -0.00 -1.84 0.28 117.51 119.03 3hm7 h ILE 135 Ca 0.38 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 65.24 3hm7 h ILE 135 Cb 2.15 0.86 0.00 0.00 -0.00 0.00 0.00 36.82 39.83 3hm7 h ILE 135 CO 0.68 0.00 -0.02 0.47 -0.00 0.00 0.00 178.15 179.29 3hm7 n ASP 136 N -4.31 0.85 0.02 2.16 8.00 -1.26 -3.80 116.55 118.20 3hm7 n ASP 136 Ca 0.03 0.57 0.12 0.00 0.71 0.00 0.00 54.79 56.22 3hm7 n ASP 136 Cb 0.35 -0.78 0.16 0.00 -0.02 0.00 0.00 41.12 40.82 3hm7 n ASP 136 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3hm7 n HIS 137 N -2.29 0.19 -0.15 1.24 8.25 0.08 -4.30 115.22 118.24 3hm7 n HIS 137 Ca 0.05 0.06 -0.10 0.00 -0.26 0.00 0.00 57.72 57.47 3hm7 n HIS 137 Cb 0.43 -0.38 -0.01 0.00 1.12 0.00 0.00 29.99 31.16 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 0.00 0.73 -0.54 2.41 3.38 -1.64 -1.06 115.31 118.58 3hm7 h LEU 138 Ca 0.00 -0.29 0.08 0.00 0.09 0.00 0.00 57.88 57.75 3hm7 h LEU 138 Cb 0.61 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.10 3hm7 h LEU 138 CO 0.00 0.85 0.19 -0.61 0.09 0.00 0.00 178.44 178.96 3hm7 h GLN 139 N 0.60 0.36 -0.52 1.13 5.75 -1.82 -1.91 115.11 118.69 3hm7 h GLN 139 Ca 0.13 -0.02 -0.10 0.00 -0.15 0.00 0.00 58.65 58.50 3hm7 h GLN 139 Cb 0.46 -0.08 -0.02 0.00 1.07 0.00 0.00 27.48 28.91 3hm7 h GLN 139 CO 0.02 0.24 -0.07 0.22 -2.65 0.00 0.00 178.83 176.58 3hm7 h ASP 140 N 0.37 0.94 -0.31 -0.69 -0.00 -1.72 -2.54 116.42 112.48 3hm7 h ASP 140 Ca 0.27 -0.29 -0.10 0.00 -0.00 0.00 0.00 57.03 56.91 3hm7 h ASP 140 Cb 0.31 -0.25 -0.02 0.00 -0.00 0.00 0.00 39.33 39.37 3hm7 h ASP 140 CO -0.27 1.04 -0.14 -0.07 -0.00 0.00 0.00 179.24 179.79 3hm7 h LEU 141 N 0.86 0.74 -0.60 2.28 3.38 -0.92 -0.86 115.31 120.18 3hm7 h LEU 141 Ca 0.14 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.76 3hm7 h LEU 141 Cb 0.61 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 3hm7 h LEU 141 CO 0.04 0.89 -0.18 -0.74 0.09 0.00 0.00 178.44 178.55 3hm7 h HIS 142 N 0.67 1.04 -0.05 1.13 2.76 -1.25 -2.34 115.15 117.11 3hm7 h HIS 142 Ca 0.11 -0.23 -0.08 0.00 -2.20 0.00 0.00 60.37 57.97 3hm7 h HIS 142 Cb 0.62 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.31 3hm7 h HIS 142 CO 0.03 1.02 -0.33 -0.44 -1.30 0.00 0.00 177.93 176.91 3hm7 h ASP 143 N 0.81 0.10 0.48 3.26 3.45 -1.29 -1.27 116.42 121.96 3hm7 h ASP 143 Ca 0.12 -0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.54 3hm7 h ASP 143 Cb 0.73 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 39.47 3hm7 h ASP 143 CO 0.06 0.42 0.00 0.61 -1.57 0.00 0.00 179.24 178.76 3hm7 n GLY 144 N -0.51 -0.98 0.61 2.75 0.00 -0.34 -4.91 105.19 101.82 3hm7 n GLY 144 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 0.08 1.19 3.76 -0.02 0.00 -0.48 -5.06 105.19 104.66 3hm7 n GLY 145 Ca 0.05 -0.30 -0.38 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.00 2.69 -0.76 1.61 -7.23 -1.12 -4.79 120.40 108.80 3hm7 s VAL 146 Ca 0.00 0.56 0.26 0.00 -1.81 0.00 0.00 61.98 60.99 3hm7 s VAL 146 Cb 0.00 -3.31 0.28 0.00 0.56 0.00 0.00 36.38 33.91 3hm7 s VAL 146 CO 0.00 0.04 1.79 2.30 -0.31 0.00 0.00 175.10 178.92 3hm7 n ILE 147 N -0.30 0.52 -2.92 -0.62 -6.64 -0.97 -4.88 119.36 103.56 3hm7 n ILE 147 Ca 0.06 -0.21 0.00 0.00 -1.77 0.00 0.00 62.75 60.83 3hm7 n ILE 147 Cb 0.45 -0.61 0.00 0.00 -1.44 0.00 0.00 39.64 38.04 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 1.25 -1.31 3.26 3.28 0.00 -1.26 -4.66 105.19 105.75 3hm7 n GLY 148 Ca 0.06 -0.94 -0.19 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.89 1.51 -0.16 1.61 0.40 -0.44 -0.53 117.98 117.47 3hm7 s PHE 149 Ca 0.00 -0.52 -0.02 0.00 -0.60 0.00 0.00 56.93 55.79 3hm7 s PHE 149 Cb 0.00 -0.79 0.05 0.00 0.51 0.00 0.00 43.02 42.79 3hm7 s PHE 149 CO 0.00 0.18 0.01 0.21 0.70 0.00 0.00 175.22 176.32 3hm7 s LYS 150 N -2.57 0.77 0.17 0.44 2.36 0.96 0.36 119.74 122.23 3hm7 s LYS 150 Ca 0.09 -0.32 0.06 0.00 -2.55 0.00 0.00 55.97 53.25 3hm7 s LYS 150 Cb -0.06 -1.84 -0.04 0.00 -1.05 0.00 0.00 37.83 34.85 3hm7 s LYS 150 CO 0.04 -0.53 0.11 0.00 1.55 0.00 0.00 175.35 176.51 3hm7 s ALA 151 N 1.84 3.49 -0.10 3.13 0.00 -0.77 -2.26 121.76 127.08 3hm7 s ALA 151 Ca 0.01 -1.26 -0.03 0.00 0.00 0.00 0.00 51.96 50.68 3hm7 s ALA 151 Cb -0.16 -1.28 -0.03 0.00 0.00 0.00 0.00 23.12 21.65 3hm7 s ALA 151 CO -0.07 0.49 0.03 -0.06 0.00 0.00 0.00 175.76 176.14 3hm7 s PHE 152 N -1.76 3.23 -0.40 0.00 0.40 -1.26 -2.83 117.98 115.36 3hm7 s PHE 152 Ca 0.30 0.21 0.23 0.00 -0.60 0.00 0.00 56.93 57.06 3hm7 s PHE 152 Cb -0.10 -1.85 -0.04 0.00 0.51 0.00 0.00 43.02 41.54 3hm7 s PHE 152 CO 0.22 0.45 0.92 -1.33 0.70 0.00 0.00 175.22 176.19 3hm7 n MET 153 N 2.34 0.44 -4.13 0.44 2.81 -0.94 0.30 117.12 118.39 3hm7 n MET 153 Ca -0.19 -0.01 -0.14 0.00 -1.81 0.00 0.00 57.70 55.56 3hm7 n MET 153 Cb 0.54 -1.64 -0.11 0.00 -0.71 0.00 0.00 33.22 31.29 3hm7 n MET 153 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 3hm7 s SER 154 N -4.41 1.21 0.21 7.83 1.04 -1.25 -4.14 113.70 114.19 3hm7 s SER 154 Ca 0.00 -0.69 -0.32 0.00 0.48 0.00 0.00 55.95 55.42 3hm7 s SER 154 Cb 0.13 0.02 -0.14 0.00 0.10 0.00 0.00 66.02 66.13 3hm7 s SER 154 CO 0.82 -0.23 1.48 -0.62 0.98 0.00 0.00 173.24 175.67 3hm7 n GLU 155 N 1.00 2.08 -3.72 4.02 1.02 -1.26 -4.76 120.64 119.01 3hm7 n GLU 155 Ca -0.19 0.74 -0.13 0.00 -0.02 0.00 0.00 57.16 57.56 3hm7 n GLU 155 Cb 0.56 -2.45 -0.13 0.00 -0.02 0.00 0.00 31.44 29.40 3hm7 n GLU 155 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hm7 n GLY 157 N 4.30 3.98 3.74 0.00 0.00 -1.26 -4.57 105.19 111.38 3hm7 n GLY 157 Ca -0.24 0.05 -0.41 0.00 0.00 0.00 0.00 46.02 45.42 3hm7 n GLY 157 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3hm7 s THR 158 N 0.00 3.70 -0.54 2.61 -1.32 -1.26 -4.95 115.64 113.88 3hm7 s THR 158 Ca 0.00 1.46 0.06 0.00 -1.21 0.00 0.00 61.69 62.00 3hm7 s THR 158 Cb 0.00 -3.93 0.37 0.00 -1.51 0.00 0.00 72.50 67.43 3hm7 s THR 158 CO 0.00 0.25 1.18 -0.90 -2.21 0.00 0.00 174.62 172.94 3hm7 n ASP 159 N 2.35 3.28 0.08 8.08 5.68 -1.26 -3.50 116.55 131.26 3hm7 n ASP 159 Ca 0.03 -2.52 0.12 0.00 -0.50 0.00 0.00 54.79 51.92 3hm7 n ASP 159 Cb 0.45 -0.61 0.07 0.00 -1.14 0.00 0.00 41.12 39.89 3hm7 n ASP 159 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 3hm7 n ASP 160 N 0.16 0.75 -4.33 -1.12 5.68 -1.26 -4.53 116.55 111.91 3hm7 n ASP 160 Ca 0.17 0.17 -0.44 0.00 -0.50 0.00 0.00 54.79 54.19 3hm7 n ASP 160 Cb 0.79 0.41 -0.07 0.00 -1.14 0.00 0.00 41.12 41.10 3hm7 n ASP 160 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 3hm7 s PHE 161 N -3.27 3.28 0.19 2.11 5.36 -1.23 -4.81 117.98 119.61 3hm7 s PHE 161 Ca 0.03 -1.24 -0.30 0.00 -0.96 0.00 0.00 56.93 54.46 3hm7 s PHE 161 Cb 0.12 -3.35 -0.08 0.00 -0.34 0.00 0.00 43.02 39.37 3hm7 s PHE 161 CO 0.77 -0.89 0.97 -0.65 -1.46 0.00 0.00 175.22 173.95 3hm7 s GLN 162 N 1.56 4.77 0.61 10.12 -0.21 -1.26 -4.78 119.66 130.47 3hm7 s GLN 162 Ca 0.04 1.51 -0.16 0.00 0.02 0.00 0.00 55.36 56.77 3hm7 s GLN 162 Cb -0.26 -3.31 -0.02 0.00 1.00 0.00 0.00 33.01 30.41 3hm7 s GLN 162 CO 0.04 0.35 1.09 -0.59 -2.12 0.00 0.00 175.29 174.06 3hm7 s PHE 163 N -0.64 2.80 -0.18 0.91 -0.71 -1.26 -4.57 117.98 114.34 3hm7 s PHE 163 Ca 0.44 1.53 -0.14 0.00 -1.04 0.00 0.00 56.93 57.73 3hm7 s PHE 163 Cb -0.25 -3.10 -0.05 0.00 -1.21 0.00 0.00 43.02 38.41 3hm7 s PHE 163 CO 0.32 -1.39 0.30 -1.12 -1.34 0.00 0.00 175.22 171.98 3hm7 s SER 164 N -2.60 6.40 0.92 1.98 0.01 0.15 -4.66 113.70 115.90 3hm7 s SER 164 Ca 0.66 0.47 -0.14 0.00 1.31 0.00 0.00 55.95 58.25 3hm7 s SER 164 Cb -0.19 -2.18 0.15 0.00 0.21 0.00 0.00 66.02 64.01 3hm7 s SER 164 CO 0.38 0.06 1.19 -1.00 0.41 0.00 0.00 173.24 174.28 3hm7 s HIS 165 N 0.68 2.25 0.42 2.43 3.76 -1.26 -4.61 115.29 118.96 3hm7 s HIS 165 Ca 0.16 0.66 0.12 0.00 -0.15 0.00 0.00 55.06 55.85 3hm7 s HIS 165 Cb -0.13 -3.60 0.97 0.00 1.11 0.00 0.00 32.58 30.92 3hm7 s HIS 165 CO 0.04 -2.39 1.97 -0.44 -0.85 0.00 0.00 174.74 173.08 3hm7 h ASP 166 N -1.50 0.43 -0.31 1.40 3.32 -1.98 -2.43 116.42 115.36 3hm7 h ASP 166 Ca -0.47 0.01 -0.04 0.00 0.02 0.00 0.00 57.03 56.54 3hm7 h ASP 166 Cb 1.30 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.76 3hm7 h ASP 166 CO 0.55 0.26 0.02 -0.08 -1.72 0.00 0.00 179.24 178.27 3hm7 h GLU 167 N 0.48 0.53 -0.03 3.56 4.81 -2.00 -2.67 114.58 119.26 3hm7 h GLU 167 Ca 0.28 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 3hm7 h GLU 167 Cb 0.48 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.80 3hm7 h GLU 167 CO -0.08 0.66 0.02 1.15 -0.73 0.00 0.00 179.01 180.02 3hm7 h THR 168 N 0.33 1.02 -0.44 0.32 2.02 -1.82 -2.09 112.91 112.24 3hm7 h THR 168 Ca 0.09 -0.04 0.07 0.00 0.77 0.00 0.00 66.41 67.30 3hm7 h THR 168 Cb 0.41 0.99 -0.06 0.00 -1.74 0.00 0.00 68.15 67.75 3hm7 h THR 168 CO 0.01 0.01 0.09 -0.07 0.37 0.00 0.00 175.52 175.94 3hm7 h LEU 169 N 0.03 0.02 -0.56 2.58 3.38 -1.46 -0.86 115.31 118.44 3hm7 h LEU 169 Ca 0.01 0.08 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 3hm7 h LEU 169 Cb 0.01 0.10 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 3hm7 h LEU 169 CO -0.00 0.04 0.05 -0.07 0.09 0.00 0.00 178.44 178.55 3hm7 h LEU 170 N 0.23 0.92 -0.36 1.67 3.38 -1.37 -1.68 115.31 118.09 3hm7 h LEU 170 Ca 0.22 -0.28 -0.16 0.00 0.09 0.00 0.00 57.88 57.74 3hm7 h LEU 170 Cb 0.27 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3hm7 h LEU 170 CO -0.28 0.98 -0.40 0.11 0.09 0.00 0.00 178.44 178.93 3hm7 h LYS 171 N 0.84 0.92 -0.50 1.13 1.57 -1.07 -2.78 116.57 116.68 3hm7 h LYS 171 Ca 0.16 -0.50 -0.04 0.00 -1.87 0.00 0.00 60.65 58.41 3hm7 h LYS 171 Cb 0.48 0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 3hm7 h LYS 171 CO 0.02 1.15 0.16 0.78 -0.57 0.00 0.00 179.45 180.99 3hm7 h GLY 172 N 0.73 0.83 1.16 3.86 0.00 -1.13 -2.98 103.07 105.53 3hm7 h GLY 172 Ca 0.05 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.82 3hm7 h GLY 172 CO 0.10 0.46 0.06 -0.33 0.00 0.00 0.00 176.54 176.83 3hm7 h MET 173 N 0.68 1.03 -0.89 4.80 2.86 -1.30 0.26 114.93 122.36 3hm7 h MET 173 Ca 0.16 -0.28 0.04 0.00 -2.06 0.00 0.00 59.70 57.56 3hm7 h MET 173 Cb 0.26 -0.12 -0.06 0.00 0.06 0.00 0.00 31.60 31.75 3hm7 h MET 173 CO -0.01 0.97 0.57 -0.22 1.06 0.00 0.00 176.91 179.28 3hm7 h LYS 174 N 0.96 1.06 -0.16 1.72 3.64 -1.48 0.02 116.57 122.32 3hm7 h LYS 174 Ca 0.18 -0.06 -0.10 0.00 -1.27 0.00 0.00 60.65 59.40 3hm7 h LYS 174 Cb 0.46 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 3hm7 h LYS 174 CO 0.02 0.70 -0.29 -0.22 -2.27 0.00 0.00 179.45 177.38 3hm7 h LYS 175 N 1.09 0.47 -0.73 1.90 1.63 -1.22 -2.86 116.57 116.85 3hm7 h LYS 175 Ca 0.37 -0.30 -0.05 0.00 -0.85 0.00 0.00 60.65 59.82 3hm7 h LYS 175 Cb 0.06 0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 31.69 3hm7 h LYS 175 CO -0.14 0.90 0.28 0.82 -3.45 0.00 0.00 179.45 177.86 3hm7 h ILE 176 N 0.10 1.25 -0.78 2.00 2.04 -0.27 0.69 117.51 122.54 3hm7 h ILE 176 Ca 0.01 -0.82 -0.04 0.00 1.00 0.00 0.00 64.86 65.02 3hm7 h ILE 176 Cb 0.88 0.41 -0.04 0.00 -0.74 0.00 0.00 36.82 37.34 3hm7 h ILE 176 CO 0.07 0.33 0.34 0.00 0.00 0.00 0.00 178.15 178.88 3hm7 h ALA 177 N 1.14 1.13 0.00 1.87 0.00 -1.10 -1.93 119.26 120.37 3hm7 h ALA 177 Ca 0.24 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3hm7 h ALA 177 Cb 0.23 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.71 3hm7 h ALA 177 CO -0.02 0.64 -0.09 0.00 0.00 0.00 0.00 179.25 179.78 3hm7 h ALA 178 N 1.25 1.01 0.00 0.00 0.00 -1.12 -2.77 119.26 117.63 3hm7 h ALA 178 Ca 0.26 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3hm7 h ALA 178 Cb 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3hm7 h ALA 178 CO -0.03 0.12 -0.21 1.28 0.00 0.00 0.00 179.25 180.40 3hm7 n LEU 179 N -3.22 0.30 -2.19 0.00 4.77 0.17 -4.94 117.00 111.89 3hm7 n LEU 179 Ca 0.01 0.32 -0.14 0.00 -0.03 0.00 0.00 56.01 56.17 3hm7 n LEU 179 Cb 0.37 -0.37 0.04 0.00 -2.33 0.00 0.00 43.42 41.13 3hm7 n LEU 179 CO 0.30 0.02 0.10 0.61 -1.33 0.00 0.00 177.39 177.09 3hm7 n GLY 180 N 1.47 0.05 0.00 -0.72 0.00 -1.02 -5.03 105.19 99.93 3hm7 n GLY 180 Ca 0.06 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.92 3hm7 n GLY 180 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3hm7 n SER 181 N -1.04 1.05 -3.69 1.61 2.88 -0.77 -5.06 113.62 108.59 3hm7 n SER 181 Ca -0.02 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.39 3hm7 n SER 181 Cb 0.55 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.92 3hm7 n SER 181 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 3hm7 s ILE 182 N 1.50 0.01 -0.15 2.46 2.07 -1.26 -4.44 121.20 121.38 3hm7 s ILE 182 Ca 0.00 -0.10 -0.01 0.00 -1.41 0.00 0.00 60.65 59.13 3hm7 s ILE 182 Cb 0.00 -0.71 -0.01 0.00 0.13 0.00 0.00 42.46 41.87 3hm7 s ILE 182 CO 0.00 -0.05 -0.10 -0.22 -1.91 0.00 0.00 174.94 172.66 3hm7 s LEU 183 N -0.24 2.83 -0.04 8.50 2.96 -0.63 -1.33 118.68 130.72 3hm7 s LEU 183 Ca -0.04 -0.31 -0.05 0.00 -0.22 0.00 0.00 54.13 53.50 3hm7 s LEU 183 Cb -0.03 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.95 3hm7 s LEU 183 CO 0.03 0.13 0.20 0.00 -1.32 0.00 0.00 176.35 175.38 3hm7 s ALA 184 N 0.58 3.90 0.01 5.97 0.00 0.16 -1.07 121.76 131.30 3hm7 s ALA 184 Ca -0.06 -0.66 0.05 0.00 0.00 0.00 0.00 51.96 51.28 3hm7 s ALA 184 Cb -0.15 -1.97 -0.02 0.00 0.00 0.00 0.00 23.12 20.98 3hm7 s ALA 184 CO 0.03 0.68 -0.16 0.14 0.00 0.00 0.00 175.76 176.45 3hm7 s VAL 185 N -1.22 1.24 -0.58 0.00 -7.23 -0.56 -1.85 120.40 110.21 3hm7 s VAL 185 Ca 0.23 -0.82 -0.24 0.00 -1.81 0.00 0.00 61.98 59.35 3hm7 s VAL 185 Cb -0.13 -1.07 0.05 0.00 0.56 0.00 0.00 36.38 35.79 3hm7 s VAL 185 CO 0.13 0.24 0.96 -2.28 -0.31 0.00 0.00 175.10 173.84 3hm7 s HIS 186 N -0.54 2.75 -0.94 2.82 5.65 -1.13 -2.23 115.29 121.66 3hm7 s HIS 186 Ca 0.05 -0.11 -0.15 0.00 0.25 0.00 0.00 55.06 55.10 3hm7 s HIS 186 Cb -0.07 -4.14 0.19 0.00 -1.18 0.00 0.00 32.58 27.38 3hm7 s HIS 186 CO 0.00 -1.44 1.02 0.00 -0.65 0.00 0.00 174.74 173.67 3hm7 s ALA 187 N 4.05 3.86 0.10 1.58 0.00 -1.26 -2.21 121.76 127.88 3hm7 s ALA 187 Ca 0.29 -3.16 0.06 0.00 0.00 0.00 0.00 51.96 49.15 3hm7 s ALA 187 Cb -0.13 -3.80 -0.03 0.00 0.00 0.00 0.00 23.12 19.15 3hm7 s ALA 187 CO 0.17 -2.60 -0.16 -1.21 0.00 0.00 0.00 175.76 171.96 3hm7 s GLU 188 N 1.16 0.96 -0.59 0.00 2.02 -1.26 -4.45 118.70 116.54 3hm7 s GLU 188 Ca 0.28 -1.10 -0.21 0.00 0.02 0.00 0.00 54.97 53.95 3hm7 s GLU 188 Cb -0.07 -0.98 0.07 0.00 0.10 0.00 0.00 34.13 33.25 3hm7 s GLU 188 CO -0.08 0.21 0.84 0.45 0.02 0.00 0.00 175.26 176.70 3hm7 s SER 189 N -2.04 6.22 0.20 -0.19 0.15 -1.16 -3.87 113.70 113.01 3hm7 s SER 189 Ca 0.04 -0.91 -0.16 0.00 0.70 0.00 0.00 55.95 55.61 3hm7 s SER 189 Cb -0.08 -2.37 0.18 0.00 -1.71 0.00 0.00 66.02 62.04 3hm7 s SER 189 CO 0.03 -1.22 1.62 -1.13 1.20 0.00 0.00 173.24 173.74 3hm7 h ASN 190 N 9.32 -0.72 0.82 5.45 -1.24 -1.93 -0.52 115.58 126.75 3hm7 h ASN 190 Ca -0.28 0.19 -0.19 0.00 0.71 0.00 0.00 56.30 56.73 3hm7 h ASN 190 Cb 1.08 0.42 -0.02 0.00 0.73 0.00 0.00 38.32 40.53 3hm7 h ASN 190 CO 1.10 -0.24 -0.90 -0.33 -1.29 0.00 0.00 177.43 175.78 3hm7 h GLU 191 N -0.07 0.05 -0.63 6.67 4.39 -1.92 -2.24 114.58 120.82 3hm7 h GLU 191 Ca 0.26 -0.06 -0.08 0.00 0.34 0.00 0.00 59.36 59.82 3hm7 h GLU 191 Cb 0.47 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 29.12 3hm7 h GLU 191 CO -0.61 0.91 0.09 0.52 -1.16 0.00 0.00 179.01 178.75 3hm7 h MET 192 N 0.02 1.05 0.71 2.33 2.86 -1.84 -2.75 114.93 117.31 3hm7 h MET 192 Ca -0.02 -0.29 -0.03 0.00 -2.06 0.00 0.00 59.70 57.29 3hm7 h MET 192 Cb 1.57 -0.12 0.01 0.00 0.06 0.00 0.00 31.60 33.12 3hm7 h MET 192 CO 0.12 0.98 -0.34 0.28 1.06 0.00 0.00 176.91 179.01 3hm7 h VAL 193 N 0.96 0.29 0.00 -2.22 2.07 -0.87 -2.20 116.25 114.28 3hm7 h VAL 193 Ca 0.19 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.66 3hm7 h VAL 193 Cb 0.45 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 3hm7 h VAL 193 CO 0.01 0.01 -0.25 -0.55 0.02 0.00 0.00 177.57 176.81 3hm7 h ASN 194 N -0.99 0.00 -0.14 0.57 7.08 -1.51 -1.25 115.58 119.34 3hm7 h ASN 194 Ca -0.10 -0.02 -0.06 0.00 -3.08 0.00 0.00 56.30 53.05 3hm7 h ASN 194 Cb 0.74 0.00 -0.00 0.00 -2.08 0.00 0.00 38.32 36.98 3hm7 h ASN 194 CO 0.16 0.01 -0.13 0.00 -2.08 0.00 0.00 177.43 175.39 3hm7 h ALA 195 N 2.16 0.21 -0.06 4.14 0.00 -1.53 -2.15 119.26 122.01 3hm7 h ALA 195 Ca 0.00 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.49 3hm7 h ALA 195 Cb 0.92 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 3hm7 h ALA 195 CO 0.00 0.07 -0.46 -0.07 0.00 0.00 0.00 179.25 178.80 3hm7 h LEU 196 N -0.03 0.15 -0.10 0.00 3.38 -1.34 -2.65 115.31 114.72 3hm7 h LEU 196 Ca 0.02 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 3hm7 h LEU 196 Cb 0.65 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 3hm7 h LEU 196 CO 0.03 0.59 0.01 0.74 0.09 0.00 0.00 178.44 179.90 3hm7 h THR 197 N 0.12 1.24 -0.59 0.22 2.02 -1.26 -2.35 112.91 112.31 3hm7 h THR 197 Ca 0.01 -0.76 0.05 0.00 0.77 0.00 0.00 66.41 66.48 3hm7 h THR 197 Cb 0.85 1.56 -0.05 0.00 -1.74 0.00 0.00 68.15 68.77 3hm7 h THR 197 CO 0.07 0.22 0.31 0.74 0.37 0.00 0.00 175.52 177.22 3hm7 h THR 198 N -0.09 0.95 -0.53 3.16 2.02 -1.33 -0.58 112.91 116.52 3hm7 h THR 198 Ca 0.03 -0.20 0.05 0.00 0.77 0.00 0.00 66.41 67.06 3hm7 h THR 198 Cb 0.33 0.32 -0.05 0.00 -1.74 0.00 0.00 68.15 67.01 3hm7 h THR 198 CO 0.00 0.11 0.27 0.40 0.37 0.00 0.00 175.52 176.67 3hm7 h ILE 199 N 0.58 0.95 -0.45 3.11 2.04 -1.48 -1.19 117.51 121.08 3hm7 h ILE 199 Ca 0.26 -0.18 -0.09 0.00 1.00 0.00 0.00 64.86 65.85 3hm7 h ILE 199 Cb 0.17 0.39 -0.02 0.00 -0.74 0.00 0.00 36.82 36.62 3hm7 h ILE 199 CO -0.18 0.09 -0.10 0.00 0.00 0.00 0.00 178.15 177.97 3hm7 h ALA 200 N 1.28 0.99 -0.31 1.87 0.00 -0.74 -1.82 119.26 120.53 3hm7 h ALA 200 Ca 0.23 -0.31 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 3hm7 h ALA 200 Cb 0.14 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 3hm7 h ALA 200 CO -0.16 0.60 -0.43 0.82 0.00 0.00 0.00 179.25 180.08 3hm7 h ILE 201 N 0.72 1.29 -0.81 0.00 2.04 -0.97 -2.53 117.51 117.24 3hm7 h ILE 201 Ca 0.12 -1.62 -0.01 0.00 1.00 0.00 0.00 64.86 64.36 3hm7 h ILE 201 Cb 0.58 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 38.13 3hm7 h ILE 201 CO 0.04 0.53 0.47 -0.33 0.00 0.00 0.00 178.15 178.85 3hm7 h GLU 202 N 0.62 1.12 -0.34 2.37 3.07 -0.98 -3.20 114.58 117.24 3hm7 h GLU 202 Ca 0.04 -0.12 0.00 0.00 -0.50 0.00 0.00 59.36 58.79 3hm7 h GLU 202 Cb 1.00 -0.23 0.00 0.00 -0.84 0.00 0.00 28.75 28.68 3hm7 h GLU 202 CO 0.10 0.81 0.00 0.39 -1.40 0.00 0.00 179.01 178.90 3hm7 n GLU 203 N -4.43 1.93 -1.63 2.33 1.02 -0.71 -4.91 120.64 114.25 3hm7 n GLU 203 Ca 0.08 -1.44 -0.20 0.00 -0.02 0.00 0.00 57.16 55.58 3hm7 n GLU 203 Cb 0.08 -1.36 -0.08 0.00 -0.02 0.00 0.00 31.44 30.05 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 0.66 -1.41 -2.82 3.49 1.13 -1.19 -4.95 117.38 112.29 3hm7 n GLN 204 Ca 0.15 1.20 -0.43 0.00 -1.94 0.00 0.00 57.00 55.98 3hm7 n GLN 204 Cb 0.36 -5.57 -0.03 0.00 0.11 0.00 0.00 30.24 25.11 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 -3.78 3.23 -0.19 -1.09 0.52 -0.96 -4.86 118.95 111.82 3hm7 s ARG 205 Ca 0.00 -0.95 0.13 0.00 -0.52 0.00 0.00 55.73 54.39 3hm7 s ARG 205 Cb 0.00 -4.41 0.40 0.00 0.52 0.00 0.00 34.95 31.47 3hm7 s ARG 205 CO 0.00 -1.87 1.21 1.28 0.02 0.00 0.00 175.30 175.94 3hm7 n LEU 206 N 7.75 2.55 -4.98 2.53 4.77 -1.26 -4.64 117.00 123.71 3hm7 n LEU 206 Ca 0.04 -3.68 -0.26 0.00 -0.03 0.00 0.00 56.01 52.08 3hm7 n LEU 206 Cb 0.47 -0.48 0.15 0.00 -2.33 0.00 0.00 43.42 41.23 3hm7 n LEU 206 CO 0.63 1.26 0.69 0.42 -1.33 0.00 0.00 177.39 179.06 3hm7 s THR 207 N -2.99 2.00 0.22 -5.08 -4.23 -1.26 -4.49 115.64 99.81 3hm7 s THR 207 Ca 0.37 -0.40 0.05 0.00 -1.18 0.00 0.00 61.69 60.53 3hm7 s THR 207 Cb 0.36 -2.60 -0.08 0.00 1.34 0.00 0.00 72.50 71.51 3hm7 s THR 207 CO -0.06 0.00 1.50 -0.37 -0.54 0.00 0.00 174.62 175.15 3hm7 h VAL 208 N -1.04 1.44 -0.52 2.29 -1.51 -1.95 -3.04 116.25 111.93 3hm7 h VAL 208 Ca -0.38 -2.25 -0.12 0.00 -1.23 0.00 0.00 66.70 62.72 3hm7 h VAL 208 Cb 1.24 2.20 -0.02 0.00 -2.13 0.00 0.00 31.29 32.58 3hm7 h VAL 208 CO 0.35 0.66 -0.16 0.50 -1.23 0.00 0.00 177.57 177.68 3hm7 h LYS 209 N 0.12 1.02 -0.76 5.19 3.64 -1.95 -2.34 116.57 121.49 3hm7 h LYS 209 Ca -0.02 -0.41 -0.04 0.00 -1.27 0.00 0.00 60.65 58.91 3hm7 h LYS 209 Cb 1.25 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.99 3hm7 h LYS 209 CO 0.11 1.09 0.30 -0.44 -2.27 0.00 0.00 179.45 178.24 3hm7 h ASP 210 N 0.89 1.05 -0.51 4.20 3.32 -1.88 -0.64 116.42 122.85 3hm7 h ASP 210 Ca 0.13 -0.16 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 3hm7 h ASP 210 Cb 0.74 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 3hm7 h ASP 210 CO 0.06 0.93 0.14 0.22 -1.72 0.00 0.00 179.24 178.87 3hm7 h TYR 211 N 1.11 0.83 -0.83 4.55 3.20 -1.41 -1.26 116.97 123.17 3hm7 h TYR 211 Ca 0.26 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 62.01 3hm7 h TYR 211 Cb 0.21 -0.24 -0.04 0.00 1.54 0.00 0.00 36.73 38.21 3hm7 h TYR 211 CO 0.02 0.73 0.42 1.03 -1.64 0.00 0.00 178.16 178.72 3hm7 h SER 212 N 0.69 1.06 1.72 -2.11 0.87 -1.01 -2.62 113.55 112.15 3hm7 h SER 212 Ca 0.16 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 3hm7 h SER 212 Cb 0.30 -0.27 0.00 0.00 -0.44 0.00 0.00 62.40 61.99 3hm7 h SER 212 CO -0.00 0.87 -0.09 -0.33 -0.53 0.00 0.00 176.83 176.75 3hm7 h GLU 213 N 1.17 0.00 0.00 2.24 5.08 -0.99 -3.09 114.58 118.98 3hm7 h GLU 213 Ca 0.29 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.61 3hm7 h GLU 213 Cb 0.08 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 3hm7 h GLU 213 CO -0.04 0.00 -0.20 0.00 -1.00 0.00 0.00 179.01 177.77 3hm7 h ALA 214 N 2.19 0.90 -2.45 3.43 0.00 -0.86 -3.28 119.26 119.19 3hm7 h ALA 214 Ca 0.00 -0.18 -0.60 0.00 0.00 0.00 0.00 54.91 54.13 3hm7 h ALA 214 Cb 0.90 -0.03 -0.41 0.00 0.00 0.00 0.00 17.79 18.26 3hm7 h ALA 214 CO 0.00 0.25 -0.77 0.54 0.00 0.00 0.00 179.25 179.27 3hm7 n ARG 215 N -3.19 1.50 -2.09 0.00 1.74 -1.08 -4.18 116.66 109.36 3hm7 n ARG 215 Ca 0.02 -4.03 -0.28 0.00 -0.77 0.00 0.00 57.85 52.79 3hm7 n ARG 215 Cb 0.55 -1.94 0.16 0.00 -1.02 0.00 0.00 32.46 30.22 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 -1.43 0.94 0.29 5.56 0.04 -1.18 -4.54 135.00 134.69 3hm7 s PRO 216 Ca 0.33 -0.56 -0.01 0.00 0.04 0.00 0.00 61.00 60.80 3hm7 s PRO 216 Cb 0.08 -1.97 0.44 0.00 0.04 0.00 0.00 34.50 33.09 3hm7 s PRO 216 CO -0.11 -2.15 1.86 0.82 0.04 0.00 0.00 177.00 177.46 3hm7 h ILE 217 N -1.35 1.21 -0.67 0.56 2.04 -1.93 -2.48 117.51 114.89 3hm7 h ILE 217 Ca -0.43 -0.71 0.01 0.00 1.00 0.00 0.00 64.86 64.74 3hm7 h ILE 217 Cb 1.25 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 3hm7 h ILE 217 CO 0.40 0.27 0.44 1.62 0.00 0.00 0.00 178.15 180.88 3hm7 h VAL 218 N 0.83 1.15 -0.56 1.67 3.04 -1.98 0.46 116.25 120.86 3hm7 h VAL 218 Ca 0.19 -0.30 -0.00 0.00 -1.01 0.00 0.00 66.70 65.58 3hm7 h VAL 218 Cb 0.21 0.20 -0.03 0.00 -2.01 0.00 0.00 31.29 29.66 3hm7 h VAL 218 CO -0.01 0.16 0.34 -1.28 -1.01 0.00 0.00 177.57 175.76 3hm7 h SER 219 N 0.87 0.67 -0.90 3.17 0.87 -1.81 0.82 113.55 117.24 3hm7 h SER 219 Ca 0.25 -0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.74 3hm7 h SER 219 Cb -0.05 -0.17 -0.04 0.00 -0.44 0.00 0.00 62.40 61.69 3hm7 h SER 219 CO -0.06 0.53 0.53 -0.33 -0.53 0.00 0.00 176.83 176.98 3hm7 h GLU 220 N 0.76 1.24 -0.55 2.24 5.08 -1.20 -2.47 114.58 119.67 3hm7 h GLU 220 Ca 0.20 -0.12 -0.10 0.00 -1.00 0.00 0.00 59.36 58.34 3hm7 h GLU 220 Cb -0.02 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 28.96 3hm7 h GLU 220 CO -0.04 0.87 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.72 3hm7 h LEU 221 N 1.25 0.99 -0.11 1.33 3.38 -0.43 -1.08 115.31 120.64 3hm7 h LEU 221 Ca 0.32 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3hm7 h LEU 221 Cb -0.03 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.45 3hm7 h LEU 221 CO -0.06 1.07 0.04 -0.08 0.09 0.00 0.00 178.44 179.50 3hm7 h GLU 222 N 0.90 0.17 -0.41 1.13 4.22 -0.67 -0.59 114.58 119.33 3hm7 h GLU 222 Ca 0.15 -0.03 -0.15 0.00 0.08 0.00 0.00 59.36 59.41 3hm7 h GLU 222 Cb 0.60 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 3hm7 h GLU 222 CO 0.04 0.30 -0.33 0.00 -2.18 0.00 0.00 179.01 176.85 3hm7 h ALA 223 N 0.86 0.59 0.06 2.92 0.00 -1.43 0.03 119.26 122.29 3hm7 h ALA 223 Ca 0.04 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 3hm7 h ALA 223 Cb 0.20 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3hm7 h ALA 223 CO -0.00 0.66 -0.03 0.28 0.00 0.00 0.00 179.25 180.16 3hm7 h VAL 224 N 0.78 0.96 -0.68 0.00 2.07 -1.22 -1.39 116.25 116.76 3hm7 h VAL 224 Ca 0.08 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.61 3hm7 h VAL 224 Cb 0.92 0.99 -0.06 0.00 -1.52 0.00 0.00 31.29 31.62 3hm7 h VAL 224 CO 0.09 0.01 0.38 -0.33 0.02 0.00 0.00 177.57 177.74 3hm7 h GLU 225 N -0.10 0.67 0.35 1.57 5.08 -0.91 -1.23 114.58 120.01 3hm7 h GLU 225 Ca -0.01 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3hm7 h GLU 225 Cb 0.08 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.18 3hm7 h GLU 225 CO 0.01 0.44 -0.18 -0.09 -1.00 0.00 0.00 179.01 178.19 3hm7 h ARG 226 N 0.69 -0.47 -0.67 2.33 2.43 -0.87 -2.47 114.38 115.36 3hm7 h ARG 226 Ca 0.31 0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.48 3hm7 h ARG 226 Cb 0.21 0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 3hm7 h ARG 226 CO -0.19 -0.32 0.29 0.97 -1.51 0.00 0.00 179.97 179.21 3hm7 h ILE 227 N -0.49 1.22 -0.91 1.20 6.09 -1.02 -1.82 117.51 121.79 3hm7 h ILE 227 Ca -0.04 -0.67 0.05 0.00 -1.37 0.00 0.00 64.86 62.82 3hm7 h ILE 227 Cb 0.39 0.40 -0.06 0.00 0.47 0.00 0.00 36.82 38.02 3hm7 h ILE 227 CO 0.06 0.28 0.58 -0.07 -3.07 0.00 0.00 178.15 175.93 3hm7 h LEU 228 N 0.96 0.95 -0.41 2.19 3.38 -1.17 0.09 115.31 121.29 3hm7 h LEU 228 Ca 0.23 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.09 3hm7 h LEU 228 Cb 0.15 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3hm7 h LEU 228 CO -0.02 0.63 -0.16 0.03 0.09 0.00 0.00 178.44 179.01 3hm7 h ARG 229 N 1.10 0.84 -0.70 1.13 2.47 -0.89 -1.70 114.38 116.63 3hm7 h ARG 229 Ca 0.38 -0.35 -0.00 0.00 -1.26 0.00 0.00 59.98 58.74 3hm7 h ARG 229 Cb 0.08 -0.03 -0.03 0.00 -1.65 0.00 0.00 29.97 28.33 3hm7 h ARG 229 CO -0.14 0.99 0.43 0.74 0.56 0.00 0.00 179.97 182.54 3hm7 h PHE 230 N 0.66 0.92 -0.99 3.04 0.05 -1.07 -2.32 116.94 117.23 3hm7 h PHE 230 Ca 0.10 0.00 0.08 0.00 3.82 0.00 0.00 57.97 61.96 3hm7 h PHE 230 Cb 0.71 -0.30 -0.07 0.00 2.00 0.00 0.00 35.95 38.29 3hm7 h PHE 230 CO 0.05 0.62 0.63 0.00 -0.18 0.00 0.00 178.31 179.43 3hm7 h ALA 231 N 1.22 1.40 -0.71 2.45 0.00 -0.85 0.18 119.26 122.95 3hm7 h ALA 231 Ca 0.25 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.10 3hm7 h ALA 231 Cb -0.04 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3hm7 h ALA 231 CO -0.05 0.37 0.26 1.96 0.00 0.00 0.00 179.25 181.80 3hm7 h GLN 232 N 1.11 1.06 -0.01 0.00 4.20 -0.78 0.21 115.11 120.90 3hm7 h GLN 232 Ca 0.44 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.94 3hm7 h GLN 232 Cb 0.24 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.85 3hm7 h GLN 232 CO -0.19 0.88 -0.07 1.25 -0.67 0.00 0.00 178.83 180.03 3hm7 h LEU 233 N 1.04 0.09 0.00 1.46 6.46 -1.06 -3.35 115.31 119.94 3hm7 h LEU 233 Ca 0.24 -0.66 -0.02 0.00 -0.12 0.00 0.00 57.88 57.32 3hm7 h LEU 233 Cb 0.23 -0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 40.13 3hm7 h LEU 233 CO -0.02 0.73 -0.19 0.71 -0.62 0.00 0.00 178.44 179.06 3hm7 h THR 234 N -0.55 0.13 -3.30 1.05 1.35 -0.89 -3.47 112.91 107.22 3hm7 h THR 234 Ca -0.00 -1.18 -0.40 0.00 -0.55 0.00 0.00 66.41 64.28 3hm7 h THR 234 Cb 0.73 2.01 0.01 0.00 -1.73 0.00 0.00 68.15 69.16 3hm7 h THR 234 CO 0.01 0.07 -0.54 0.00 -0.25 0.00 0.00 175.52 174.82 3hm7 n PRO 237 N 5.54 2.16 -4.21 0.00 -0.02 -1.26 -4.75 135.00 132.45 3hm7 n PRO 237 Ca -0.07 0.76 -0.17 0.00 -2.02 0.00 0.00 63.50 62.00 3hm7 n PRO 237 Cb 0.49 -2.41 -0.12 0.00 -0.02 0.00 0.00 33.50 31.44 3hm7 n PRO 237 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3hm7 s ILE 238 N -0.40 0.92 -0.07 4.25 1.10 -0.64 -1.61 121.20 124.74 3hm7 s ILE 238 Ca 0.63 -1.06 0.01 0.00 -0.51 0.00 0.00 60.65 59.73 3hm7 s ILE 238 Cb -0.60 -0.88 0.02 0.00 0.15 0.00 0.00 42.46 41.14 3hm7 s ILE 238 CO 0.54 -0.16 -0.10 -2.28 -2.11 0.00 0.00 174.94 170.83 3hm7 s HIS 239 N -1.06 1.34 -0.37 3.50 5.65 -0.23 -1.54 115.29 122.57 3hm7 s HIS 239 Ca -0.02 -0.52 -0.14 0.00 0.25 0.00 0.00 55.06 54.63 3hm7 s HIS 239 Cb -0.09 -1.04 0.00 0.00 -1.18 0.00 0.00 32.58 30.28 3hm7 s HIS 239 CO 0.01 -0.31 0.26 0.42 -0.65 0.00 0.00 174.74 174.47 3hm7 s ILE 240 N 0.94 5.21 0.71 0.89 -1.09 -0.30 -1.50 121.20 126.05 3hm7 s ILE 240 Ca -0.10 -0.47 -0.11 0.00 -2.23 0.00 0.00 60.65 57.74 3hm7 s ILE 240 Cb -0.15 -3.79 0.02 0.00 -1.58 0.00 0.00 42.46 36.95 3hm7 s ILE 240 CO 0.01 -0.16 1.06 0.00 -1.23 0.00 0.00 174.94 174.62 3hm7 n HIS 242 N -3.17 0.00 -3.02 0.00 -0.00 -1.25 -4.71 115.22 103.07 3hm7 n HIS 242 Ca 0.07 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.40 3hm7 n HIS 242 Cb 0.54 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.47 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 -0.09 4.68 -0.14 0.61 1.01 -0.93 -4.50 120.40 121.05 3hm7 s VAL 243 Ca 0.00 1.58 0.22 0.00 0.00 0.00 0.00 61.98 63.78 3hm7 s VAL 243 Cb 0.00 -4.09 -0.16 0.00 0.00 0.00 0.00 36.38 32.13 3hm7 s VAL 243 CO 0.00 0.41 0.77 -1.54 0.00 0.00 0.00 175.10 174.74 3hm7 n SER 244 N 2.53 0.45 -4.02 3.32 3.41 -1.26 -4.63 113.62 113.42 3hm7 n SER 244 Ca -0.04 0.18 -0.14 0.00 -0.26 0.00 0.00 58.87 58.61 3hm7 n SER 244 Cb 0.50 1.15 -0.12 0.00 -0.26 0.00 0.00 64.21 65.48 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 -4.99 0.76 0.46 4.04 0.15 -1.26 -4.80 113.70 108.05 3hm7 s SER 245 Ca -0.04 -0.39 0.18 0.00 0.70 0.00 0.00 55.95 56.40 3hm7 s SER 245 Cb 0.11 0.00 1.12 0.00 -1.71 0.00 0.00 66.02 65.55 3hm7 s SER 245 CO 0.85 -0.12 2.00 -0.09 1.20 0.00 0.00 173.24 177.08 3hm7 h ARG 246 N 5.01 0.00 -0.95 5.44 2.43 -1.85 -2.55 114.38 121.91 3hm7 h ARG 246 Ca -0.33 0.00 0.15 0.00 -0.81 0.00 0.00 59.98 58.99 3hm7 h ARG 246 Cb 1.20 0.00 -0.10 0.00 -0.42 0.00 0.00 29.97 30.65 3hm7 h ARG 246 CO 0.44 0.18 0.56 0.87 -1.51 0.00 0.00 179.97 180.51 3hm7 h LYS 247 N 0.00 0.77 -0.16 0.20 1.57 -1.96 0.35 116.57 117.34 3hm7 h LYS 247 Ca -0.00 -0.05 -0.20 0.00 -1.87 0.00 0.00 60.65 58.53 3hm7 h LYS 247 Cb 0.36 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.50 3hm7 h LYS 247 CO 0.02 0.51 -0.69 0.28 -0.57 0.00 0.00 179.45 179.00 3hm7 h VAL 248 N 0.79 1.31 -0.13 0.50 2.07 -1.82 -3.06 116.25 115.91 3hm7 h VAL 248 Ca 0.51 -1.95 -0.03 0.00 0.82 0.00 0.00 66.70 66.06 3hm7 h VAL 248 Cb 0.68 1.92 -0.01 0.00 -1.52 0.00 0.00 31.29 32.36 3hm7 h VAL 248 CO -0.34 0.61 -0.06 -0.07 0.02 0.00 0.00 177.57 177.73 3hm7 h LEU 249 N 0.48 0.17 -0.45 2.57 3.38 -1.16 -1.72 115.31 118.58 3hm7 h LEU 249 Ca -0.03 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.75 3hm7 h LEU 249 Cb 1.29 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 3hm7 h LEU 249 CO 0.14 0.26 -0.59 0.11 0.09 0.00 0.00 178.44 178.46 3hm7 h LYS 250 N 0.18 0.59 -0.40 1.13 1.57 -0.95 -1.03 116.57 117.67 3hm7 h LYS 250 Ca 0.04 -0.39 -0.13 0.00 -1.87 0.00 0.00 60.65 58.30 3hm7 h LYS 250 Cb 0.23 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 3hm7 h LYS 250 CO 0.01 1.01 -0.27 -0.09 -0.57 0.00 0.00 179.45 179.54 3hm7 h ARG 251 N 0.45 0.83 -0.41 3.15 9.65 -1.36 -1.47 114.38 125.22 3hm7 h ARG 251 Ca 0.00 -0.37 -0.14 0.00 -1.10 0.00 0.00 59.98 58.37 3hm7 h ARG 251 Cb 1.15 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.69 3hm7 h ARG 251 CO 0.11 1.00 -0.31 0.82 2.80 0.00 0.00 179.97 184.39 3hm7 h ILE 252 N 0.71 1.27 -0.74 1.20 2.04 -1.27 -2.13 117.51 118.59 3hm7 h ILE 252 Ca 0.09 -1.47 0.06 0.00 1.00 0.00 0.00 64.86 64.54 3hm7 h ILE 252 Cb 0.81 1.28 -0.06 0.00 -0.74 0.00 0.00 36.82 38.12 3hm7 h ILE 252 CO 0.07 0.50 0.43 0.50 0.00 0.00 0.00 178.15 179.65 3hm7 h LYS 253 N 0.76 0.77 -0.43 2.37 3.64 -1.02 0.12 116.57 122.77 3hm7 h LYS 253 Ca 0.08 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.42 3hm7 h LYS 253 Cb 0.88 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 3hm7 h LYS 253 CO 0.08 0.51 0.28 0.37 -2.27 0.00 0.00 179.45 178.42 3hm7 h GLN 254 N 0.79 0.57 -0.69 1.90 4.15 -1.08 -1.19 115.11 119.55 3hm7 h GLN 254 Ca 0.33 -0.04 -0.07 0.00 0.77 0.00 0.00 58.65 59.64 3hm7 h GLN 254 Cb 0.19 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.72 3hm7 h GLN 254 CO -0.18 0.38 0.15 0.00 -1.93 0.00 0.00 178.83 177.25 3hm7 h ALA 255 N 1.15 0.91 -0.63 3.38 0.00 -0.77 -2.29 119.26 121.03 3hm7 h ALA 255 Ca 0.16 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3hm7 h ALA 255 Cb -0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 3hm7 h ALA 255 CO -0.03 0.65 0.40 0.87 0.00 0.00 0.00 179.25 181.14 3hm7 h LYS 256 N 1.05 0.84 -0.38 0.00 1.57 -0.52 -1.85 116.57 117.28 3hm7 h LYS 256 Ca 0.21 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3hm7 h LYS 256 Cb 0.39 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 3hm7 h LYS 256 CO 0.01 0.57 0.24 0.78 -0.57 0.00 0.00 179.45 180.48 3hm7 h GLY 257 N 0.85 0.54 2.00 3.86 0.00 -1.07 -2.50 103.07 106.75 3hm7 h GLY 257 Ca 0.23 -0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.35 3hm7 h GLY 257 CO -0.05 0.20 0.00 1.18 0.00 0.00 0.00 176.54 177.87 3hm7 n GLU 258 N -4.47 0.27 0.00 4.80 1.02 -0.83 -4.94 120.64 116.48 3hm7 n GLU 258 Ca 0.03 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.41 3hm7 n GLU 258 Cb 0.07 -1.83 0.00 0.00 -0.02 0.00 0.00 31.44 29.66 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 1.16 0.96 3.72 0.62 0.00 -0.82 -5.09 105.19 105.74 3hm7 n GLY 259 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 3.49 -1.08 1.61 1.01 -0.76 -4.95 120.40 117.73 3hm7 s VAL 260 Ca 0.00 1.14 -0.22 0.00 0.00 0.00 0.00 61.98 62.90 3hm7 s VAL 260 Cb 0.00 -3.73 0.03 0.00 0.00 0.00 0.00 36.38 32.69 3hm7 s VAL 260 CO 0.00 0.12 1.60 0.21 0.00 0.00 0.00 175.10 177.04 3hm7 s ASN 261 N 0.75 6.33 -0.01 3.32 3.84 -1.26 -4.48 114.94 123.42 3hm7 s ASN 261 Ca 0.59 -1.58 0.02 0.00 0.21 0.00 0.00 52.86 52.10 3hm7 s ASN 261 Cb -0.34 -2.57 -0.00 0.00 -0.55 0.00 0.00 41.25 37.78 3hm7 s ASN 261 CO 0.33 -1.67 -0.07 0.54 -2.79 0.00 0.00 177.10 173.43 3hm7 s VAL 262 N 5.78 0.63 0.32 -5.21 0.11 -1.26 -1.63 120.40 119.14 3hm7 s VAL 262 Ca 0.52 -0.30 0.09 0.00 -2.93 0.00 0.00 61.98 59.36 3hm7 s VAL 262 Cb -0.00 -0.55 -0.05 0.00 -1.53 0.00 0.00 36.38 34.25 3hm7 s VAL 262 CO -0.04 0.19 0.04 -0.94 -3.33 0.00 0.00 175.10 171.03 3hm7 s SER 263 N 0.04 4.40 -0.04 3.54 1.04 -0.59 -4.99 113.70 117.10 3hm7 s SER 263 Ca -0.00 -0.85 -0.02 0.00 0.48 0.00 0.00 55.95 55.56 3hm7 s SER 263 Cb -0.06 -0.66 0.02 0.00 0.10 0.00 0.00 66.02 65.43 3hm7 s SER 263 CO -0.00 -0.19 0.08 0.54 0.98 0.00 0.00 173.24 174.65 3hm7 s VAL 264 N -2.44 -0.03 0.24 5.02 0.11 -1.26 -1.15 120.40 120.88 3hm7 s VAL 264 Ca 0.35 0.12 0.09 0.00 -2.93 0.00 0.00 61.98 59.60 3hm7 s VAL 264 Cb -0.02 -0.14 -0.04 0.00 -1.53 0.00 0.00 36.38 34.64 3hm7 s VAL 264 CO 0.20 0.05 0.02 -1.83 -3.33 0.00 0.00 175.10 170.22 3hm7 s GLU 265 N 0.68 2.41 0.45 1.54 -1.05 -0.57 -1.27 118.70 120.89 3hm7 s GLU 265 Ca -0.05 -1.29 0.03 0.00 -0.15 0.00 0.00 54.97 53.51 3hm7 s GLU 265 Cb -0.07 -2.26 -0.01 0.00 -0.44 0.00 0.00 34.13 31.34 3hm7 s GLU 265 CO -0.03 0.39 0.10 -0.08 0.95 0.00 0.00 175.26 176.60 3hm7 s THR 266 N -2.15 0.67 0.12 1.83 -1.32 -1.13 -2.18 115.64 111.50 3hm7 s THR 266 Ca 0.31 -2.00 0.09 0.00 -1.21 0.00 0.00 61.69 58.87 3hm7 s THR 266 Cb -0.07 -2.22 -0.04 0.00 -1.51 0.00 0.00 72.50 68.66 3hm7 s THR 266 CO 0.20 0.00 -0.21 0.00 -2.21 0.00 0.00 174.62 172.40 3hm7 h PRO 268 N 3.83 0.00 0.00 0.00 0.13 -1.84 -2.30 132.00 131.82 3hm7 h PRO 268 Ca -0.46 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.58 3hm7 h PRO 268 Cb 1.19 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 3hm7 h PRO 268 CO 0.42 0.00 -0.45 1.12 -0.23 0.00 0.00 178.00 178.86 3hm7 h HIS 269 N 0.00 0.00 0.00 1.56 2.07 -1.93 0.35 115.15 117.20 3hm7 h HIS 269 Ca 0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.51 3hm7 h HIS 269 Cb 0.38 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.36 3hm7 h HIS 269 CO 0.00 0.45 -0.04 1.88 -3.07 0.00 0.00 177.93 177.15 3hm7 h TYR 270 N 0.00 0.00 0.00 6.12 0.05 -1.68 -1.08 116.97 120.38 3hm7 h TYR 270 Ca -0.00 0.00 -0.27 0.00 0.05 0.00 0.00 58.73 58.50 3hm7 h TYR 270 Cb 1.04 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 38.73 3hm7 h TYR 270 CO 0.00 0.04 -1.55 -0.07 -1.05 0.00 0.00 178.16 175.53 3hm7 h LEU 271 N 0.00 0.01 0.03 3.88 3.38 -1.38 -3.42 115.31 117.81 3hm7 h LEU 271 Ca -0.00 -0.02 -0.38 0.00 0.09 0.00 0.00 57.88 57.57 3hm7 h LEU 271 Cb 0.68 -0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.37 3hm7 h LEU 271 CO 0.01 1.02 -2.19 -0.11 0.09 0.00 0.00 178.44 177.25 3hm7 n LEU 272 N -3.12 2.45 -4.71 1.67 0.00 0.06 -4.98 117.00 108.36 3hm7 n LEU 272 Ca -0.13 0.16 -0.35 0.00 0.00 0.00 0.00 56.01 55.68 3hm7 n LEU 272 Cb 1.03 -0.94 -0.09 0.00 0.00 0.00 0.00 43.42 43.42 3hm7 n LEU 272 CO 0.45 0.72 -0.25 -0.36 0.00 0.00 0.00 177.39 177.95 3hm7 s PHE 273 N -2.50 3.30 0.00 1.96 2.99 -0.42 -5.04 117.98 118.27 3hm7 s PHE 273 Ca -0.32 0.22 0.00 0.00 0.00 0.00 0.00 56.93 56.82 3hm7 s PHE 273 Cb 0.10 -1.94 0.00 0.00 0.00 0.00 0.00 43.02 41.18 3hm7 s PHE 273 CO 0.61 0.40 0.00 -1.13 -0.00 0.00 0.00 175.22 175.10 3hm7 n SER 274 N 2.66 0.18 0.13 1.36 3.41 -1.26 -4.65 113.62 115.44 3hm7 n SER 274 Ca -0.18 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.37 3hm7 n SER 274 Cb 0.53 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.57 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 -0.34 1.04 5.85 -1.31 -2.12 115.31 118.43 3hm7 h LEU 275 Ca 0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 3hm7 h LEU 275 Cb 0.00 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3hm7 h LEU 275 CO 0.00 0.63 0.05 0.44 -0.34 0.00 0.00 178.44 179.21 3hm7 h ASP 276 N 0.00 0.54 0.93 1.25 3.32 -1.95 -1.97 116.42 118.54 3hm7 h ASP 276 Ca -0.01 -0.27 -0.13 0.00 0.02 0.00 0.00 57.03 56.64 3hm7 h ASP 276 Cb 1.32 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.71 3hm7 h ASP 276 CO 0.08 0.67 -0.64 -0.33 -1.72 0.00 0.00 179.24 177.31 3hm7 h GLU 277 N 0.39 0.00 -0.18 3.56 3.07 -1.93 -2.87 114.58 116.62 3hm7 h GLU 277 Ca 0.10 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.96 3hm7 h GLU 277 Cb 0.37 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.27 3hm7 h GLU 277 CO 0.01 0.64 0.11 0.35 -1.40 0.00 0.00 179.01 178.71 3hm7 h PHE 278 N 0.00 0.23 -0.39 4.33 3.04 -1.31 -1.10 116.94 121.74 3hm7 h PHE 278 Ca -0.01 0.00 0.03 0.00 3.98 0.00 0.00 57.97 61.98 3hm7 h PHE 278 Cb 1.27 -0.08 -0.03 0.00 2.56 0.00 0.00 35.95 39.67 3hm7 h PHE 278 CO 0.00 0.18 0.18 0.00 -2.02 0.00 0.00 178.31 176.66 3hm7 h ALA 279 N 1.03 0.48 -0.01 2.41 0.00 -1.22 0.19 119.26 122.14 3hm7 h ALA 279 Ca 0.06 0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.74 3hm7 h ALA 279 Cb 0.02 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 17.78 3hm7 h ALA 279 CO -0.01 -0.18 -1.00 0.93 0.00 0.00 0.00 179.25 178.98 3hm7 h GLU 280 N 0.38 0.69 -0.35 0.00 5.08 -1.47 -3.21 114.58 115.70 3hm7 h GLU 280 Ca 0.17 -0.74 -0.16 0.00 -1.00 0.00 0.00 59.36 57.63 3hm7 h GLU 280 Cb 0.09 0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 3hm7 h GLU 280 CO -0.13 1.31 -0.42 0.82 -1.00 0.00 0.00 179.01 179.59 3hm7 h ILE 281 N 0.37 1.27 0.00 3.13 2.04 -1.22 -3.49 117.51 119.62 3hm7 h ILE 281 Ca -0.12 -1.60 0.00 0.00 1.00 0.00 0.00 64.86 64.14 3hm7 h ILE 281 Cb 1.66 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 39.21 3hm7 h ILE 281 CO 0.20 0.53 0.00 0.61 0.00 0.00 0.00 178.15 179.49 3hm7 n GLY 282 N 0.21 0.36 0.30 5.37 0.00 0.67 -4.33 105.19 107.77 3hm7 n GLY 282 Ca -0.03 -0.83 0.19 0.00 0.00 0.00 0.00 46.02 45.35 3hm7 n GLY 282 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3hm7 h TYR 283 N 0.00 0.00 0.00 1.61 0.05 -1.89 -2.57 116.97 114.17 3hm7 h TYR 283 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3hm7 h TYR 283 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 3hm7 h TYR 283 CO 0.00 0.01 0.00 -0.07 -1.05 0.00 0.00 178.16 177.05 3hm7 h LEU 284 N 0.00 0.00 -3.14 3.88 3.38 -1.88 -3.12 115.31 114.43 3hm7 h LEU 284 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3hm7 h LEU 284 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 3hm7 h LEU 284 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 3hm7 n ALA 285 N -2.00 3.07 -2.60 1.53 0.00 -0.97 -4.54 120.51 115.00 3hm7 n ALA 285 Ca 0.02 -1.61 -0.43 0.00 0.00 0.00 0.00 53.44 51.42 3hm7 n ALA 285 Cb 0.37 -0.99 -0.02 0.00 0.00 0.00 0.00 19.45 18.80 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 -1.85 4.23 0.14 0.00 2.20 -1.18 -4.71 119.74 118.57 3hm7 s LYS 286 Ca 0.51 1.41 -0.01 0.00 -0.36 0.00 0.00 55.97 57.52 3hm7 s LYS 286 Cb 0.33 -3.68 -0.04 0.00 -1.51 0.00 0.00 37.83 32.92 3hm7 s LYS 286 CO 0.24 -0.68 0.05 0.00 -0.36 0.00 0.00 175.35 174.60 3hm7 s ALA 288 N -3.98 2.36 0.70 0.00 0.00 -1.26 -2.42 121.76 117.16 3hm7 s ALA 288 Ca 0.24 -1.18 -0.16 0.00 0.00 0.00 0.00 51.96 50.86 3hm7 s ALA 288 Cb 0.07 -1.18 0.02 0.00 0.00 0.00 0.00 23.12 22.04 3hm7 s ALA 288 CO 0.02 -0.26 1.22 -2.14 0.00 0.00 0.00 175.76 174.60 3hm7 s PRO 289 N 1.17 2.30 0.94 0.00 0.02 -1.26 -5.02 135.00 133.16 3hm7 s PRO 289 Ca 0.02 1.82 -0.11 0.00 0.02 0.00 0.00 61.00 62.74 3hm7 s PRO 289 Cb -0.14 -1.85 0.16 0.00 0.02 0.00 0.00 34.50 32.69 3hm7 s PRO 289 CO -0.09 -1.72 1.09 -2.14 -0.33 0.00 0.00 177.00 173.81 3hm7 s PRO 290 N -3.75 0.84 0.55 5.54 0.02 -1.02 -4.98 135.00 132.20 3hm7 s PRO 290 Ca 0.76 1.05 -0.19 0.00 0.02 0.00 0.00 61.00 62.64 3hm7 s PRO 290 Cb -0.31 -1.74 -0.05 0.00 0.02 0.00 0.00 34.50 32.42 3hm7 s PRO 290 CO 0.43 -2.59 1.12 -0.51 -0.33 0.00 0.00 177.00 175.12 3hm7 s LEU 291 N -6.50 3.72 0.00 -5.54 1.43 -1.26 -4.91 118.68 105.62 3hm7 s LEU 291 Ca 0.65 2.14 0.03 0.00 -1.03 0.00 0.00 54.13 55.93 3hm7 s LEU 291 Cb -0.21 -4.58 0.03 0.00 0.03 0.00 0.00 46.19 41.47 3hm7 s LEU 291 CO 0.59 -1.24 0.27 0.54 0.23 0.00 0.00 176.35 176.74 3hm7 n ARG 292 N -1.40 0.75 -1.26 1.70 5.12 -1.26 -4.75 116.66 115.55 3hm7 n ARG 292 Ca 0.11 -3.38 -0.30 0.00 -1.93 0.00 0.00 57.85 52.36 3hm7 n ARG 292 Cb 0.51 0.54 0.12 0.00 -1.16 0.00 0.00 32.46 32.48 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 -4.03 1.54 0.21 5.56 -1.05 -1.26 -0.93 118.70 118.74 3hm7 s GLU 293 Ca 0.20 0.86 -0.10 0.00 -0.15 0.00 0.00 54.97 55.78 3hm7 s GLU 293 Cb -0.02 -1.84 0.21 0.00 -0.44 0.00 0.00 34.13 32.04 3hm7 s GLU 293 CO 0.13 -2.06 1.83 -0.09 0.95 0.00 0.00 175.26 176.02 3hm7 h ARG 294 N -1.42 0.74 -0.94 -4.83 9.65 -1.95 -0.80 114.38 114.82 3hm7 h ARG 294 Ca -0.48 -0.04 0.14 0.00 -1.10 0.00 0.00 59.98 58.50 3hm7 h ARG 294 Cb 1.27 -0.17 -0.09 0.00 -1.39 0.00 0.00 29.97 29.59 3hm7 h ARG 294 CO 0.55 0.49 0.56 0.37 2.80 0.00 0.00 179.97 184.73 3hm7 h GLN 295 N 0.76 0.79 -0.11 0.20 -0.00 -1.99 -0.07 115.11 114.69 3hm7 h GLN 295 Ca 0.29 -0.05 -0.18 0.00 -0.00 0.00 0.00 58.65 58.71 3hm7 h GLN 295 Cb 0.10 -0.18 -0.00 0.00 0.00 0.00 0.00 27.48 27.40 3hm7 h GLN 295 CO -0.14 0.52 -0.70 1.49 0.00 0.00 0.00 178.83 180.00 3hm7 h GLU 296 N 0.81 0.47 -0.27 1.69 4.57 -1.53 -1.55 114.58 118.76 3hm7 h GLU 296 Ca 0.50 -0.36 -0.05 0.00 -1.18 0.00 0.00 59.36 58.27 3hm7 h GLU 296 Cb 0.63 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.28 3hm7 h GLU 296 CO -0.32 0.99 -0.01 0.28 -1.18 0.00 0.00 179.01 178.77 3hm7 h VAL 297 N 0.33 1.26 -1.00 0.32 2.07 -0.80 -2.26 116.25 116.17 3hm7 h VAL 297 Ca -0.03 -0.94 0.04 0.00 0.82 0.00 0.00 66.70 66.60 3hm7 h VAL 297 Cb 1.27 1.33 -0.06 0.00 -1.52 0.00 0.00 31.29 32.31 3hm7 h VAL 297 CO 0.12 0.30 0.66 -0.08 0.02 0.00 0.00 177.57 178.59 3hm7 h GLU 298 N 0.27 1.22 -0.00 1.57 4.57 -0.89 -2.12 114.58 119.19 3hm7 h GLU 298 Ca 0.08 -0.07 -0.13 0.00 -1.18 0.00 0.00 59.36 58.06 3hm7 h GLU 298 Cb 0.44 -0.28 -0.02 0.00 -0.16 0.00 0.00 28.75 28.73 3hm7 h GLU 298 CO 0.02 0.81 -0.59 -0.44 -1.18 0.00 0.00 179.01 177.62 3hm7 h ASP 299 N 1.26 0.02 -0.16 1.04 3.45 -1.24 -3.08 116.42 117.70 3hm7 h ASP 299 Ca 0.41 -0.01 -0.09 0.00 0.43 0.00 0.00 57.03 57.77 3hm7 h ASP 299 Cb 0.03 -0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.78 3hm7 h ASP 299 CO -0.13 0.60 -0.19 0.25 -1.57 0.00 0.00 179.24 178.20 3hm7 h LEU 300 N 0.01 0.57 -0.60 1.55 5.85 -0.77 -2.02 115.31 119.90 3hm7 h LEU 300 Ca -0.01 -0.18 -0.12 0.00 0.84 0.00 0.00 57.88 58.42 3hm7 h LEU 300 Cb 1.05 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.91 3hm7 h LEU 300 CO 0.08 0.77 -0.14 -0.50 -0.34 0.00 0.00 178.44 178.31 3hm7 h TRP 301 N 0.52 1.07 -0.90 1.25 4.06 -1.44 -1.70 115.95 118.81 3hm7 h TRP 301 Ca 0.08 -0.23 0.05 0.00 2.06 0.00 0.00 58.89 60.85 3hm7 h TRP 301 Cb 0.62 -0.26 -0.05 0.00 -1.00 0.00 0.00 29.16 28.46 3hm7 h TRP 301 CO 0.02 1.02 0.59 -0.44 -3.56 0.00 0.00 178.44 176.08 3hm7 h ASP 302 N 0.85 0.95 -0.21 -3.49 3.45 -1.41 0.10 116.42 116.66 3hm7 h ASP 302 Ca 0.13 -0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.56 3hm7 h ASP 302 Cb 0.70 -0.21 -0.01 0.00 -0.56 0.00 0.00 39.33 39.25 3hm7 h ASP 302 CO 0.05 0.63 0.06 1.23 -1.57 0.00 0.00 179.24 179.64 3hm7 h GLY 303 N 1.09 0.36 0.89 2.75 0.00 -1.10 -2.13 103.07 104.92 3hm7 h GLY 303 Ca 0.37 -0.22 0.02 0.00 0.00 0.00 0.00 47.33 47.50 3hm7 h GLY 303 CO -0.12 0.20 0.18 -2.00 0.00 0.00 0.00 176.54 174.80 3hm7 h LEU 304 N 0.16 0.29 -1.02 3.11 6.46 -0.84 -0.05 115.31 123.41 3hm7 h LEU 304 Ca 0.07 0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.82 3hm7 h LEU 304 Cb 0.25 -0.05 -0.04 0.00 -0.73 0.00 0.00 40.66 40.09 3hm7 h LEU 304 CO -0.00 0.21 0.45 -0.03 -0.62 0.00 0.00 178.44 178.45 3hm7 h MET 305 N 0.38 1.13 -0.10 1.25 4.05 -0.78 -2.25 114.93 118.61 3hm7 h MET 305 Ca 0.13 -0.13 0.00 0.00 -0.28 0.00 0.00 59.70 59.43 3hm7 h MET 305 Cb 0.02 -0.22 0.00 0.00 -0.80 0.00 0.00 31.60 30.60 3hm7 h MET 305 CO -0.07 0.83 0.00 0.00 0.23 0.00 0.00 176.91 177.89 3hm7 n ALA 306 N -2.42 2.51 -1.00 0.39 0.00 -0.81 -4.89 120.51 114.29 3hm7 n ALA 306 Ca 0.08 -0.22 -0.00 0.00 0.00 0.00 0.00 53.44 53.31 3hm7 n ALA 306 Cb 0.10 -1.06 -0.00 0.00 0.00 0.00 0.00 19.45 18.49 3hm7 n ALA 306 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hm7 n GLY 307 N 0.75 0.43 0.02 0.00 0.00 -0.85 -4.94 105.19 100.60 3hm7 n GLY 307 Ca 0.07 -0.66 0.15 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.00 0.55 -4.88 1.61 1.02 -0.06 -4.74 120.64 111.14 3hm7 n GLU 308 Ca -0.00 -0.05 -0.33 0.00 -0.02 0.00 0.00 57.16 56.77 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 -2.48 2.92 -0.04 -3.67 1.01 -1.26 -4.92 121.20 112.76 3hm7 s ILE 309 Ca 0.31 -0.74 -0.20 0.00 0.00 0.00 0.00 60.65 60.02 3hm7 s ILE 309 Cb 0.20 -2.18 -0.32 0.00 0.01 0.00 0.00 42.46 40.18 3hm7 s ILE 309 CO 0.45 0.55 0.87 0.44 0.00 0.00 0.00 174.94 177.26 3hm7 h ASP 310 N 6.20 0.54 -5.07 3.58 5.19 -1.47 -3.49 116.42 121.89 3hm7 h ASP 310 Ca -0.33 -0.94 -0.04 0.00 -0.62 0.00 0.00 57.03 55.10 3hm7 h ASP 310 Cb 1.19 -0.18 -0.12 0.00 0.18 0.00 0.00 39.33 40.40 3hm7 h ASP 310 CO 0.53 1.49 -0.03 -1.48 -3.12 0.00 0.00 179.24 176.63 3hm7 s LEU 311 N -7.78 0.25 -0.06 1.55 0.05 -1.19 -4.68 118.68 106.82 3hm7 s LEU 311 Ca -0.13 -0.31 0.03 0.00 0.05 0.00 0.00 54.13 53.77 3hm7 s LEU 311 Cb 0.02 1.96 -0.02 0.00 -2.05 0.00 0.00 46.19 46.10 3hm7 s LEU 311 CO 0.85 -0.89 -0.14 -0.63 -0.55 0.00 0.00 176.35 174.98 3hm7 s ILE 312 N -3.81 3.06 0.06 1.48 -1.09 0.58 -2.82 121.20 118.67 3hm7 s ILE 312 Ca 0.04 -0.71 -0.03 0.00 -2.23 0.00 0.00 60.65 57.71 3hm7 s ILE 312 Cb 0.01 -2.21 -0.03 0.00 -1.58 0.00 0.00 42.46 38.65 3hm7 s ILE 312 CO -0.11 0.58 0.03 -0.55 -1.23 0.00 0.00 174.94 173.67 3hm7 s SER 313 N -0.57 0.36 0.08 3.58 0.15 -0.95 -4.58 113.70 111.77 3hm7 s SER 313 Ca 0.08 -0.85 -0.13 0.00 0.70 0.00 0.00 55.95 55.75 3hm7 s SER 313 Cb -0.11 0.23 -0.23 0.00 -1.71 0.00 0.00 66.02 64.19 3hm7 s SER 313 CO 0.01 -0.61 1.18 0.77 1.20 0.00 0.00 173.24 175.80 3hm7 h SER 314 N 3.18 0.87 -6.15 5.45 4.64 -1.87 -3.36 113.55 116.31 3hm7 h SER 314 Ca -0.34 -0.72 -0.43 0.00 -0.47 0.00 0.00 61.79 59.83 3hm7 h SER 314 Cb 1.16 -0.27 0.04 0.00 -0.31 0.00 0.00 62.40 63.02 3hm7 h SER 314 CO 0.61 1.52 -0.84 -0.67 -0.87 0.00 0.00 176.83 176.58 3hm7 n ASP 315 N -3.83 -1.08 -4.58 4.97 2.03 -0.70 -4.70 116.55 108.66 3hm7 n ASP 315 Ca -0.11 -0.85 -0.41 0.00 0.52 0.00 0.00 54.79 53.94 3hm7 n ASP 315 Cb 0.90 -3.89 -0.03 0.00 -0.72 0.00 0.00 41.12 37.38 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 -3.72 1.21 -0.55 -0.67 5.65 -1.21 -4.39 115.29 111.61 3hm7 s HIS 316 Ca 0.01 0.87 0.06 0.00 0.25 0.00 0.00 55.06 56.25 3hm7 s HIS 316 Cb -0.00 -3.85 0.21 0.00 -1.18 0.00 0.00 32.58 27.76 3hm7 s HIS 316 CO 0.82 -3.44 0.54 0.45 -0.65 0.00 0.00 174.74 172.46 3hm7 n SER 317 N 12.91 1.78 -4.93 9.88 2.88 0.43 -1.41 113.62 135.15 3hm7 n SER 317 Ca 0.31 -2.97 -0.25 0.00 -1.33 0.00 0.00 58.87 54.63 3hm7 n SER 317 Cb 0.48 -0.66 0.06 0.00 -0.75 0.00 0.00 64.21 63.34 3hm7 n SER 317 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 3hm7 s PRO 318 N -1.35 2.39 0.37 -1.46 0.04 -1.26 -3.34 135.00 130.39 3hm7 s PRO 318 Ca 0.33 -0.28 -0.06 0.00 0.04 0.00 0.00 61.00 61.03 3hm7 s PRO 318 Cb 0.08 -2.24 0.02 0.00 0.04 0.00 0.00 34.50 32.40 3hm7 s PRO 318 CO -0.12 -1.06 0.58 -1.54 0.04 0.00 0.00 177.00 174.91 3hm7 s SER 319 N -4.46 0.72 0.21 6.66 1.04 -1.26 -4.93 113.70 111.66 3hm7 s SER 319 Ca 0.58 -1.42 -0.30 0.00 0.48 0.00 0.00 55.95 55.29 3hm7 s SER 319 Cb -0.11 0.74 -0.09 0.00 0.10 0.00 0.00 66.02 66.66 3hm7 s SER 319 CO 0.44 -1.45 1.30 -0.76 0.98 0.00 0.00 173.24 173.75 3hm7 s LEU 320 N -3.20 4.42 0.55 2.42 1.43 -1.26 -4.92 118.68 118.12 3hm7 s LEU 320 Ca 0.26 2.41 0.32 0.00 -1.03 0.00 0.00 54.13 56.09 3hm7 s LEU 320 Cb -0.02 -3.61 1.48 0.00 0.03 0.00 0.00 46.19 44.07 3hm7 s LEU 320 CO 0.18 -0.52 1.85 -0.65 0.23 0.00 0.00 176.35 177.45 3hm7 h PRO 321 N 5.23 0.00 0.00 1.29 0.11 -1.98 0.24 132.00 136.89 3hm7 h PRO 321 Ca -0.45 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.60 3hm7 h PRO 321 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 3hm7 h PRO 321 CO 0.76 0.00 -0.29 -0.56 -0.21 0.00 0.00 178.00 177.70 3hm7 h GLN 322 N 0.00 0.00 0.00 1.05 3.07 -1.92 -2.93 115.11 114.38 3hm7 h GLN 322 Ca 0.43 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 59.13 3hm7 h GLN 322 Cb 1.80 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 29.36 3hm7 h GLN 322 CO -0.00 0.29 -0.15 0.52 0.09 0.00 0.00 178.83 179.57 3hm7 h MET 323 N 0.00 0.00 0.00 0.06 2.86 -0.89 -2.94 114.93 114.03 3hm7 h MET 323 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3hm7 h MET 323 Cb 0.58 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.24 3hm7 h MET 323 CO 0.04 0.15 -0.10 1.17 1.06 0.00 0.00 176.91 179.23 3hm7 n LYS 324 N -3.25 0.13 -3.83 1.72 3.00 -1.11 -2.88 118.16 111.94 3hm7 n LYS 324 Ca 0.01 0.09 -0.37 0.00 -0.00 0.00 0.00 58.31 58.05 3hm7 n LYS 324 Cb 0.44 -1.64 -0.06 0.00 0.00 0.00 0.00 35.03 33.77 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 -3.05 5.47 0.00 3.15 2.01 -1.11 -4.83 115.64 117.27 3hm7 s THR 325 Ca 0.12 0.24 0.00 0.00 0.31 0.00 0.00 61.69 62.36 3hm7 s THR 325 Cb 0.16 -3.43 0.00 0.00 0.01 0.00 0.00 72.50 69.24 3hm7 s THR 325 CO 0.59 0.58 0.00 0.61 -0.69 0.00 0.00 174.62 175.71 3hm7 n GLY 326 N 2.30 2.49 0.14 4.40 0.00 -1.26 -4.86 105.19 108.40 3hm7 n GLY 326 Ca -0.19 -0.86 -0.05 0.00 0.00 0.00 0.00 46.02 44.92 3hm7 n GLY 326 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hm7 h LYS 327 N 0.00 -0.33 0.00 1.61 1.57 -1.98 -3.49 116.57 113.95 3hm7 h LYS 327 Ca 0.00 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3hm7 h LYS 327 Cb 0.00 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.38 3hm7 h LYS 327 CO 0.00 -0.22 0.00 0.25 -0.57 0.00 0.00 179.45 178.91 3hm7 n THR 328 N -3.28 0.00 0.21 -0.16 -2.24 -1.26 -5.01 114.28 102.54 3hm7 n THR 328 Ca -0.04 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.84 3hm7 n THR 328 Cb 0.13 0.00 0.65 0.00 -2.10 0.00 0.00 70.33 69.01 3hm7 n THR 328 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 3hm7 h ILE 329 N 0.80 0.95 0.00 2.28 6.09 -1.92 -1.81 117.51 123.90 3hm7 h ILE 329 Ca 0.00 -0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 3hm7 h ILE 329 Cb 0.00 0.95 0.00 0.00 0.47 0.00 0.00 36.82 38.24 3hm7 h ILE 329 CO 0.00 0.00 -0.10 0.49 -3.07 0.00 0.00 178.15 175.47 3hm7 n PHE 330 N -4.51 0.45 -0.02 2.19 3.72 -1.26 -3.77 117.46 114.26 3hm7 n PHE 330 Ca -0.01 0.13 -0.13 0.00 -0.05 0.00 0.00 57.45 57.39 3hm7 n PHE 330 Cb 0.18 -0.68 -0.14 0.00 -0.94 0.00 0.00 39.48 37.90 3hm7 n PHE 330 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 3hm7 n GLU 331 N -1.88 0.68 -1.99 -1.08 4.07 -0.69 -4.93 120.64 114.82 3hm7 n GLU 331 Ca 0.06 0.26 -0.42 0.00 -0.06 0.00 0.00 57.16 57.01 3hm7 n GLU 331 Cb 0.39 -1.74 -0.03 0.00 -0.06 0.00 0.00 31.44 30.00 3hm7 n GLU 331 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 3hm7 s VAL 332 N -2.58 2.71 -0.28 6.31 1.01 -1.15 -4.87 120.40 121.54 3hm7 s VAL 332 Ca -0.12 0.54 -0.29 0.00 0.00 0.00 0.00 61.98 62.12 3hm7 s VAL 332 Cb 0.07 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.09 3hm7 s VAL 332 CO 0.80 0.06 1.68 0.86 0.00 0.00 0.00 175.10 178.50 3hm7 s TRP 333 N 0.74 1.99 0.36 5.22 -0.00 -1.14 -4.98 118.94 121.13 3hm7 s TRP 333 Ca 0.66 0.58 -0.16 0.00 -0.00 0.00 0.00 56.10 57.18 3hm7 s TRP 333 Cb -0.42 -4.08 -0.09 0.00 -0.00 0.00 0.00 33.47 28.87 3hm7 s TRP 333 CO 0.35 -2.88 0.79 0.20 -0.00 0.00 0.00 176.95 175.41 3hm7 s GLY 334 N 5.02 2.32 0.00 5.86 0.00 -1.26 -4.73 107.32 114.53 3hm7 s GLY 334 Ca 0.74 0.11 0.00 0.00 0.00 0.00 0.00 44.72 45.57 3hm7 s GLY 334 CO 0.32 0.33 0.00 0.61 0.00 0.00 0.00 173.10 174.36 3hm7 n GLY 335 N -0.51 4.47 3.44 0.20 0.00 0.34 -4.83 105.19 108.30 3hm7 n GLY 335 Ca 0.04 -0.96 -0.33 0.00 0.00 0.00 0.00 46.02 44.77 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 -1.77 3.35 -0.50 -0.61 1.01 -1.21 -4.77 121.20 116.71 3hm7 s ILE 336 Ca 0.00 -0.57 -0.21 0.00 0.00 0.00 0.00 60.65 59.87 3hm7 s ILE 336 Cb 0.00 -2.41 0.04 0.00 0.01 0.00 0.00 42.46 40.10 3hm7 s ILE 336 CO 0.00 0.53 0.74 0.00 0.00 0.00 0.00 174.94 176.21 3hm7 s ALA 337 N 0.06 3.30 0.00 9.38 0.00 -1.26 -0.43 121.76 132.81 3hm7 s ALA 337 Ca -0.03 -1.40 0.00 0.00 0.00 0.00 0.00 51.96 50.53 3hm7 s ALA 337 Cb -0.14 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.51 3hm7 s ALA 337 CO 0.04 -2.06 0.00 0.41 0.00 0.00 0.00 175.76 174.15 3hm7 n GLY 338 N 5.11 1.00 0.31 0.00 0.00 -1.26 -4.62 105.19 105.72 3hm7 n GLY 338 Ca -0.02 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.19 3hm7 n GLY 338 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hm7 h GLN 340 N 0.00 0.00 -0.04 0.00 4.15 -1.93 -3.36 115.11 113.94 3hm7 h GLN 340 Ca -0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3hm7 h GLN 340 Cb 0.16 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.85 3hm7 h GLN 340 CO 0.00 0.15 0.00 0.09 -1.93 0.00 0.00 178.83 177.15 3hm7 n ASN 341 N -3.21 1.92 0.13 -0.69 5.03 0.70 -3.98 115.26 115.16 3hm7 n ASN 341 Ca 0.02 -1.47 -0.14 0.00 0.87 0.00 0.00 54.58 53.87 3hm7 n ASN 341 Cb 0.48 -0.02 -0.06 0.00 -1.02 0.00 0.00 39.78 39.16 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 1.94 0.29 -1.00 3.41 2.02 -1.62 -0.52 112.91 117.43 3hm7 h THR 342 Ca 0.00 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.25 3hm7 h THR 342 Cb 0.44 0.29 -0.07 0.00 -1.74 0.00 0.00 68.15 67.07 3hm7 h THR 342 CO 0.00 0.00 0.64 0.25 0.37 0.00 0.00 175.52 176.78 3hm7 h LEU 343 N -0.58 1.02 0.19 2.58 5.85 -1.85 -2.45 115.31 120.07 3hm7 h LEU 343 Ca 0.02 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 3hm7 h LEU 343 Cb 0.60 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.43 3hm7 h LEU 343 CO -0.18 0.63 -0.09 0.00 -0.34 0.00 0.00 178.44 178.46 3hm7 h ALA 344 N 1.47 -0.26 -0.55 1.25 0.00 -1.61 -1.40 119.26 118.17 3hm7 h ALA 344 Ca 0.44 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.22 3hm7 h ALA 344 Cb 0.22 0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 3hm7 h ALA 344 CO -0.19 -0.64 0.06 -0.24 0.00 0.00 0.00 179.25 178.25 3hm7 h VAL 345 N -0.27 1.24 -0.92 0.00 3.04 -1.09 -1.88 116.25 116.37 3hm7 h VAL 345 Ca -0.03 -0.97 -0.01 0.00 -1.01 0.00 0.00 66.70 64.69 3hm7 h VAL 345 Cb 0.21 0.76 -0.04 0.00 -2.01 0.00 0.00 31.29 30.20 3hm7 h VAL 345 CO 0.04 0.35 0.53 0.24 -1.01 0.00 0.00 177.57 177.72 3hm7 h MET 346 N 0.84 1.27 -0.13 4.17 2.07 -1.28 0.14 114.93 122.01 3hm7 h MET 346 Ca 0.17 -0.13 -0.20 0.00 -2.07 0.00 0.00 59.70 57.46 3hm7 h MET 346 Cb 0.41 -0.26 0.00 0.00 -1.87 0.00 0.00 31.60 29.88 3hm7 h MET 346 CO 0.01 0.91 -0.73 -0.07 1.07 0.00 0.00 176.91 178.10 3hm7 h LEU 347 N 1.29 0.74 0.12 1.22 4.07 -1.14 0.36 115.31 121.96 3hm7 h LEU 347 Ca 0.33 -0.47 -0.01 0.00 0.08 0.00 0.00 57.88 57.81 3hm7 h LEU 347 Cb -0.01 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.52 3hm7 h LEU 347 CO -0.06 1.24 -0.06 0.74 -1.08 0.00 0.00 178.44 179.23 3hm7 h THR 348 N 0.43 0.83 0.04 0.22 2.02 -1.12 -2.46 112.91 112.88 3hm7 h THR 348 Ca -0.04 -1.28 -0.27 0.00 0.77 0.00 0.00 66.41 65.59 3hm7 h THR 348 Cb 1.33 1.45 -0.03 0.00 -1.74 0.00 0.00 68.15 69.17 3hm7 h THR 348 CO 0.14 0.24 -1.41 -0.33 0.37 0.00 0.00 175.52 174.53 3hm7 h GLU 349 N -0.92 0.09 0.00 6.66 4.39 -0.84 -2.68 114.58 121.29 3hm7 h GLU 349 Ca -0.02 -0.15 -0.03 0.00 0.34 0.00 0.00 59.36 59.50 3hm7 h GLU 349 Cb 0.51 0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.22 3hm7 h GLU 349 CO 0.03 0.89 -0.46 0.78 -1.16 0.00 0.00 179.01 179.09 3hm7 h GLY 350 N 2.68 0.00 0.40 -3.84 0.00 -1.04 -1.92 103.07 99.34 3hm7 h GLY 350 Ca -0.18 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.14 3hm7 h GLY 350 CO 0.12 0.00 -0.12 -1.82 0.00 0.00 0.00 176.54 174.72 3hm7 h TYR 351 N -1.00 -0.32 -0.02 5.60 5.03 -1.40 0.30 116.97 125.17 3hm7 h TYR 351 Ca -0.04 -0.01 -0.07 0.00 2.58 0.00 0.00 58.73 61.18 3hm7 h TYR 351 Cb 0.51 0.11 0.01 0.00 1.55 0.00 0.00 36.73 38.90 3hm7 h TYR 351 CO -0.10 0.02 -0.28 0.45 -1.32 0.00 0.00 178.16 176.93 3hm7 h HIS 352 N -0.95 0.31 0.11 -3.82 3.86 -1.53 -2.96 115.15 110.16 3hm7 h HIS 352 Ca -0.04 -0.16 -0.20 0.00 -1.16 0.00 0.00 60.37 58.82 3hm7 h HIS 352 Cb 0.48 -0.04 0.01 0.00 1.06 0.00 0.00 27.41 28.92 3hm7 h HIS 352 CO 0.05 0.94 -0.95 -0.22 0.86 0.00 0.00 177.93 178.61 3hm7 h LYS 353 N -0.40 0.22 -0.20 2.45 3.64 -1.56 -3.38 116.57 117.34 3hm7 h LYS 353 Ca -0.03 -0.38 0.00 0.00 -1.27 0.00 0.00 60.65 58.97 3hm7 h LYS 353 Cb 1.00 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 3hm7 h LYS 353 CO 0.06 1.18 0.00 0.54 -2.27 0.00 0.00 179.45 178.96 3hm7 n ARG 354 N -4.14 1.78 -3.38 1.90 1.74 -0.72 -5.00 116.66 108.84 3hm7 n ARG 354 Ca -0.18 -1.73 -0.24 0.00 -0.77 0.00 0.00 57.85 54.92 3hm7 n ARG 354 Cb 0.80 -1.32 0.03 0.00 -1.02 0.00 0.00 32.46 30.95 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 0.85 -5.29 -2.41 5.56 4.01 -0.12 -4.94 118.16 115.83 3hm7 n LYS 355 Ca 0.11 0.74 -0.38 0.00 -0.51 0.00 0.00 58.31 58.27 3hm7 n LYS 355 Cb 0.42 -5.61 -0.03 0.00 -0.51 0.00 0.00 35.03 29.29 3hm7 n LYS 355 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3hm7 s MET 356 N -6.07 4.27 0.53 1.97 0.23 0.87 -4.95 119.30 116.15 3hm7 s MET 356 Ca 0.45 1.76 -0.19 0.00 -1.03 0.00 0.00 55.69 56.68 3hm7 s MET 356 Cb -0.21 -2.81 -0.07 0.00 -1.53 0.00 0.00 34.83 30.21 3hm7 s MET 356 CO 0.56 -0.11 1.07 -2.14 -2.03 0.00 0.00 175.02 172.37 3hm7 s PRO 357 N -2.08 3.55 0.47 3.16 0.02 -1.26 -4.20 135.00 134.66 3hm7 s PRO 357 Ca 0.53 1.43 0.20 0.00 0.02 0.00 0.00 61.00 63.18 3hm7 s PRO 357 Cb -0.29 -2.05 1.16 0.00 0.02 0.00 0.00 34.50 33.34 3hm7 s PRO 357 CO 0.37 -0.65 2.00 -0.07 -0.33 0.00 0.00 177.00 178.32 3hm7 h LEU 358 N 1.24 0.00 -1.27 -5.54 3.38 -1.95 -2.35 115.31 108.81 3hm7 h LEU 358 Ca -0.49 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.47 3hm7 h LEU 358 Cb 1.24 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.95 3hm7 h LEU 358 CO 0.58 0.18 0.40 0.71 0.09 0.00 0.00 178.44 180.40 3hm7 h THR 359 N 0.00 1.19 0.00 0.22 1.35 -1.87 -1.74 112.91 112.06 3hm7 h THR 359 Ca -0.00 -0.41 -0.14 0.00 -0.55 0.00 0.00 66.41 65.30 3hm7 h THR 359 Cb 0.38 0.24 -0.02 0.00 -1.73 0.00 0.00 68.15 67.02 3hm7 h THR 359 CO 0.02 0.19 -0.69 -0.61 -0.25 0.00 0.00 175.52 174.19 3hm7 h GLN 360 N 0.92 0.00 -0.46 4.72 4.15 -1.66 -1.81 115.11 120.97 3hm7 h GLN 360 Ca 0.24 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.61 3hm7 h GLN 360 Cb -0.04 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.63 3hm7 h GLN 360 CO -0.05 0.69 0.07 0.82 -1.93 0.00 0.00 178.83 178.44 3hm7 h ILE 361 N 0.00 1.25 -0.37 2.39 2.04 -1.24 0.05 117.51 121.63 3hm7 h ILE 361 Ca -0.01 -0.91 0.01 0.00 1.00 0.00 0.00 64.86 64.95 3hm7 h ILE 361 Cb 1.36 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 38.37 3hm7 h ILE 361 CO 0.09 0.32 0.23 0.58 0.00 0.00 0.00 178.15 179.37 3hm7 h VAL 362 N 0.63 1.06 -0.49 1.67 2.07 -1.30 -0.78 116.25 119.11 3hm7 h VAL 362 Ca 0.14 -0.16 0.02 0.00 0.82 0.00 0.00 66.70 67.52 3hm7 h VAL 362 Cb 0.39 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 3hm7 h VAL 362 CO 0.01 0.08 0.29 -0.61 0.02 0.00 0.00 177.57 177.37 3hm7 h GLN 363 N 0.46 0.57 0.05 1.57 4.15 -1.09 -0.06 115.11 120.76 3hm7 h GLN 363 Ca 0.14 -0.03 -0.24 0.00 0.77 0.00 0.00 58.65 59.29 3hm7 h GLN 363 Cb -0.01 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.53 3hm7 h GLN 363 CO -0.06 0.38 -1.11 -0.07 -1.93 0.00 0.00 178.83 176.04 3hm7 h LEU 364 N 0.59 0.16 -0.85 -2.39 3.38 -0.87 -0.03 115.31 115.29 3hm7 h LEU 364 Ca 0.19 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.99 3hm7 h LEU 364 Cb 0.01 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3hm7 h LEU 364 CO -0.08 1.14 -0.32 0.18 0.09 0.00 0.00 178.44 179.45 3hm7 n LEU 365 N -3.41 1.55 0.13 1.67 4.32 -0.31 -0.30 117.00 120.65 3hm7 n LEU 365 Ca -0.04 -0.76 0.00 0.00 -0.02 0.00 0.00 56.01 55.19 3hm7 n LEU 365 Cb 0.97 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.77 3hm7 n LEU 365 CO 0.49 0.30 0.00 -0.24 -1.22 0.00 0.00 177.39 176.72 3hm7 n SER 366 N -0.16 -0.08 0.05 -1.43 2.88 -0.26 -0.69 113.62 113.93 3hm7 n SER 366 Ca 0.06 0.45 -0.11 0.00 -1.33 0.00 0.00 58.87 57.95 3hm7 n SER 366 Cb 0.32 0.35 -0.08 0.00 -0.75 0.00 0.00 64.21 64.05 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 0.89 -0.81 2.46 2.02 -1.06 -2.55 112.91 113.87 3hm7 h THR 367 Ca 0.00 -1.13 -0.04 0.00 0.77 0.00 0.00 66.41 66.01 3hm7 h THR 367 Cb 0.00 1.49 -0.04 0.00 -1.74 0.00 0.00 68.15 67.86 3hm7 h THR 367 CO 0.00 0.23 0.37 -0.33 0.37 0.00 0.00 175.52 176.15 3hm7 h GLU 368 N -0.84 1.17 -0.94 6.66 4.39 -1.24 -0.44 114.58 123.35 3hm7 h GLU 368 Ca -0.02 -0.18 0.17 0.00 0.34 0.00 0.00 59.36 59.67 3hm7 h GLU 368 Cb 0.53 -0.21 -0.08 0.00 -0.10 0.00 0.00 28.75 28.89 3hm7 h GLU 368 CO 0.03 0.92 0.60 -1.35 -1.16 0.00 0.00 179.01 178.05 3hm7 h PRO 369 N 1.16 0.64 -0.00 2.33 0.11 -1.76 -1.04 132.00 133.44 3hm7 h PRO 369 Ca 0.27 -0.04 -0.22 0.00 0.11 0.00 0.00 66.00 66.13 3hm7 h PRO 369 Cb 0.15 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 3hm7 h PRO 369 CO -0.03 0.42 -0.91 0.00 -0.21 0.00 0.00 178.00 177.27 3hm7 h ALA 370 N 1.61 0.42 -0.19 -0.75 0.00 -0.92 -3.22 119.26 116.21 3hm7 h ALA 370 Ca 0.50 -0.70 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 3hm7 h ALA 370 Cb 0.89 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 3hm7 h ALA 370 CO -0.26 0.83 -0.23 0.87 0.00 0.00 0.00 179.25 180.47 3hm7 h LYS 371 N 0.21 0.49 0.00 0.00 1.57 -0.84 0.39 116.57 118.39 3hm7 h LYS 371 Ca -0.07 -0.27 -0.04 0.00 -1.87 0.00 0.00 60.65 58.40 3hm7 h LYS 371 Cb 1.54 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.86 3hm7 h LYS 371 CO 0.15 0.86 -0.18 -0.09 -0.57 0.00 0.00 179.45 179.62 3hm7 h ARG 372 N 0.15 0.00 -0.17 3.15 9.65 -1.28 -2.75 114.38 123.12 3hm7 h ARG 372 Ca 0.03 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.91 3hm7 h ARG 372 Cb 0.78 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.36 3hm7 h ARG 372 CO 0.05 0.18 0.00 1.19 2.80 0.00 0.00 179.97 184.19 3hm7 n PHE 373 N -3.74 0.52 -2.04 2.20 3.72 -1.21 -4.99 117.46 111.92 3hm7 n PHE 373 Ca -0.02 -0.82 -0.07 0.00 -0.05 0.00 0.00 57.45 56.50 3hm7 n PHE 373 Cb 0.29 -0.20 -0.01 0.00 -0.94 0.00 0.00 39.48 38.62 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 -0.62 0.17 0.89 1.37 0.00 -1.04 -4.94 105.19 101.02 3hm7 n GLY 374 Ca 0.16 -0.62 0.08 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.93 3.87 -4.49 0.99 4.77 0.13 -4.99 117.00 116.35 3hm7 n LEU 375 Ca -0.08 -3.07 -0.33 0.00 -0.03 0.00 0.00 56.01 52.50 3hm7 n LEU 375 Cb 0.53 -0.55 -0.13 0.00 -2.33 0.00 0.00 43.42 40.94 3hm7 n LEU 375 CO 0.09 0.71 -0.44 -0.47 -1.33 0.00 0.00 177.39 175.95 3hm7 s TYR 376 N -2.86 2.75 -2.04 -1.77 6.14 -1.12 -0.09 117.35 118.35 3hm7 s TYR 376 Ca 0.42 -0.13 0.13 0.00 0.64 0.00 0.00 57.07 58.13 3hm7 s TYR 376 Cb 0.34 -1.65 0.40 0.00 0.42 0.00 0.00 41.96 41.47 3hm7 s TYR 376 CO 0.08 0.21 1.32 -0.35 0.64 0.00 0.00 175.55 177.45 3hm7 n PRO 377 N 2.32 1.89 -0.12 4.97 -0.04 -1.26 -4.94 135.00 137.82 3hm7 n PRO 377 Ca -0.17 -1.38 -0.04 0.00 -0.04 0.00 0.00 63.50 61.86 3hm7 n PRO 377 Cb 0.52 -1.32 0.02 0.00 -0.04 0.00 0.00 33.50 32.69 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 2.31 0.04 -6.11 0.54 4.15 -1.93 -3.40 115.11 110.72 3hm7 h GLN 378 Ca 0.00 -0.00 -0.52 0.00 0.77 0.00 0.00 58.65 58.89 3hm7 h GLN 378 Cb 0.53 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 28.15 3hm7 h GLN 378 CO 0.00 0.03 -0.47 0.15 -1.93 0.00 0.00 178.83 176.61 3hm7 s LYS 379 N -6.20 2.47 0.00 1.69 1.02 0.87 -1.86 119.74 117.73 3hm7 s LYS 379 Ca -0.14 -1.54 0.00 0.00 0.02 0.00 0.00 55.97 54.32 3hm7 s LYS 379 Cb 0.14 -2.26 0.00 0.00 -0.52 0.00 0.00 37.83 35.19 3hm7 s LYS 379 CO 0.71 -0.01 0.00 0.41 -0.92 0.00 0.00 175.35 175.54 3hm7 n GLY 380 N -1.32 0.88 3.21 -3.33 0.00 -1.26 -4.51 105.19 98.87 3hm7 n GLY 380 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.51 1.09 -0.54 2.61 -4.23 -1.26 -4.34 115.64 105.46 3hm7 s THR 381 Ca 0.00 -1.82 -0.01 0.00 -1.18 0.00 0.00 61.69 58.68 3hm7 s THR 381 Cb 0.00 -1.58 0.14 0.00 1.34 0.00 0.00 72.50 72.40 3hm7 s THR 381 CO 0.00 -0.61 0.33 -0.63 -0.54 0.00 0.00 174.62 173.17 3hm7 s ILE 382 N -2.75 3.36 0.09 2.99 1.01 -1.26 -4.84 121.20 119.79 3hm7 s ILE 382 Ca 0.10 -2.76 -0.16 0.00 0.00 0.00 0.00 60.65 57.84 3hm7 s ILE 382 Cb -0.01 -3.25 0.03 0.00 0.01 0.00 0.00 42.46 39.25 3hm7 s ILE 382 CO 0.01 -0.80 0.39 0.00 0.00 0.00 0.00 174.94 174.53 3hm7 s GLN 383 N 0.26 1.00 0.13 2.79 -2.07 -1.26 -5.07 119.66 115.43 3hm7 s GLN 383 Ca 0.14 -0.60 -0.33 0.00 -1.82 0.00 0.00 55.36 52.76 3hm7 s GLN 383 Cb -0.22 0.44 -0.13 0.00 -1.09 0.00 0.00 33.01 32.02 3hm7 s GLN 383 CO -0.03 -0.37 1.70 0.28 -1.32 0.00 0.00 175.29 175.55 3hm7 n VAL 384 N 0.06 0.15 0.00 3.63 0.31 -1.26 -2.50 118.33 118.71 3hm7 n VAL 384 Ca -0.17 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.13 3hm7 n VAL 384 Cb 0.62 -1.80 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 3hm7 n VAL 384 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3hm7 n GLY 385 N 3.83 3.15 3.85 2.92 0.00 -0.12 -4.98 105.19 113.83 3hm7 n GLY 385 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 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 -2.73 2.98 0.24 4.61 0.00 -1.04 -4.60 121.76 121.21 3hm7 s ALA 386 Ca 0.00 0.03 -0.31 0.00 0.00 0.00 0.00 51.96 51.67 3hm7 s ALA 386 Cb 0.00 -3.12 -0.13 0.00 0.00 0.00 0.00 23.12 19.87 3hm7 s ALA 386 CO 0.00 -0.74 1.43 -1.91 0.00 0.00 0.00 175.76 174.53 3hm7 n GLU 387 N -2.60 2.07 -1.65 0.00 2.13 -0.77 -0.68 120.64 119.14 3hm7 n GLU 387 Ca 0.07 0.74 -0.40 0.00 0.66 0.00 0.00 57.16 58.23 3hm7 n GLU 387 Cb 0.54 -2.41 -0.02 0.00 0.27 0.00 0.00 31.44 29.82 3hm7 n GLU 387 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3hm7 n ALA 388 N 2.00 6.92 -3.71 4.31 0.00 0.89 -4.68 120.51 126.24 3hm7 n ALA 388 Ca 0.12 -3.81 -0.34 0.00 0.00 0.00 0.00 53.44 49.41 3hm7 n ALA 388 Cb 0.32 -3.18 -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 1.64 4.78 0.30 0.00 0.01 -1.26 -2.05 113.70 117.11 3hm7 s SER 389 Ca 0.60 -1.26 -0.08 0.00 1.31 0.00 0.00 55.95 56.52 3hm7 s SER 389 Cb 0.17 -1.68 0.00 0.00 0.21 0.00 0.00 66.02 64.72 3hm7 s SER 389 CO -0.07 -0.24 0.48 0.72 0.41 0.00 0.00 173.24 174.55 3hm7 s PHE 390 N 1.24 0.68 -0.07 2.43 -0.71 -0.26 -0.58 117.98 120.71 3hm7 s PHE 390 Ca -0.05 -1.01 -0.05 0.00 -1.04 0.00 0.00 56.93 54.77 3hm7 s PHE 390 Cb -0.20 0.09 0.02 0.00 -1.21 0.00 0.00 43.02 41.73 3hm7 s PHE 390 CO -0.02 -1.08 0.18 -0.08 -1.34 0.00 0.00 175.22 172.87 3hm7 s THR 391 N -3.47 -0.01 -0.23 -4.49 -1.32 -0.43 -0.26 115.64 105.43 3hm7 s THR 391 Ca 0.26 0.04 -0.09 0.00 -1.21 0.00 0.00 61.69 60.69 3hm7 s THR 391 Cb -0.01 -0.26 -0.04 0.00 -1.51 0.00 0.00 72.50 70.68 3hm7 s THR 391 CO 0.14 0.02 0.13 -0.76 -2.21 0.00 0.00 174.62 171.94 3hm7 s LEU 392 N 0.39 3.92 -0.10 9.08 1.43 -0.52 -1.52 118.68 131.37 3hm7 s LEU 392 Ca -0.02 0.03 0.02 0.00 -1.03 0.00 0.00 54.13 53.13 3hm7 s LEU 392 Cb -0.04 -2.05 0.01 0.00 0.03 0.00 0.00 46.19 44.15 3hm7 s LEU 392 CO -0.02 0.06 -0.17 -0.63 0.23 0.00 0.00 176.35 175.82 3hm7 s ILE 393 N 1.10 1.60 -0.45 -0.59 1.09 -0.02 -0.37 121.20 123.56 3hm7 s ILE 393 Ca 0.06 -0.72 -0.27 0.00 -1.10 0.00 0.00 60.65 58.62 3hm7 s ILE 393 Cb -0.14 -1.43 0.03 0.00 -1.06 0.00 0.00 42.46 39.86 3hm7 s ILE 393 CO 0.04 0.46 1.03 -0.62 -0.10 0.00 0.00 174.94 175.75 3hm7 s ASP 394 N 0.75 6.61 0.17 3.58 2.15 -0.77 -0.30 116.67 128.85 3hm7 s ASP 394 Ca -0.11 0.38 0.23 0.00 0.43 0.00 0.00 52.55 53.48 3hm7 s ASP 394 Cb -0.16 -2.50 0.90 0.00 -0.30 0.00 0.00 42.92 40.86 3hm7 s ASP 394 CO 0.02 -1.10 1.71 0.18 -0.17 0.00 0.00 175.17 175.81 3hm7 n LEU 395 N 7.39 0.50 -0.35 -1.34 4.77 -1.26 -1.56 117.00 125.15 3hm7 n LEU 395 Ca 0.09 0.59 0.04 0.00 -0.03 0.00 0.00 56.01 56.70 3hm7 n LEU 395 Cb 0.49 -0.48 0.06 0.00 -2.33 0.00 0.00 43.42 41.16 3hm7 n LEU 395 CO 0.66 -0.33 0.46 0.59 -1.33 0.00 0.00 177.39 177.45 3hm7 n ASN 396 N -2.02 2.04 -4.64 -1.43 3.02 -1.26 -3.50 115.26 107.47 3hm7 n ASN 396 Ca 0.04 -1.60 -0.43 0.00 -0.03 0.00 0.00 54.58 52.56 3hm7 n ASN 396 Cb 0.29 -0.06 -0.02 0.00 -0.61 0.00 0.00 39.78 39.37 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 -0.78 4.08 0.28 3.52 2.12 -1.17 -4.68 118.70 122.06 3hm7 s GLU 397 Ca 0.12 1.08 -0.23 0.00 0.36 0.00 0.00 54.97 56.30 3hm7 s GLU 397 Cb 0.07 -3.73 -0.09 0.00 0.26 0.00 0.00 34.13 30.64 3hm7 s GLU 397 CO 0.10 -0.87 0.83 -1.12 -0.54 0.00 0.00 175.26 173.66 3hm7 s SER 398 N 1.61 7.18 -0.28 -1.70 0.01 -1.26 -0.58 113.70 118.69 3hm7 s SER 398 Ca 0.45 1.62 -0.23 0.00 1.31 0.00 0.00 55.95 59.10 3hm7 s SER 398 Cb -0.12 -2.50 0.09 0.00 0.21 0.00 0.00 66.02 63.70 3hm7 s SER 398 CO 0.14 -0.03 0.84 -0.72 0.41 0.00 0.00 173.24 173.89 3hm7 s TYR 399 N -1.59 -0.71 -0.09 2.43 1.13 -0.82 -4.99 117.35 112.71 3hm7 s TYR 399 Ca 0.47 1.64 -0.26 0.00 -1.41 0.00 0.00 57.07 57.50 3hm7 s TYR 399 Cb -0.17 0.36 -0.02 0.00 -1.10 0.00 0.00 41.96 41.02 3hm7 s TYR 399 CO 0.22 -0.34 0.86 0.99 -2.51 0.00 0.00 175.55 174.76 3hm7 s THR 400 N 0.58 4.91 -0.11 -3.49 2.01 -1.26 -0.39 115.64 117.89 3hm7 s THR 400 Ca -0.01 1.74 -0.30 0.00 0.31 0.00 0.00 61.69 63.44 3hm7 s THR 400 Cb -0.05 -4.18 -0.01 0.00 0.01 0.00 0.00 72.50 68.27 3hm7 s THR 400 CO -0.06 0.12 1.01 -0.22 -0.69 0.00 0.00 174.62 174.78 3hm7 s LEU 401 N 1.50 4.24 0.26 4.42 2.96 -0.42 -4.96 118.68 126.68 3hm7 s LEU 401 Ca 0.43 1.53 0.09 0.00 -0.22 0.00 0.00 54.13 55.96 3hm7 s LEU 401 Cb -0.18 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 42.90 3hm7 s LEU 401 CO 0.18 -0.46 -0.15 0.54 -1.32 0.00 0.00 176.35 175.14 3hm7 s ASN 402 N 1.11 3.11 0.55 3.68 4.22 -1.26 -0.04 114.94 126.30 3hm7 s ASN 402 Ca 0.48 -1.07 0.26 0.00 -2.14 0.00 0.00 52.86 50.40 3hm7 s ASN 402 Cb -0.18 -0.23 1.44 0.00 1.28 0.00 0.00 41.25 43.57 3hm7 s ASN 402 CO 0.17 -0.12 1.99 0.00 -2.04 0.00 0.00 177.10 177.11 3hm7 h ALA 403 N 2.35 2.39 0.00 3.54 0.00 -1.97 -0.89 119.26 124.69 3hm7 h ALA 403 Ca -0.39 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.49 3hm7 h ALA 403 Cb 1.24 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 3hm7 h ALA 403 CO 0.63 -0.64 -0.03 0.77 0.00 0.00 0.00 179.25 179.98 3hm7 h SER 404 N 0.00 0.00 0.76 0.00 0.02 -1.97 -2.49 113.55 109.87 3hm7 h SER 404 Ca 0.24 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.08 3hm7 h SER 404 Cb 1.01 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.53 3hm7 h SER 404 CO -0.00 0.03 -0.51 0.44 -1.14 0.00 0.00 176.83 175.64 3hm7 h ASP 405 N 0.00 0.00 -3.43 3.07 3.32 -1.58 -3.46 116.42 114.34 3hm7 h ASP 405 Ca -0.00 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.53 3hm7 h ASP 405 Cb 0.06 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.62 3hm7 h ASP 405 CO 0.00 0.51 0.55 -0.76 -1.72 0.00 0.00 179.24 177.83 3hm7 s LEU 406 N -7.30 4.44 0.00 1.55 1.43 -0.94 -4.94 118.68 112.92 3hm7 s LEU 406 Ca -0.00 2.17 0.23 0.00 -1.03 0.00 0.00 54.13 55.50 3hm7 s LEU 406 Cb 0.12 -3.60 0.43 0.00 0.03 0.00 0.00 46.19 43.17 3hm7 s LEU 406 CO 0.73 -0.37 1.41 -1.22 0.23 0.00 0.00 176.35 177.13 3hm7 n TYR 407 N 2.78 0.46 -1.90 0.29 4.02 -1.26 -4.85 117.16 116.70 3hm7 n TYR 407 Ca 0.05 -0.23 -0.39 0.00 -0.01 0.00 0.00 57.90 57.32 3hm7 n TYR 407 Cb 0.45 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.79 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 -1.54 2.52 0.37 -0.72 2.02 -1.26 -4.50 117.35 114.24 3hm7 s TYR 408 Ca 0.38 1.36 0.13 0.00 -0.37 0.00 0.00 57.07 58.58 3hm7 s TYR 408 Cb 0.23 -3.77 0.96 0.00 -0.40 0.00 0.00 41.96 38.98 3hm7 s TYR 408 CO 0.32 -2.59 1.80 -0.09 -1.57 0.00 0.00 175.55 173.42 3hm7 h ARG 409 N 2.07 0.52 -4.83 -0.62 2.43 -1.83 -3.29 114.38 108.84 3hm7 h ARG 409 Ca -0.50 -0.03 -0.67 0.00 -0.81 0.00 0.00 59.98 57.96 3hm7 h ARG 409 Cb 1.27 -0.12 -0.36 0.00 -0.42 0.00 0.00 29.97 30.35 3hm7 h ARG 409 CO 0.60 0.34 -0.76 -1.01 -1.51 0.00 0.00 179.97 177.63 3hm7 s HIS 410 N -5.61 3.28 -1.19 2.20 3.76 -1.26 -5.05 115.29 111.42 3hm7 s HIS 410 Ca -0.09 -2.19 -0.17 0.00 -0.15 0.00 0.00 55.06 52.46 3hm7 s HIS 410 Cb 0.24 -2.01 -0.04 0.00 1.11 0.00 0.00 32.58 31.88 3hm7 s HIS 410 CO 0.79 -0.86 2.09 -0.35 -0.85 0.00 0.00 174.74 175.57 3hm7 n PRO 411 N 4.49 2.33 -4.05 8.40 -0.04 -1.24 -4.85 135.00 140.04 3hm7 n PRO 411 Ca -0.13 -2.34 -0.17 0.00 -0.04 0.00 0.00 63.50 60.82 3hm7 n PRO 411 Cb 0.42 -3.17 -0.15 0.00 -0.04 0.00 0.00 33.50 30.56 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 4.10 0.31 -0.14 0.52 -4.36 -1.26 -4.78 121.20 115.59 3hm7 s ILE 412 Ca 0.52 -0.06 -0.27 0.00 -0.26 0.00 0.00 60.65 60.57 3hm7 s ILE 412 Cb 0.13 -0.33 0.07 0.00 1.25 0.00 0.00 42.46 43.58 3hm7 s ILE 412 CO 0.00 0.14 0.67 -0.55 0.24 0.00 0.00 174.94 175.44 3hm7 s SER 413 N 0.55 -0.67 0.61 4.36 0.15 -1.26 -4.71 113.70 112.73 3hm7 s SER 413 Ca -0.06 0.99 0.41 0.00 0.70 0.00 0.00 55.95 57.99 3hm7 s SER 413 Cb -0.09 0.91 2.14 0.00 -1.71 0.00 0.00 66.02 67.28 3hm7 s SER 413 CO -0.01 -0.45 2.24 1.55 1.20 0.00 0.00 173.24 177.78 3hm7 h PRO 414 N 3.91 0.00 -0.00 5.44 0.13 -1.82 -2.57 132.00 137.09 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 0.25 0.00 -0.07 0.66 -0.23 0.00 0.00 178.00 178.61 3hm7 n TYR 415 N -2.99 0.00 -2.21 1.56 4.01 -1.26 -4.82 117.16 111.45 3hm7 n TYR 415 Ca -0.02 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.29 3hm7 n TYR 415 Cb 0.10 -0.21 -0.02 0.00 -0.31 0.00 0.00 39.34 38.90 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 -2.48 3.89 0.00 -0.72 1.01 -0.97 -2.31 120.40 118.82 3hm7 s VAL 416 Ca 0.30 1.06 0.00 0.00 0.00 0.00 0.00 61.98 63.34 3hm7 s VAL 416 Cb 0.20 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.83 3hm7 s VAL 416 CO 0.46 -0.17 0.00 0.61 0.00 0.00 0.00 175.10 176.00 3hm7 n GLY 417 N 4.09 0.89 3.83 4.51 0.00 0.94 -5.01 105.19 114.44 3hm7 n GLY 417 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.93 3.97 -0.36 1.61 2.00 -0.98 -4.87 119.66 120.10 3hm7 s GLN 418 Ca 0.00 0.45 -0.17 0.00 -2.00 0.00 0.00 55.36 53.64 3hm7 s GLN 418 Cb 0.00 -3.23 -0.00 0.00 0.80 0.00 0.00 33.01 30.58 3hm7 s GLN 418 CO 0.00 0.67 0.45 0.50 -0.50 0.00 0.00 175.29 176.41 3hm7 s ARG 419 N -1.02 3.49 0.36 1.67 3.52 -1.26 -1.30 118.95 124.41 3hm7 s ARG 419 Ca 0.24 -0.37 0.07 0.00 -0.13 0.00 0.00 55.73 55.55 3hm7 s ARG 419 Cb -0.17 -3.84 -0.01 0.00 -1.56 0.00 0.00 34.95 29.37 3hm7 s ARG 419 CO 0.14 -0.65 0.47 -0.06 -0.81 0.00 0.00 175.30 174.39 3hm7 s PHE 420 N 2.23 3.00 -0.09 5.12 2.99 0.48 -4.96 117.98 126.74 3hm7 s PHE 420 Ca 0.15 -0.28 -0.04 0.00 0.00 0.00 0.00 56.93 56.76 3hm7 s PHE 420 Cb -0.16 -2.07 0.05 0.00 0.00 0.00 0.00 43.02 40.83 3hm7 s PHE 420 CO 0.13 -0.09 0.19 0.50 -0.00 0.00 0.00 175.22 175.94 3hm7 s ARG 421 N -4.19 0.09 0.00 0.44 3.52 -1.26 -1.95 118.95 115.60 3hm7 s ARG 421 Ca 0.47 0.55 0.00 0.00 -0.13 0.00 0.00 55.73 56.62 3hm7 s ARG 421 Cb -0.09 -0.19 0.00 0.00 -1.56 0.00 0.00 34.95 33.11 3hm7 s ARG 421 CO 0.31 -0.25 0.00 0.41 -0.81 0.00 0.00 175.30 174.96 3hm7 n GLY 422 N 4.92 1.08 3.21 8.12 0.00 0.26 -4.01 105.19 118.77 3hm7 n GLY 422 Ca -0.13 -0.85 -0.31 0.00 0.00 0.00 0.00 46.02 44.73 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 -0.77 2.65 -0.02 1.61 2.20 -0.60 -4.78 119.74 120.03 3hm7 s LYS 423 Ca 0.00 -0.83 -0.30 0.00 -0.36 0.00 0.00 55.97 54.48 3hm7 s LYS 423 Cb 0.00 -2.11 -0.04 0.00 -1.51 0.00 0.00 37.83 34.16 3hm7 s LYS 423 CO 0.00 0.25 1.26 0.54 -0.36 0.00 0.00 175.35 177.04 3hm7 s VAL 424 N 0.15 4.04 -0.11 4.02 0.11 -1.26 -1.84 120.40 125.51 3hm7 s VAL 424 Ca -0.12 1.40 0.12 0.00 -2.93 0.00 0.00 61.98 60.46 3hm7 s VAL 424 Cb -0.16 -3.90 -0.17 0.00 -1.53 0.00 0.00 36.38 30.62 3hm7 s VAL 424 CO 0.06 0.01 0.09 0.29 -3.33 0.00 0.00 175.10 172.22 3hm7 n LYS 425 N 5.07 1.64 -3.90 1.54 4.76 0.50 -4.67 118.16 123.10 3hm7 n LYS 425 Ca 0.11 -0.03 -0.10 0.00 -2.87 0.00 0.00 58.31 55.42 3hm7 n LYS 425 Cb 0.45 -1.33 -0.10 0.00 -1.84 0.00 0.00 35.03 32.21 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 -2.42 0.10 -0.08 2.13 3.76 -1.14 -0.23 115.29 117.41 3hm7 s HIS 426 Ca -0.06 -0.27 -0.03 0.00 -0.15 0.00 0.00 55.06 54.54 3hm7 s HIS 426 Cb 0.05 -0.09 0.04 0.00 1.11 0.00 0.00 32.58 33.70 3hm7 s HIS 426 CO 0.54 -0.30 0.16 0.99 -0.85 0.00 0.00 174.74 175.28 3hm7 s THR 427 N -1.74 -0.18 -0.18 1.30 2.01 -0.38 -1.43 115.64 115.03 3hm7 s THR 427 Ca -0.12 0.28 -0.01 0.00 0.31 0.00 0.00 61.69 62.15 3hm7 s THR 427 Cb -0.06 -0.28 -0.00 0.00 0.01 0.00 0.00 72.50 72.16 3hm7 s THR 427 CO -0.00 0.12 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.30 3hm7 s ILE 428 N 1.86 2.89 -0.24 1.82 1.09 0.65 -1.47 121.20 127.80 3hm7 s ILE 428 Ca -0.02 -0.68 0.02 0.00 -1.10 0.00 0.00 60.65 58.87 3hm7 s ILE 428 Cb -0.12 -2.25 0.04 0.00 -1.06 0.00 0.00 42.46 39.07 3hm7 s ILE 428 CO -0.06 0.49 -0.13 0.00 -0.10 0.00 0.00 174.94 175.14 3hm7 n GLN 430 N 4.52 -5.19 0.00 0.00 6.02 -1.09 -1.84 117.38 119.80 3hm7 n GLN 430 Ca -0.16 0.79 0.00 0.00 -0.01 0.00 0.00 57.00 57.62 3hm7 n GLN 430 Cb 0.45 -5.66 0.00 0.00 1.02 0.00 0.00 30.24 26.05 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 -1.56 2.96 3.70 1.08 0.00 -0.87 -4.13 105.19 106.37 3hm7 n GLY 431 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.11 4.44 -0.53 1.61 2.20 -0.76 -4.93 119.74 121.65 3hm7 s LYS 432 Ca 0.00 1.57 -0.28 0.00 -0.36 0.00 0.00 55.97 56.90 3hm7 s LYS 432 Cb 0.00 -3.48 0.00 0.00 -1.51 0.00 0.00 37.83 32.84 3hm7 s LYS 432 CO 0.00 -0.27 1.56 -1.58 -0.36 0.00 0.00 175.35 174.70 3hm7 s HIS 433 N 1.60 2.09 -0.10 4.03 5.65 -1.26 -1.16 115.29 126.14 3hm7 s HIS 433 Ca 0.54 0.56 0.15 0.00 0.25 0.00 0.00 55.06 56.55 3hm7 s HIS 433 Cb -0.23 -4.29 -0.21 0.00 -1.18 0.00 0.00 32.58 26.66 3hm7 s HIS 433 CO 0.24 -2.19 0.18 0.28 -0.65 0.00 0.00 174.74 172.60 3hm7 n VAL 434 N 7.01 0.61 -3.74 0.89 0.31 -0.54 -4.96 118.33 117.91 3hm7 n VAL 434 Ca 0.16 -0.53 -0.13 0.00 -0.01 0.00 0.00 64.34 63.82 3hm7 n VAL 434 Cb 0.49 -0.30 -0.10 0.00 -0.91 0.00 0.00 33.84 33.02 3hm7 n VAL 434 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 3hm7 s TYR 435 N -2.68 -0.42 0.00 3.52 5.04 -0.88 -4.97 117.35 116.96 3hm7 s TYR 435 Ca -0.07 1.03 0.01 0.00 -2.44 0.00 0.00 57.07 55.60 3hm7 s TYR 435 Cb 0.07 0.14 -0.01 0.00 0.35 0.00 0.00 41.96 42.52 3hm7 s TYR 435 CO 0.64 -0.21 -0.04 -1.14 -1.34 0.00 0.00 175.55 173.46 3hm7 s GLN 436 N 0.18 0.35 0.32 4.97 0.74 -1.26 -1.25 119.66 123.70 3hm7 s GLN 436 Ca -0.00 -0.20 -0.29 0.00 0.05 0.00 0.00 55.36 54.91 3hm7 s GLN 436 Cb -0.03 -0.31 -0.10 0.00 1.10 0.00 0.00 33.01 33.67 3hm7 s GLN 436 CO 0.01 0.08 1.31 0.34 -0.55 0.00 0.00 175.29 176.47 3hm7 s ASP 437 N -0.24 6.79 0.00 6.67 -1.08 0.68 -4.97 116.67 124.52 3hm7 s ASP 437 Ca 0.00 2.66 0.00 0.00 -0.52 0.00 0.00 52.55 54.69 3hm7 s ASP 437 Cb -0.02 -2.64 0.00 0.00 -1.46 0.00 0.00 42.92 38.79 3hm7 s ASP 437 CO -0.00 -0.53 0.00 1.41 0.52 0.00 0.00 175.17 176.57