#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s7r s PRO 2 N 0.00 2.87 0.22 1.61 0.04 -1.26 -3.73 135.00 134.74 1s7r s PRO 2 Ca 0.00 0.06 0.00 0.00 0.04 0.00 0.00 61.00 61.10 1s7r s PRO 2 Cb 0.00 -2.22 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 1s7r s PRO 2 CO 0.00 -0.79 0.16 -1.01 0.04 0.00 0.00 177.00 175.40 1s7r s HIS 3 N -3.07 1.24 -0.13 0.56 3.76 -0.31 -4.97 115.29 112.37 1s7r s HIS 3 Ca 0.55 -1.42 -0.24 0.00 -0.15 0.00 0.00 55.06 53.80 1s7r s HIS 3 Cb -0.11 -0.57 0.06 0.00 1.11 0.00 0.00 32.58 33.07 1s7r s HIS 3 CO 0.46 -0.68 0.60 -1.54 -0.85 0.00 0.00 174.74 172.74 1s7r s SER 4 N -3.19 -0.59 -0.17 1.40 1.04 -1.26 -0.05 113.70 110.88 1s7r s SER 4 Ca 0.39 0.90 -0.13 0.00 0.48 0.00 0.00 55.95 57.59 1s7r s SER 4 Cb 0.06 0.87 -0.05 0.00 0.10 0.00 0.00 66.02 67.00 1s7r s SER 4 CO 0.14 -0.40 0.25 -0.22 0.98 0.00 0.00 173.24 174.00 1s7r s LEU 5 N -0.47 4.24 -0.09 2.42 2.96 -0.56 -2.25 118.68 124.93 1s7r s LEU 5 Ca -0.06 0.44 -0.01 0.00 -0.22 0.00 0.00 54.13 54.28 1s7r s LEU 5 Cb -0.03 -2.30 0.03 0.00 0.50 0.00 0.00 46.19 44.39 1s7r s LEU 5 CO 0.05 0.13 -0.01 -0.13 -1.32 0.00 0.00 176.35 175.07 1s7r s ARG 6 N 0.37 0.78 -0.20 1.98 0.52 0.23 -2.07 118.95 120.56 1s7r s ARG 6 Ca 0.14 -0.01 -0.11 0.00 -0.52 0.00 0.00 55.73 55.23 1s7r s ARG 6 Cb -0.12 -1.21 -0.05 0.00 0.52 0.00 0.00 34.95 34.09 1s7r s ARG 6 CO 0.03 -0.33 0.16 0.71 0.02 0.00 0.00 175.30 175.88 1s7r s TYR 7 N 1.91 3.40 -0.39 -0.53 2.02 0.14 0.12 117.35 124.02 1s7r s TYR 7 Ca 0.04 0.35 -0.04 0.00 -0.37 0.00 0.00 57.07 57.06 1s7r s TYR 7 Cb -0.13 -2.21 0.09 0.00 -0.40 0.00 0.00 41.96 39.31 1s7r s TYR 7 CO -0.06 0.24 0.17 -0.06 -1.57 0.00 0.00 175.55 174.27 1s7r s PHE 8 N 0.52 3.49 -0.07 2.71 0.08 0.36 -2.02 117.98 123.05 1s7r s PHE 8 Ca 0.09 -2.17 0.03 0.00 0.12 0.00 0.00 56.93 55.01 1s7r s PHE 8 Cb -0.12 -2.97 -0.02 0.00 -0.57 0.00 0.00 43.02 39.34 1s7r s PHE 8 CO 0.00 -0.92 -0.16 0.54 -0.10 0.00 0.00 175.22 174.58 1s7r s VAL 9 N 1.21 2.87 -0.01 -0.44 0.11 -0.51 -0.66 120.40 122.96 1s7r s VAL 9 Ca 0.05 -0.78 0.06 0.00 -2.93 0.00 0.00 61.98 58.38 1s7r s VAL 9 Cb -0.22 -2.13 -0.01 0.00 -1.53 0.00 0.00 36.38 32.49 1s7r s VAL 9 CO -0.03 0.57 -0.19 -0.89 -3.33 0.00 0.00 175.10 171.24 1s7r s THR 10 N -0.41 1.47 0.08 5.04 2.01 -0.18 -1.37 115.64 122.29 1s7r s THR 10 Ca 0.04 -0.81 0.07 0.00 0.31 0.00 0.00 61.69 61.30 1s7r s THR 10 Cb -0.12 -1.23 -0.03 0.00 0.01 0.00 0.00 72.50 71.13 1s7r s THR 10 CO 0.02 0.40 -0.19 0.00 -0.69 0.00 0.00 174.62 174.17 1s7r s ALA 11 N -0.45 1.60 -0.30 7.40 0.00 -0.26 -1.59 121.76 128.16 1s7r s ALA 11 Ca 0.07 -1.11 -0.01 0.00 0.00 0.00 0.00 51.96 50.91 1s7r s ALA 11 Cb -0.07 -0.23 0.19 0.00 0.00 0.00 0.00 23.12 23.01 1s7r s ALA 11 CO -0.01 0.31 0.65 0.54 0.00 0.00 0.00 175.76 177.26 1s7r s VAL 12 N -1.07 -0.92 0.53 0.00 0.11 -0.69 -1.48 120.40 116.88 1s7r s VAL 12 Ca 0.04 0.00 -0.22 0.00 -2.93 0.00 0.00 61.98 58.87 1s7r s VAL 12 Cb -0.09 -0.98 -0.05 0.00 -1.53 0.00 0.00 36.38 33.72 1s7r s VAL 12 CO 0.03 0.00 1.35 -1.54 -3.33 0.00 0.00 175.10 171.61 1s7r n SER 13 N 5.43 2.70 -3.39 3.54 3.41 -0.76 -1.66 113.62 122.89 1s7r n SER 13 Ca -0.00 1.00 -0.26 0.00 -0.26 0.00 0.00 58.87 59.34 1s7r n SER 13 Cb 0.52 -1.57 -0.09 0.00 -0.26 0.00 0.00 64.21 62.81 1s7r n SER 13 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1s7r n ARG 14 N -0.87 0.76 -1.51 4.33 1.85 -1.26 -4.22 116.66 115.74 1s7r n ARG 14 Ca 0.10 -3.48 -0.46 0.00 -1.00 0.00 0.00 57.85 53.01 1s7r n ARG 14 Cb 0.44 -1.65 -0.02 0.00 -1.05 0.00 0.00 32.46 30.18 1s7r n ARG 14 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 1s7r n PRO 15 N 2.09 0.76 0.00 2.89 -0.02 -1.26 -1.01 135.00 138.45 1s7r n PRO 15 Ca 0.26 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 1s7r n PRO 15 Cb 0.47 -1.47 0.00 0.00 -0.02 0.00 0.00 33.50 32.48 1s7r n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s7r n GLY 16 N 1.56 2.85 0.08 -1.23 0.00 -1.26 -4.78 105.19 102.42 1s7r n GLY 16 Ca 0.13 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.25 1s7r n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s7r n LEU 17 N 0.00 2.28 0.00 0.99 4.77 -0.18 -5.11 117.00 119.76 1s7r n LEU 17 Ca 0.00 -3.03 0.00 0.00 -0.03 0.00 0.00 56.01 52.95 1s7r n LEU 17 Cb 0.00 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 1s7r n LEU 17 CO 0.00 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 1s7r n GLY 18 N -1.40 -1.82 3.70 -0.72 0.00 -1.23 -4.96 105.19 98.76 1s7r n GLY 18 Ca 0.16 -1.93 -0.37 0.00 0.00 0.00 0.00 46.02 43.88 1s7r n GLY 18 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1s7r n GLU 19 N 0.00 1.03 -0.72 1.61 -0.58 -1.26 -4.50 120.64 116.22 1s7r n GLU 19 Ca 0.00 0.41 -0.32 0.00 -0.42 0.00 0.00 57.16 56.83 1s7r n GLU 19 Cb 0.00 -2.46 0.15 0.00 -0.57 0.00 0.00 31.44 28.57 1s7r n GLU 19 CO 0.00 0.00 0.00 -2.30 -0.48 0.00 0.00 177.13 174.35 1s7r n PRO 20 N -1.78 -0.87 -2.90 3.49 -0.02 -1.26 -4.74 135.00 126.91 1s7r n PRO 20 Ca 0.15 -0.22 -0.42 0.00 -2.02 0.00 0.00 63.50 61.00 1s7r n PRO 20 Cb 0.48 -1.90 -0.04 0.00 -0.02 0.00 0.00 33.50 32.01 1s7r n PRO 20 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1s7r s ARG 21 N -3.77 4.19 -0.14 -0.52 6.06 -0.66 -4.91 118.95 119.19 1s7r s ARG 21 Ca 0.59 0.93 0.02 0.00 -2.50 0.00 0.00 55.73 54.77 1s7r s ARG 21 Cb -0.19 -3.64 0.01 0.00 0.06 0.00 0.00 34.95 31.19 1s7r s ARG 21 CO 0.66 -0.50 -0.20 -0.47 -2.50 0.00 0.00 175.30 172.29 1s7r s TYR 22 N 2.77 2.52 0.13 5.12 5.04 -1.26 -1.71 117.35 129.96 1s7r s TYR 22 Ca 0.35 -1.32 0.07 0.00 -2.44 0.00 0.00 57.07 53.73 1s7r s TYR 22 Cb -0.15 -1.75 -0.04 0.00 0.35 0.00 0.00 41.96 40.37 1s7r s TYR 22 CO 0.08 -0.63 -0.15 1.41 -1.34 0.00 0.00 175.55 174.92 1s7r s MET 23 N 0.98 1.08 -0.04 4.97 -2.45 -0.62 -1.18 119.30 122.05 1s7r s MET 23 Ca -0.04 -1.27 -0.01 0.00 -1.25 0.00 0.00 55.69 53.11 1s7r s MET 23 Cb -0.15 -1.02 0.03 0.00 1.25 0.00 0.00 34.83 34.94 1s7r s MET 23 CO -0.04 0.20 0.06 -1.21 1.05 0.00 0.00 175.02 175.08 1s7r s GLU 24 N -2.66 -0.05 -0.02 4.11 2.02 -0.35 -1.01 118.70 120.76 1s7r s GLU 24 Ca 0.10 0.33 0.06 0.00 0.02 0.00 0.00 54.97 55.48 1s7r s GLU 24 Cb -0.05 -0.38 -0.02 0.00 0.10 0.00 0.00 34.13 33.78 1s7r s GLU 24 CO 0.04 -0.26 -0.21 0.08 0.02 0.00 0.00 175.26 174.93 1s7r s VAL 25 N 1.73 1.64 -0.03 2.63 1.01 0.17 -0.35 120.40 127.19 1s7r s VAL 25 Ca -0.01 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.14 1s7r s VAL 25 Cb -0.12 -1.36 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 1s7r s VAL 25 CO -0.03 0.46 -0.23 -0.83 0.00 0.00 0.00 175.10 174.47 1s7r s GLY 26 N -0.50 1.14 -0.07 4.51 0.00 0.81 0.14 107.32 113.36 1s7r s GLY 26 Ca 0.08 -0.97 0.01 0.00 0.00 0.00 0.00 44.72 43.84 1s7r s GLY 26 CO -0.01 -0.72 -0.09 -0.19 0.00 0.00 0.00 173.10 172.10 1s7r s TYR 27 N -0.37 1.27 -0.42 1.90 1.51 0.32 -1.40 117.35 120.15 1s7r s TYR 27 Ca 0.04 -0.49 -0.12 0.00 -1.01 0.00 0.00 57.07 55.49 1s7r s TYR 27 Cb -0.10 -1.00 0.06 0.00 -0.11 0.00 0.00 41.96 40.81 1s7r s TYR 27 CO 0.01 -0.31 0.29 0.08 -1.11 0.00 0.00 175.55 174.50 1s7r s VAL 28 N 1.01 4.64 -0.58 0.71 1.01 -1.03 0.75 120.40 126.92 1s7r s VAL 28 Ca -0.09 -1.15 -0.16 0.00 0.00 0.00 0.00 61.98 60.58 1s7r s VAL 28 Cb -0.15 -3.76 0.02 0.00 0.00 0.00 0.00 36.38 32.50 1s7r s VAL 28 CO -0.00 -0.46 0.64 0.47 0.00 0.00 0.00 175.10 175.75 1s7r n ASP 29 N 5.03 -6.67 0.00 3.32 8.00 -0.95 -2.63 116.55 122.65 1s7r n ASP 29 Ca -0.11 -0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.31 1s7r n ASP 29 Cb 0.44 -3.66 0.00 0.00 -0.02 0.00 0.00 41.12 37.88 1s7r n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1s7r n ASP 30 N -1.05 -3.72 -4.06 -2.24 8.00 -1.26 -4.87 116.55 107.35 1s7r n ASP 30 Ca -0.05 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.13 1s7r n ASP 30 Cb 0.58 -2.88 -0.15 0.00 -0.02 0.00 0.00 41.12 38.65 1s7r n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1s7r s THR 31 N -1.16 2.28 0.06 -3.53 2.01 -1.08 -4.98 115.64 109.24 1s7r s THR 31 Ca 0.00 -1.87 -0.31 0.00 0.31 0.00 0.00 61.69 59.82 1s7r s THR 31 Cb 0.00 -2.46 -0.10 0.00 0.01 0.00 0.00 72.50 69.94 1s7r s THR 31 CO 0.00 -0.24 1.90 1.21 -0.69 0.00 0.00 174.62 176.80 1s7r n GLU 32 N 4.39 2.74 0.00 4.92 2.13 -1.26 -2.46 120.64 131.10 1s7r n GLU 32 Ca -0.08 1.00 0.00 0.00 0.66 0.00 0.00 57.16 58.74 1s7r n GLU 32 Cb 0.42 -2.92 0.00 0.00 0.27 0.00 0.00 31.44 29.21 1s7r n GLU 32 CO 0.00 0.00 0.00 1.97 -0.41 0.00 0.00 177.13 178.69 1s7r n PHE 33 N 6.54 0.00 -3.92 4.31 -1.74 -0.49 -4.45 117.46 117.71 1s7r n PHE 33 Ca 0.19 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.99 1s7r n PHE 33 Cb 0.38 0.00 -0.10 0.00 1.52 0.00 0.00 39.48 41.28 1s7r n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1s7r s VAL 34 N -1.89 0.12 -0.07 1.97 -7.23 -0.98 -1.20 120.40 111.11 1s7r s VAL 34 Ca 0.00 -0.98 -0.15 0.00 -1.81 0.00 0.00 61.98 59.04 1s7r s VAL 34 Cb 0.00 -0.74 0.03 0.00 0.56 0.00 0.00 36.38 36.23 1s7r s VAL 34 CO 0.00 -0.54 0.36 -0.60 -0.31 0.00 0.00 175.10 174.01 1s7r s ARG 35 N -2.23 0.59 0.01 4.82 3.52 -1.17 -0.13 118.95 124.35 1s7r s ARG 35 Ca -0.08 0.15 -0.01 0.00 -0.13 0.00 0.00 55.73 55.66 1s7r s ARG 35 Cb -0.03 0.27 -0.01 0.00 -1.56 0.00 0.00 34.95 33.62 1s7r s ARG 35 CO -0.03 -0.13 0.01 0.12 -0.81 0.00 0.00 175.30 174.46 1s7r s PHE 36 N -0.64 0.11 -0.29 5.12 5.36 0.52 -1.99 117.98 126.17 1s7r s PHE 36 Ca -0.07 -0.23 0.03 0.00 -0.96 0.00 0.00 56.93 55.70 1s7r s PHE 36 Cb -0.04 -0.09 0.18 0.00 -0.34 0.00 0.00 43.02 42.74 1s7r s PHE 36 CO 0.03 -0.11 0.54 0.34 -1.46 0.00 0.00 175.22 174.56 1s7r s ASP 37 N -0.77 -1.03 0.00 6.13 -1.08 -1.26 -1.21 116.67 117.46 1s7r s ASP 37 Ca -0.08 0.28 0.02 0.00 -0.52 0.00 0.00 52.55 52.25 1s7r s ASP 37 Cb -0.05 1.82 0.14 0.00 -1.46 0.00 0.00 42.92 43.37 1s7r s ASP 37 CO -0.00 -0.30 0.70 -1.54 0.52 0.00 0.00 175.17 174.55 1s7r n SER 38 N 5.41 0.00 -1.04 -0.34 3.41 -0.32 -0.54 113.62 120.19 1s7r n SER 38 Ca 0.02 0.01 0.12 0.00 -0.26 0.00 0.00 58.87 58.76 1s7r n SER 38 Cb 0.52 -0.08 0.14 0.00 -0.26 0.00 0.00 64.21 64.54 1s7r n SER 38 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1s7r n ASP 39 N -1.08 3.18 -4.46 4.04 9.92 -1.26 -4.89 116.55 122.01 1s7r n ASP 39 Ca 0.02 -2.00 -0.29 0.00 -0.53 0.00 0.00 54.79 51.99 1s7r n ASP 39 Cb 0.01 -0.09 0.21 0.00 -0.64 0.00 0.00 41.12 40.61 1s7r n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1s7r s ALA 40 N -1.81 0.42 0.08 2.24 0.00 0.29 -4.94 121.76 118.04 1s7r s ALA 40 Ca 0.32 -0.44 -0.30 0.00 0.00 0.00 0.00 51.96 51.54 1s7r s ALA 40 Cb 0.21 -3.10 -0.18 0.00 0.00 0.00 0.00 23.12 20.05 1s7r s ALA 40 CO 0.31 -3.32 1.66 0.93 0.00 0.00 0.00 175.76 175.34 1s7r h GLU 41 N -2.27 -0.60 -3.14 0.00 5.08 -1.94 -3.38 114.58 108.33 1s7r h GLU 41 Ca -0.55 0.04 -0.62 0.00 -1.00 0.00 0.00 59.36 57.23 1s7r h GLU 41 Cb 1.33 0.14 -0.41 0.00 0.50 0.00 0.00 28.75 30.31 1s7r h GLU 41 CO 0.52 -0.40 -0.68 1.21 -1.00 0.00 0.00 179.01 178.66 1s7r s ASN 42 N -4.65 4.02 -0.31 1.42 3.04 -1.26 -5.08 114.94 112.14 1s7r s ASN 42 Ca -0.16 -3.03 -0.28 0.00 0.04 0.00 0.00 52.86 49.44 1s7r s ASN 42 Cb 0.04 -1.36 -0.05 0.00 -1.54 0.00 0.00 41.25 38.34 1s7r s ASN 42 CO 0.63 -0.21 2.19 -2.16 -3.04 0.00 0.00 177.10 174.51 1s7r s PRO 43 N -0.25 2.91 -0.19 0.43 0.04 -1.26 -4.92 135.00 131.76 1s7r s PRO 43 Ca 0.19 1.76 -0.13 0.00 0.04 0.00 0.00 61.00 62.86 1s7r s PRO 43 Cb -0.20 -4.40 0.06 0.00 0.04 0.00 0.00 34.50 30.00 1s7r s PRO 43 CO -0.04 -2.36 0.48 -0.98 0.04 0.00 0.00 177.00 174.15 1s7r s ARG 44 N 6.71 0.51 0.01 4.56 1.70 -1.26 -5.01 118.95 126.16 1s7r s ARG 44 Ca 0.96 0.81 -0.37 0.00 -0.47 0.00 0.00 55.73 56.65 1s7r s ARG 44 Cb -0.27 0.12 -0.16 0.00 -0.57 0.00 0.00 34.95 34.06 1s7r s ARG 44 CO 0.32 -0.12 1.44 0.66 -1.08 0.00 0.00 175.30 176.52 1s7r n TYR 45 N 3.68 1.65 -4.24 5.89 4.02 -1.26 -4.82 117.16 122.08 1s7r n TYR 45 Ca -0.19 0.61 -0.21 0.00 -0.01 0.00 0.00 57.90 58.10 1s7r n TYR 45 Cb 0.56 -2.36 -0.12 0.00 -0.02 0.00 0.00 39.34 37.39 1s7r n TYR 45 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 176.86 174.02 1s7r s GLU 46 N 1.18 0.95 0.44 -0.72 -1.05 -0.84 -4.91 118.70 113.75 1s7r s GLU 46 Ca 0.87 -1.00 -0.23 0.00 -0.15 0.00 0.00 54.97 54.46 1s7r s GLU 46 Cb -0.97 -1.04 -0.08 0.00 -0.44 0.00 0.00 34.13 31.59 1s7r s GLU 46 CO 0.51 0.24 1.10 -1.25 0.95 0.00 0.00 175.26 176.81 1s7r s PRO 47 N -1.72 3.94 -0.11 -4.83 0.04 -1.26 -3.04 135.00 128.01 1s7r s PRO 47 Ca 0.01 1.60 0.14 0.00 0.04 0.00 0.00 61.00 62.80 1s7r s PRO 47 Cb -0.10 -2.42 0.31 0.00 0.04 0.00 0.00 34.50 32.33 1s7r s PRO 47 CO 0.03 -0.36 1.15 0.54 0.04 0.00 0.00 177.00 178.40 1s7r n ARG 48 N -0.37 0.95 -3.64 4.56 5.12 -0.34 -4.91 116.66 118.01 1s7r n ARG 48 Ca 0.07 -2.47 -0.04 0.00 -1.93 0.00 0.00 57.85 53.47 1s7r n ARG 48 Cb 0.49 -1.11 -0.07 0.00 -1.16 0.00 0.00 32.46 30.62 1s7r n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1s7r s ALA 49 N -2.01 -2.21 0.25 7.54 0.00 -1.26 -4.44 121.76 119.63 1s7r s ALA 49 Ca 0.29 1.99 -0.03 0.00 0.00 0.00 0.00 51.96 54.21 1s7r s ALA 49 Cb 0.29 -1.67 0.43 0.00 0.00 0.00 0.00 23.12 22.17 1s7r s ALA 49 CO -0.05 -0.27 1.82 0.00 0.00 0.00 0.00 175.76 177.26 1s7r h ARG 50 N 4.88 0.82 0.00 0.00 3.08 -1.96 -0.86 114.38 120.35 1s7r h ARG 50 Ca -0.28 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.72 1s7r h ARG 50 Cb 1.18 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 31.05 1s7r h ARG 50 CO 0.17 0.54 0.00 0.11 -1.07 0.00 0.00 179.97 179.72 1s7r h TRP 51 N 0.84 0.00 0.00 3.04 5.08 -1.97 -1.31 115.95 121.63 1s7r h TRP 51 Ca 0.42 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.39 1s7r h TRP 51 Cb 0.38 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.54 1s7r h TRP 51 CO -0.05 0.00 -0.53 -1.33 -1.28 0.00 0.00 178.44 175.25 1s7r n MET 52 N -2.44 0.02 -0.27 0.12 2.81 -0.33 -3.69 117.12 113.34 1s7r n MET 52 Ca -0.01 0.00 -0.06 0.00 -1.81 0.00 0.00 57.70 55.82 1s7r n MET 52 Cb 0.07 -1.51 0.06 0.00 -0.71 0.00 0.00 33.22 31.12 1s7r n MET 52 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1s7r h GLU 53 N 0.00 1.11 -0.80 0.03 5.08 -1.25 -3.09 114.58 115.66 1s7r h GLU 53 Ca 0.00 -0.18 0.15 0.00 -1.00 0.00 0.00 59.36 58.33 1s7r h GLU 53 Cb 0.52 -0.19 -0.15 0.00 0.50 0.00 0.00 28.75 29.43 1s7r h GLU 53 CO 0.00 0.88 -0.22 1.04 -1.00 0.00 0.00 179.01 179.72 1s7r n GLN 54 N -4.36 -0.09 -1.58 2.33 6.02 -1.24 -4.45 117.38 114.01 1s7r n GLN 54 Ca 0.06 1.24 -0.45 0.00 -0.01 0.00 0.00 57.00 57.84 1s7r n GLN 54 Cb 0.16 -1.85 -0.02 0.00 1.02 0.00 0.00 30.24 29.55 1s7r n GLN 54 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1s7r n GLU 55 N -5.28 1.29 -1.56 -1.09 -0.58 -1.17 -4.96 120.64 107.28 1s7r n GLU 55 Ca 0.12 0.45 -0.24 0.00 -0.42 0.00 0.00 57.16 57.07 1s7r n GLU 55 Cb 0.39 -1.84 0.17 0.00 -0.57 0.00 0.00 31.44 29.58 1s7r n GLU 55 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1s7r n GLY 56 N 1.42 -1.41 0.22 0.62 0.00 -1.26 -4.95 105.19 99.82 1s7r n GLY 56 Ca 0.11 -1.71 -0.02 0.00 0.00 0.00 0.00 46.02 44.40 1s7r n GLY 56 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1s7r h PRO 57 N 0.00 0.40 -0.34 1.61 0.11 -1.94 -3.01 132.00 128.83 1s7r h PRO 57 Ca -0.35 -0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.81 1s7r h PRO 57 Cb 0.97 -0.09 -0.08 0.00 0.11 0.00 0.00 31.00 31.91 1s7r h PRO 57 CO 0.25 0.27 -0.23 1.49 -0.21 0.00 0.00 178.00 179.56 1s7r h GLU 58 N 0.42 -0.18 -0.08 1.05 4.81 -2.00 -2.60 114.58 115.98 1s7r h GLU 58 Ca 0.27 0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.54 1s7r h GLU 58 Cb 0.29 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.64 1s7r h GLU 58 CO -0.25 -0.12 -0.50 -0.92 -0.73 0.00 0.00 179.01 176.48 1s7r h TYR 59 N -0.19 -1.47 -0.07 0.92 5.03 -1.90 -1.79 116.97 117.50 1s7r h TYR 59 Ca 0.17 0.05 0.02 0.00 2.58 0.00 0.00 58.73 61.55 1s7r h TYR 59 Cb 0.46 0.66 -0.00 0.00 1.55 0.00 0.00 36.73 39.39 1s7r h TYR 59 CO -0.44 -0.54 0.09 -1.49 -1.32 0.00 0.00 178.16 174.47 1s7r h TRP 60 N -0.59 0.00 0.19 -3.82 4.06 -1.54 0.23 115.95 114.48 1s7r h TRP 60 Ca 0.04 0.00 -0.32 0.00 2.06 0.00 0.00 58.89 60.67 1s7r h TRP 60 Cb 0.68 0.00 0.02 0.00 -1.00 0.00 0.00 29.16 28.86 1s7r h TRP 60 CO -0.53 0.00 -1.51 1.49 -3.56 0.00 0.00 178.44 174.33 1s7r h GLU 61 N 0.00 0.40 -0.09 0.49 4.57 -1.08 -2.65 114.58 116.22 1s7r h GLU 61 Ca 0.03 -0.69 -0.01 0.00 -1.18 0.00 0.00 59.36 57.51 1s7r h GLU 61 Cb 0.22 0.26 -0.00 0.00 -0.16 0.00 0.00 28.75 29.06 1s7r h GLU 61 CO -0.00 1.31 0.01 0.00 -1.18 0.00 0.00 179.01 179.15 1s7r h ARG 62 N 0.11 0.16 -0.69 1.92 3.08 -0.32 -0.57 114.38 118.07 1s7r h ARG 62 Ca -0.25 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.74 1s7r h ARG 62 Cb 2.09 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 32.09 1s7r h ARG 62 CO 0.22 0.38 0.35 0.93 -1.07 0.00 0.00 179.97 180.78 1s7r h GLU 63 N -0.09 0.99 0.00 0.04 4.39 -1.36 -1.14 114.58 117.41 1s7r h GLU 63 Ca 0.03 -0.14 -0.02 0.00 0.34 0.00 0.00 59.36 59.58 1s7r h GLU 63 Cb 0.30 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.76 1s7r h GLU 63 CO 0.00 0.77 -0.07 1.15 -1.16 0.00 0.00 179.01 179.70 1s7r h THR 64 N 0.96 1.00 0.00 1.13 2.02 -1.28 -0.80 112.91 115.93 1s7r h THR 64 Ca 0.24 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 1s7r h THR 64 Cb 0.09 1.14 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1s7r h THR 64 CO -0.03 0.07 -0.18 1.56 0.37 0.00 0.00 175.52 177.31 1s7r h GLN 65 N 0.00 0.00 0.00 6.66 1.08 -0.58 -2.77 115.11 119.50 1s7r h GLN 65 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1s7r h GLN 65 Cb 0.13 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 1s7r h GLN 65 CO 0.01 0.11 0.21 1.57 -0.95 0.00 0.00 178.83 179.78 1s7r h LYS 66 N -1.00 0.00 0.10 1.46 2.10 -1.23 0.38 116.57 118.38 1s7r h LYS 66 Ca -0.01 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.63 1s7r h LYS 66 Cb 0.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.58 1s7r h LYS 66 CO -0.01 0.00 -0.05 0.00 -2.00 0.00 0.00 179.45 177.39 1s7r h ALA 67 N 1.55 -0.14 -0.44 0.07 0.00 -1.24 -2.34 119.26 116.72 1s7r h ALA 67 Ca 0.00 -0.25 0.02 0.00 0.00 0.00 0.00 54.91 54.68 1s7r h ALA 67 Cb 0.41 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1s7r h ALA 67 CO 0.00 -0.29 0.30 0.87 0.00 0.00 0.00 179.25 180.13 1s7r h LYS 68 N -0.71 0.50 -0.01 0.00 1.79 -0.11 0.32 116.57 118.35 1s7r h LYS 68 Ca -0.01 -0.03 -0.00 0.00 -2.18 0.00 0.00 60.65 58.42 1s7r h LYS 68 Cb 0.54 -0.11 -0.00 0.00 -1.58 0.00 0.00 32.23 31.08 1s7r h LYS 68 CO 0.02 0.33 -0.00 0.78 -1.08 0.00 0.00 179.45 179.50 1s7r h GLY 69 N 0.52 0.02 0.28 3.86 0.00 -0.65 -2.75 103.07 104.35 1s7r h GLY 69 Ca 0.17 -0.02 0.11 0.00 0.00 0.00 0.00 47.33 47.59 1s7r h GLY 69 CO -0.04 0.02 0.20 3.43 0.00 0.00 0.00 176.54 180.14 1s7r h ASN 70 N -0.39 0.15 -0.65 0.19 2.35 -1.06 -1.09 115.58 115.07 1s7r h ASN 70 Ca 0.00 0.09 0.12 0.00 -0.55 0.00 0.00 56.30 55.97 1s7r h ASN 70 Cb 0.42 0.10 -0.09 0.00 0.05 0.00 0.00 38.32 38.80 1s7r h ASN 70 CO 0.00 0.08 0.20 -0.08 -1.65 0.00 0.00 177.43 175.99 1s7r h GLU 71 N 0.35 0.34 -0.47 0.81 4.81 -0.93 -0.33 114.58 119.16 1s7r h GLU 71 Ca 0.32 -0.02 -0.11 0.00 -0.13 0.00 0.00 59.36 59.43 1s7r h GLU 71 Cb 0.44 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1s7r h GLU 71 CO -0.35 0.22 -0.14 1.96 -0.73 0.00 0.00 179.01 179.97 1s7r h GLN 72 N 0.35 0.88 -0.62 1.92 1.08 -1.08 -2.29 115.11 115.34 1s7r h GLN 72 Ca 0.35 -0.32 -0.05 0.00 -1.45 0.00 0.00 58.65 57.18 1s7r h GLN 72 Cb 0.51 -0.06 -0.03 0.00 -0.05 0.00 0.00 27.48 27.85 1s7r h GLN 72 CO -0.39 0.96 0.20 1.03 -0.95 0.00 0.00 178.83 179.69 1s7r h SER 73 N 0.78 0.87 1.24 1.46 0.87 0.06 -2.51 113.55 116.32 1s7r h SER 73 Ca 0.12 -0.14 -0.14 0.00 -1.23 0.00 0.00 61.79 60.40 1s7r h SER 73 Cb 0.66 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.37 1s7r h SER 73 CO 0.05 0.81 -0.66 -0.26 -0.53 0.00 0.00 176.83 176.24 1s7r h PHE 74 N 0.91 0.00 -0.33 2.24 0.04 -1.00 0.75 116.94 119.54 1s7r h PHE 74 Ca 0.21 0.00 0.06 0.00 2.80 0.00 0.00 57.97 61.04 1s7r h PHE 74 Cb 0.25 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.34 1s7r h PHE 74 CO 0.02 0.66 -0.05 0.00 -0.60 0.00 0.00 178.31 178.33 1s7r h ARG 75 N 0.00 0.03 -0.13 1.51 -0.00 -1.01 0.15 114.38 114.92 1s7r h ARG 75 Ca -0.01 -0.00 -0.02 0.00 -0.50 0.00 0.00 59.98 59.45 1s7r h ARG 75 Cb 1.45 -0.01 -0.00 0.00 0.00 0.00 0.00 29.97 31.41 1s7r h ARG 75 CO 0.09 0.02 -0.01 0.28 0.00 0.00 0.00 179.97 180.35 1s7r h VAL 76 N 0.03 1.26 -0.90 2.04 2.07 -1.14 -2.70 116.25 116.92 1s7r h VAL 76 Ca 0.16 -0.85 0.21 0.00 0.82 0.00 0.00 66.70 67.04 1s7r h VAL 76 Cb 0.24 1.56 -0.12 0.00 -1.52 0.00 0.00 31.29 31.45 1s7r h VAL 76 CO -0.32 0.25 0.42 0.44 0.02 0.00 0.00 177.57 178.38 1s7r h ASP 77 N -0.03 0.39 -0.47 0.57 3.32 -0.56 -1.25 116.42 118.38 1s7r h ASP 77 Ca 0.04 0.14 -0.09 0.00 0.02 0.00 0.00 57.03 57.14 1s7r h ASP 77 Cb 0.38 0.11 -0.02 0.00 0.22 0.00 0.00 39.33 40.03 1s7r h ASP 77 CO 0.01 0.03 -0.06 -0.07 -1.72 0.00 0.00 179.24 177.43 1s7r h LEU 78 N 0.44 0.87 -0.77 1.55 3.38 -0.38 -1.68 115.31 118.72 1s7r h LEU 78 Ca 0.56 -0.34 -0.10 0.00 0.09 0.00 0.00 57.88 58.09 1s7r h LEU 78 Cb 1.03 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.52 1s7r h LEU 78 CO -0.50 1.00 -0.12 -0.09 0.09 0.00 0.00 178.44 178.82 1s7r h ARG 79 N 0.72 0.81 0.12 1.13 2.43 -1.21 -2.92 114.38 115.46 1s7r h ARG 79 Ca 0.13 -0.28 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 1s7r h ARG 79 Cb 0.59 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1s7r h ARG 79 CO 0.04 0.89 -0.06 1.15 -1.51 0.00 0.00 179.97 180.48 1s7r h THR 80 N 0.73 0.95 0.00 0.20 2.02 -0.91 -2.49 112.91 113.41 1s7r h THR 80 Ca 0.12 -0.24 0.00 0.00 0.77 0.00 0.00 66.41 67.06 1s7r h THR 80 Cb 0.61 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 68.12 1s7r h THR 80 CO 0.04 0.06 0.00 -0.07 0.37 0.00 0.00 175.52 175.92 1s7r h LEU 81 N -0.27 0.00 -0.25 2.58 4.07 -1.32 0.50 115.31 120.63 1s7r h LEU 81 Ca -0.02 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.93 1s7r h LEU 81 Cb 0.22 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.95 1s7r h LEU 81 CO 0.03 0.00 0.12 -0.07 -1.08 0.00 0.00 178.44 177.43 1s7r h LEU 82 N 0.00 0.33 -0.25 1.67 3.38 -1.25 -1.58 115.31 117.60 1s7r h LEU 82 Ca 0.00 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 1s7r h LEU 82 Cb 0.29 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1s7r h LEU 82 CO 0.00 0.36 -0.21 1.23 0.09 0.00 0.00 178.44 179.91 1s7r h GLY 83 N 0.27 0.64 0.45 0.83 0.00 -0.72 0.25 103.07 104.79 1s7r h GLY 83 Ca 0.09 -0.63 0.03 0.00 0.00 0.00 0.00 47.33 46.81 1s7r h GLY 83 CO -0.01 0.57 -0.27 -0.97 0.00 0.00 0.00 176.54 175.86 1s7r h TYR 84 N 0.30 -0.71 -0.19 5.60 0.05 -1.12 -1.95 116.97 118.94 1s7r h TYR 84 Ca 0.05 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.85 1s7r h TYR 84 Cb 0.75 0.31 0.00 0.00 1.01 0.00 0.00 36.73 38.80 1s7r h TYR 84 CO 0.07 -0.36 0.00 0.66 -1.05 0.00 0.00 178.16 177.48 1s7r n TYR 85 N -5.38 0.42 -3.97 4.88 4.01 -0.60 -4.91 117.16 111.62 1s7r n TYR 85 Ca -0.05 -0.17 -0.32 0.00 -0.16 0.00 0.00 57.90 57.20 1s7r n TYR 85 Cb 0.29 -0.10 -0.04 0.00 -0.31 0.00 0.00 39.34 39.18 1s7r n TYR 85 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1s7r n ASN 86 N 0.15 -2.46 -4.88 7.72 4.13 -0.73 -4.93 115.26 114.25 1s7r n ASN 86 Ca 0.07 -0.79 -0.31 0.00 1.68 0.00 0.00 54.58 55.24 1s7r n ASN 86 Cb 0.33 -2.09 -0.04 0.00 -1.54 0.00 0.00 39.78 36.44 1s7r n ASN 86 CO 0.00 0.00 0.00 -1.10 0.28 0.00 0.00 177.26 176.44 1s7r s GLN 87 N -6.64 3.78 0.23 3.52 -0.21 0.83 -5.00 119.66 116.17 1s7r s GLN 87 Ca 0.62 0.31 -0.20 0.00 0.02 0.00 0.00 55.36 56.12 1s7r s GLN 87 Cb -0.35 -2.54 -0.08 0.00 1.00 0.00 0.00 33.01 31.04 1s7r s GLN 87 CO 0.77 0.16 0.74 -1.54 -2.12 0.00 0.00 175.29 173.30 1s7r s SER 88 N -2.81 7.08 0.13 5.90 1.04 -1.26 -4.61 113.70 119.17 1s7r s SER 88 Ca 0.49 1.45 0.07 0.00 0.48 0.00 0.00 55.95 58.43 1s7r s SER 88 Cb -0.11 -2.43 0.39 0.00 0.10 0.00 0.00 66.02 63.97 1s7r s SER 88 CO 0.26 0.03 1.14 0.29 0.98 0.00 0.00 173.24 175.93 1s7r n LYS 89 N 0.71 0.05 0.00 4.02 4.76 -1.26 -3.12 118.16 123.32 1s7r n LYS 89 Ca -0.02 0.48 0.13 0.00 -2.87 0.00 0.00 58.31 56.03 1s7r n LYS 89 Cb 0.51 -1.78 0.44 0.00 -1.84 0.00 0.00 35.03 32.36 1s7r n LYS 89 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1s7r n GLY 90 N -1.35 -1.20 3.91 0.72 0.00 -1.26 -4.87 105.19 101.14 1s7r n GLY 90 Ca -0.00 -0.27 -0.21 0.00 0.00 0.00 0.00 46.02 45.54 1s7r n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1s7r s GLY 91 N -2.84 1.46 -0.21 -0.02 0.00 -1.18 -4.84 107.32 99.69 1s7r s GLY 91 Ca 0.17 -1.42 -0.16 0.00 0.00 0.00 0.00 44.72 43.31 1s7r s GLY 91 CO 0.59 -1.41 0.39 -0.45 0.00 0.00 0.00 173.10 172.22 1s7r s SER 92 N -3.98 6.40 0.23 1.64 0.15 -1.26 -4.68 113.70 112.20 1s7r s SER 92 Ca 0.37 0.47 0.11 0.00 0.70 0.00 0.00 55.95 57.61 1s7r s SER 92 Cb -0.08 -2.22 -0.05 0.00 -1.71 0.00 0.00 66.02 61.96 1s7r s SER 92 CO 0.28 -0.09 -0.21 -1.00 1.20 0.00 0.00 173.24 173.42 1s7r s HIS 93 N 1.41 2.20 -0.09 3.44 3.76 -1.26 -4.96 115.29 119.78 1s7r s HIS 93 Ca 0.18 -0.37 0.04 0.00 -0.15 0.00 0.00 55.06 54.76 1s7r s HIS 93 Cb -0.15 -1.03 -0.00 0.00 1.11 0.00 0.00 32.58 32.51 1s7r s HIS 93 CO 0.08 0.56 -0.24 0.99 -0.85 0.00 0.00 174.74 175.28 1s7r s THR 94 N -2.14 2.08 -0.08 1.30 2.01 -1.26 -1.83 115.64 115.73 1s7r s THR 94 Ca 0.24 -1.02 -0.02 0.00 0.31 0.00 0.00 61.69 61.20 1s7r s THR 94 Cb -0.06 -1.78 -0.03 0.00 0.01 0.00 0.00 72.50 70.63 1s7r s THR 94 CO 0.11 0.56 0.01 -0.63 -0.69 0.00 0.00 174.62 173.98 1s7r s ILE 95 N 0.24 4.33 -0.01 1.82 1.01 -0.55 -0.42 121.20 127.63 1s7r s ILE 95 Ca -0.16 -0.26 0.05 0.00 0.00 0.00 0.00 60.65 60.28 1s7r s ILE 95 Cb -0.17 -2.83 -0.01 0.00 0.01 0.00 0.00 42.46 39.46 1s7r s ILE 95 CO 0.08 0.59 -0.15 -1.10 0.00 0.00 0.00 174.94 174.36 1s7r s GLN 96 N -0.94 1.21 -0.04 2.79 -0.21 -0.87 -1.10 119.66 120.50 1s7r s GLN 96 Ca 0.14 -0.55 0.01 0.00 0.02 0.00 0.00 55.36 54.98 1s7r s GLN 96 Cb -0.11 -1.17 0.02 0.00 1.00 0.00 0.00 33.01 32.75 1s7r s GLN 96 CO 0.03 0.32 -0.04 0.08 -2.12 0.00 0.00 175.29 173.55 1s7r s VAL 97 N -0.38 0.53 -0.20 1.09 1.01 -0.47 -1.65 120.40 120.34 1s7r s VAL 97 Ca 0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 61.98 61.88 1s7r s VAL 97 Cb -0.06 -0.55 -0.01 0.00 0.00 0.00 0.00 36.38 35.76 1s7r s VAL 97 CO -0.00 0.22 -0.05 -0.51 0.00 0.00 0.00 175.10 174.76 1s7r s ILE 98 N 0.87 3.48 0.02 2.22 -1.16 0.26 -1.43 121.20 125.46 1s7r s ILE 98 Ca -0.12 -0.47 0.01 0.00 -0.51 0.00 0.00 60.65 59.56 1s7r s ILE 98 Cb -0.14 -2.56 -0.02 0.00 0.61 0.00 0.00 42.46 40.35 1s7r s ILE 98 CO 0.00 0.44 -0.04 -0.55 -2.81 0.00 0.00 174.94 171.99 1s7r s SER 99 N 1.14 0.40 0.00 4.50 0.15 -0.86 0.56 113.70 119.59 1s7r s SER 99 Ca 0.02 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.23 1s7r s SER 99 Cb -0.15 0.06 0.00 0.00 -1.71 0.00 0.00 66.02 64.23 1s7r s SER 99 CO -0.00 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.82 1s7r n GLY 100 N 1.78 -0.96 3.29 9.45 0.00 -0.77 0.25 105.19 118.23 1s7r n GLY 100 Ca -0.22 -1.29 -0.13 0.00 0.00 0.00 0.00 46.02 44.38 1s7r n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s7r s GLU 102 N -0.22 3.29 0.21 0.00 -1.05 0.12 -1.50 118.70 119.55 1s7r s GLU 102 Ca -0.04 -0.66 0.03 0.00 -0.15 0.00 0.00 54.97 54.15 1s7r s GLU 102 Cb -0.03 -2.88 -0.05 0.00 -0.44 0.00 0.00 34.13 30.73 1s7r s GLU 102 CO 0.02 0.51 -0.02 0.14 0.95 0.00 0.00 175.26 176.86 1s7r s VAL 103 N -1.73 1.00 0.32 1.83 -7.23 0.93 -1.76 120.40 113.76 1s7r s VAL 103 Ca 0.34 -2.03 -0.03 0.00 -1.81 0.00 0.00 61.98 58.45 1s7r s VAL 103 Cb -0.11 -2.21 0.07 0.00 0.56 0.00 0.00 36.38 34.69 1s7r s VAL 103 CO 0.27 -0.43 0.44 0.61 -0.31 0.00 0.00 175.10 175.69 1s7r n GLY 104 N -0.35 -0.10 0.17 2.32 0.00 -0.81 -1.16 105.19 105.26 1s7r n GLY 104 Ca -0.06 -1.86 0.05 0.00 0.00 0.00 0.00 46.02 44.15 1s7r n GLY 104 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1s7r h SER 105 N -0.42 0.00 0.36 1.61 4.64 -1.90 -1.83 113.55 116.00 1s7r h SER 105 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1s7r h SER 105 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1s7r h SER 105 CO 0.13 0.40 0.00 -0.90 -0.87 0.00 0.00 176.83 175.59 1s7r n ASP 106 N -3.33 0.00 0.00 4.97 5.75 -1.26 -4.87 116.55 117.81 1s7r n ASP 106 Ca 0.01 0.23 0.00 0.00 -0.01 0.00 0.00 54.79 55.02 1s7r n ASP 106 Cb 0.61 -0.36 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 1s7r n ASP 106 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1s7r n GLY 107 N -0.02 0.68 3.83 6.12 0.00 -0.69 -5.05 105.19 110.07 1s7r n GLY 107 Ca 0.06 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1s7r n GLY 107 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s7r s ARG 108 N -0.16 4.16 -0.02 1.61 0.52 -1.26 -4.77 118.95 119.02 1s7r s ARG 108 Ca 0.00 0.77 -0.39 0.00 -0.52 0.00 0.00 55.73 55.59 1s7r s ARG 108 Cb 0.00 -2.80 -0.18 0.00 0.52 0.00 0.00 34.95 32.49 1s7r s ARG 108 CO 0.00 0.36 1.31 -0.11 0.02 0.00 0.00 175.30 176.88 1s7r n LEU 109 N 0.52 1.13 -0.04 2.53 7.94 -1.26 -1.93 117.00 125.89 1s7r n LEU 109 Ca -0.02 1.13 -0.02 0.00 -1.11 0.00 0.00 56.01 56.00 1s7r n LEU 109 Cb 0.52 -1.07 -0.09 0.00 0.53 0.00 0.00 43.42 43.31 1s7r n LEU 109 CO 0.43 -1.26 -0.78 -0.11 -1.11 0.00 0.00 177.39 174.55 1s7r n LEU 110 N 2.58 0.00 0.00 -1.96 7.94 -0.72 -4.77 117.00 120.06 1s7r n LEU 110 Ca 0.21 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.11 1s7r n LEU 110 Cb 0.13 0.18 0.00 0.00 0.53 0.00 0.00 43.42 44.26 1s7r n LEU 110 CO 0.66 0.18 0.00 -1.14 -1.11 0.00 0.00 177.39 175.98 1s7r n ARG 111 N -2.24 0.00 -4.47 1.96 0.63 -1.12 -4.97 116.66 106.45 1s7r n ARG 111 Ca -0.13 0.00 -0.22 0.00 -0.92 0.00 0.00 57.85 56.58 1s7r n ARG 111 Cb 0.68 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 33.48 1s7r n ARG 111 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1s7r s GLY 112 N 0.00 2.16 -0.29 5.14 0.00 -1.26 0.13 107.32 113.19 1s7r s GLY 112 Ca 0.00 -1.96 -0.32 0.00 0.00 0.00 0.00 44.72 42.45 1s7r s GLY 112 CO 0.00 -1.83 1.39 -2.52 0.00 0.00 0.00 173.10 170.13 1s7r s TYR 113 N -3.27 -0.01 -0.21 1.90 -0.85 -0.96 -4.88 117.35 109.08 1s7r s TYR 113 Ca 0.35 0.02 -0.06 0.00 -0.52 0.00 0.00 57.07 56.86 1s7r s TYR 113 Cb 0.08 0.50 0.10 0.00 0.38 0.00 0.00 41.96 43.02 1s7r s TYR 113 CO 0.15 -0.01 0.40 -1.14 -1.52 0.00 0.00 175.55 173.43 1s7r s GLN 114 N -1.27 0.32 -0.02 -3.49 0.74 -1.25 -1.85 119.66 112.84 1s7r s GLN 114 Ca 0.10 0.92 0.07 0.00 0.05 0.00 0.00 55.36 56.50 1s7r s GLN 114 Cb -0.01 0.15 -0.02 0.00 1.10 0.00 0.00 33.01 34.23 1s7r s GLN 114 CO -0.07 -0.34 -0.24 -0.65 -0.55 0.00 0.00 175.29 173.44 1s7r s GLN 115 N 2.59 2.01 0.10 1.67 -0.21 0.19 -2.35 119.66 123.66 1s7r s GLN 115 Ca 0.02 -0.86 0.09 0.00 0.02 0.00 0.00 55.36 54.62 1s7r s GLN 115 Cb -0.13 -1.91 -0.04 0.00 1.00 0.00 0.00 33.01 31.94 1s7r s GLN 115 CO -0.13 0.50 -0.18 0.71 -2.12 0.00 0.00 175.29 174.07 1s7r s TYR 116 N -0.51 2.55 0.06 0.91 1.51 0.23 -0.58 117.35 121.52 1s7r s TYR 116 Ca 0.08 -0.25 -0.01 0.00 -1.01 0.00 0.00 57.07 55.87 1s7r s TYR 116 Cb -0.10 -1.37 -0.04 0.00 -0.11 0.00 0.00 41.96 40.34 1s7r s TYR 116 CO -0.00 0.37 -0.02 0.00 -1.11 0.00 0.00 175.55 174.79 1s7r s ALA 117 N -1.11 0.55 -0.01 3.71 0.00 -0.66 -1.24 121.76 122.99 1s7r s ALA 117 Ca 0.18 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.90 1s7r s ALA 117 Cb -0.11 0.34 0.01 0.00 0.00 0.00 0.00 23.12 23.37 1s7r s ALA 117 CO 0.10 -0.39 0.00 -0.47 0.00 0.00 0.00 175.76 175.00 1s7r s TYR 118 N -3.93 0.11 -1.77 0.00 5.04 0.01 -2.04 117.35 114.76 1s7r s TYR 118 Ca 0.09 0.03 -0.17 0.00 -2.44 0.00 0.00 57.07 54.58 1s7r s TYR 118 Cb 0.08 -0.17 0.16 0.00 0.35 0.00 0.00 41.96 42.38 1s7r s TYR 118 CO -0.09 -0.05 0.47 -0.25 -1.34 0.00 0.00 175.55 174.30 1s7r n ASP 119 N 3.59 -1.29 0.00 4.32 8.00 0.44 -1.99 116.55 129.62 1s7r n ASP 119 Ca -0.20 -1.22 0.00 0.00 0.71 0.00 0.00 54.79 54.08 1s7r n ASP 119 Cb 0.55 -1.79 0.00 0.00 -0.02 0.00 0.00 41.12 39.86 1s7r n ASP 119 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1s7r n GLY 120 N -1.50 2.87 3.85 0.44 0.00 -1.26 -5.01 105.19 104.58 1s7r n GLY 120 Ca -0.01 -0.75 -0.32 0.00 0.00 0.00 0.00 46.02 44.94 1s7r n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s7r n ASP 122 N -0.63 3.24 0.00 0.00 9.92 -1.26 -0.81 116.55 127.01 1s7r n ASP 122 Ca 0.04 1.14 -0.01 0.00 -0.53 0.00 0.00 54.79 55.44 1s7r n ASP 122 Cb 0.53 -1.58 -0.00 0.00 -0.64 0.00 0.00 41.12 39.43 1s7r n ASP 122 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1s7r n TYR 123 N -0.05 0.00 -3.67 1.24 9.36 -0.38 -4.65 117.16 119.02 1s7r n TYR 123 Ca 0.05 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.12 1s7r n TYR 123 Cb 0.40 -0.04 -0.08 0.00 -0.63 0.00 0.00 39.34 38.99 1s7r n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1s7r s ILE 124 N -1.36 0.03 -0.19 2.97 2.07 -1.11 0.25 121.20 123.86 1s7r s ILE 124 Ca -0.02 -0.23 -0.18 0.00 -1.41 0.00 0.00 60.65 58.80 1s7r s ILE 124 Cb 0.00 -0.76 0.05 0.00 0.13 0.00 0.00 42.46 41.89 1s7r s ILE 124 CO 0.03 -0.13 0.52 0.00 -1.91 0.00 0.00 174.94 173.46 1s7r s ALA 125 N -1.01 -1.29 0.03 1.50 0.00 -0.96 -0.60 121.76 119.43 1s7r s ALA 125 Ca -0.10 1.44 -0.30 0.00 0.00 0.00 0.00 51.96 52.99 1s7r s ALA 125 Cb -0.03 -0.81 -0.06 0.00 0.00 0.00 0.00 23.12 22.22 1s7r s ALA 125 CO 0.06 -0.25 1.33 -1.17 0.00 0.00 0.00 175.76 175.73 1s7r s LEU 126 N 0.20 4.33 0.90 0.00 2.96 -0.99 -1.38 118.68 124.69 1s7r s LEU 126 Ca -0.01 2.10 -0.12 0.00 -0.22 0.00 0.00 54.13 55.88 1s7r s LEU 126 Cb -0.04 -3.57 0.13 0.00 0.50 0.00 0.00 46.19 43.22 1s7r s LEU 126 CO 0.01 -0.64 1.13 0.20 -1.32 0.00 0.00 176.35 175.73 1s7r s ASN 127 N 1.51 3.60 0.24 3.68 0.01 -0.59 -4.56 114.94 118.84 1s7r s ASN 127 Ca 0.62 1.02 0.25 0.00 -0.71 0.00 0.00 52.86 54.04 1s7r s ASN 127 Cb -0.31 -1.62 0.87 0.00 0.41 0.00 0.00 41.25 40.59 1s7r s ASN 127 CO 0.27 -2.50 1.76 -0.62 -1.51 0.00 0.00 177.10 174.50 1s7r n GLU 128 N -3.74 0.25 0.00 -0.60 -0.58 -1.26 -1.88 120.64 112.83 1s7r n GLU 128 Ca 0.07 0.30 0.09 0.00 -0.42 0.00 0.00 57.16 57.20 1s7r n GLU 128 Cb 0.59 -1.85 0.43 0.00 -0.57 0.00 0.00 31.44 30.04 1s7r n GLU 128 CO 0.00 0.00 0.00 -0.40 -0.48 0.00 0.00 177.13 176.25 1s7r n ASP 129 N -2.30 0.00 -1.33 1.62 5.75 -1.26 -4.90 116.55 114.13 1s7r n ASP 129 Ca 0.04 0.39 -0.16 0.00 -0.01 0.00 0.00 54.79 55.05 1s7r n ASP 129 Cb 0.36 -0.45 -0.06 0.00 -1.03 0.00 0.00 41.12 39.94 1s7r n ASP 129 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1s7r n LEU 130 N -1.45 -1.26 0.03 -2.12 4.32 -0.79 -4.81 117.00 110.92 1s7r n LEU 130 Ca 0.06 0.34 0.00 0.00 -0.02 0.00 0.00 56.01 56.39 1s7r n LEU 130 Cb 0.21 -2.35 0.00 0.00 -1.62 0.00 0.00 43.42 39.67 1s7r n LEU 130 CO 0.17 -0.75 -0.21 0.29 -1.22 0.00 0.00 177.39 175.68 1s7r n LYS 131 N -2.53 0.00 -2.80 3.23 5.02 -1.26 -4.61 118.16 115.20 1s7r n LYS 131 Ca -0.17 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 55.86 1s7r n LYS 131 Cb 0.55 -0.42 0.00 0.00 -0.02 0.00 0.00 35.03 35.14 1s7r n LYS 131 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1s7r s THR 132 N -2.00 4.71 0.02 -0.18 -4.23 -1.26 -4.82 115.64 107.88 1s7r s THR 132 Ca 0.00 -0.04 0.07 0.00 -1.18 0.00 0.00 61.69 60.55 1s7r s THR 132 Cb 0.00 -3.78 -0.03 0.00 1.34 0.00 0.00 72.50 70.03 1s7r s THR 132 CO 0.00 -0.69 -0.21 0.26 -0.54 0.00 0.00 174.62 173.44 1s7r s TRP 133 N -2.66 2.48 -0.19 3.99 0.52 -1.26 -1.54 118.94 120.28 1s7r s TRP 133 Ca 0.47 -0.31 -0.04 0.00 0.02 0.00 0.00 56.10 56.24 1s7r s TRP 133 Cb -0.10 -1.47 -0.02 0.00 -1.15 0.00 0.00 33.47 30.73 1s7r s TRP 133 CO 0.42 0.17 -0.03 0.99 0.02 0.00 0.00 176.95 178.52 1s7r s THR 134 N -0.82 3.64 -0.15 2.01 2.01 -0.48 -4.91 115.64 116.94 1s7r s THR 134 Ca 0.13 -0.42 -0.11 0.00 0.31 0.00 0.00 61.69 61.60 1s7r s THR 134 Cb -0.10 -2.63 -0.05 0.00 0.01 0.00 0.00 72.50 69.73 1s7r s THR 134 CO 0.03 0.44 0.20 0.00 -0.69 0.00 0.00 174.62 174.60 1s7r s ALA 135 N 1.03 3.72 -0.03 7.40 0.00 -1.26 -2.26 121.76 130.36 1s7r s ALA 135 Ca 0.01 -0.57 -0.22 0.00 0.00 0.00 0.00 51.96 51.19 1s7r s ALA 135 Cb -0.15 -2.19 -0.15 0.00 0.00 0.00 0.00 23.12 20.63 1s7r s ALA 135 CO 0.01 0.31 0.97 0.00 0.00 0.00 0.00 175.76 177.04 1s7r h ALA 136 N 5.99 -0.36 -1.89 0.00 0.00 -0.46 -3.47 119.26 119.06 1s7r h ALA 136 Ca -0.46 -0.20 -0.55 0.00 0.00 0.00 0.00 54.91 53.70 1s7r h ALA 136 Cb 1.18 0.14 -0.13 0.00 0.00 0.00 0.00 17.79 18.98 1s7r h ALA 136 CO 0.69 -0.44 -0.50 0.16 0.00 0.00 0.00 179.25 179.16 1s7r s ASP 137 N -5.21 2.60 0.39 0.00 1.47 -1.26 -5.05 116.67 109.60 1s7r s ASP 137 Ca -0.12 -1.72 0.27 0.00 1.18 0.00 0.00 52.55 52.16 1s7r s ASP 137 Cb 0.01 0.57 1.37 0.00 -0.34 0.00 0.00 42.92 44.52 1s7r s ASP 137 CO 0.46 -0.99 1.83 0.24 0.68 0.00 0.00 175.17 177.39 1s7r h MET 138 N 1.83 0.00 0.04 2.11 2.86 -1.98 -2.15 114.93 117.64 1s7r h MET 138 Ca -0.32 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.31 1s7r h MET 138 Cb 1.27 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.93 1s7r h MET 138 CO 0.51 0.00 -0.02 0.00 1.06 0.00 0.00 176.91 178.46 1s7r h ALA 139 N 2.07 -0.05 0.00 6.32 0.00 -1.96 -3.13 119.26 122.50 1s7r h ALA 139 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1s7r h ALA 139 Cb 0.14 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1s7r h ALA 139 CO 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.08 1s7r n ALA 140 N -2.51 1.40 0.09 0.00 0.00 -1.03 -2.26 120.51 116.21 1s7r n ALA 140 Ca -0.09 -0.03 -0.04 0.00 0.00 0.00 0.00 53.44 53.29 1s7r n ALA 140 Cb 0.33 -1.14 0.16 0.00 0.00 0.00 0.00 19.45 18.79 1s7r n ALA 140 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1s7r h LEU 141 N 0.00 0.25 0.28 0.00 5.85 -1.34 -2.40 115.31 117.96 1s7r h LEU 141 Ca 0.00 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 1s7r h LEU 141 Cb 0.15 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.11 1s7r h LEU 141 CO 0.00 0.74 -0.14 0.40 -0.34 0.00 0.00 178.44 179.10 1s7r h ILE 142 N 0.17 0.75 -0.83 4.05 2.04 -1.52 -2.38 117.51 119.80 1s7r h ILE 142 Ca 0.00 -0.49 0.19 0.00 1.00 0.00 0.00 64.86 65.56 1s7r h ILE 142 Cb 1.01 1.02 -0.12 0.00 -0.74 0.00 0.00 36.82 37.98 1s7r h ILE 142 CO 0.08 0.10 0.28 0.74 0.00 0.00 0.00 178.15 179.36 1s7r h THR 143 N -0.65 0.49 -0.03 -0.27 2.02 -1.64 -0.51 112.91 112.32 1s7r h THR 143 Ca -0.04 -0.12 0.03 0.00 0.77 0.00 0.00 66.41 67.05 1s7r h THR 143 Cb 0.46 0.12 -0.04 0.00 -1.74 0.00 0.00 68.15 66.95 1s7r h THR 143 CO 0.06 0.06 -0.17 0.50 0.37 0.00 0.00 175.52 176.35 1s7r h LYS 144 N 0.34 -0.25 -0.85 6.66 3.64 -1.31 -0.99 116.57 123.81 1s7r h LYS 144 Ca 0.49 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.88 1s7r h LYS 144 Cb 0.89 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.73 1s7r h LYS 144 CO -0.53 -0.17 0.49 1.25 -2.27 0.00 0.00 179.45 178.23 1s7r h HIS 145 N -0.26 1.13 -0.36 1.91 2.76 -0.62 0.19 115.15 119.90 1s7r h HIS 145 Ca 0.06 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.28 1s7r h HIS 145 Cb 0.35 -0.37 -0.05 0.00 1.55 0.00 0.00 27.41 28.89 1s7r h HIS 145 CO -0.23 0.76 0.07 0.87 -1.30 0.00 0.00 177.93 178.09 1s7r h LYS 146 N 1.17 0.18 0.00 5.26 1.57 -0.93 -2.01 116.57 121.81 1s7r h LYS 146 Ca 0.30 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.99 1s7r h LYS 146 Cb -0.02 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1s7r h LYS 146 CO -0.05 0.12 -0.39 -1.49 -0.57 0.00 0.00 179.45 177.07 1s7r h TRP 147 N 0.19 0.00 -0.08 -1.35 4.06 0.24 -1.03 115.95 117.98 1s7r h TRP 147 Ca 0.17 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 61.02 1s7r h TRP 147 Cb 0.20 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.36 1s7r h TRP 147 CO -0.19 0.39 -0.37 0.93 -3.56 0.00 0.00 178.44 175.64 1s7r h GLU 148 N 0.00 0.39 0.00 0.49 5.08 -0.85 -1.27 114.58 118.42 1s7r h GLU 148 Ca -0.00 -0.31 -0.09 0.00 -1.00 0.00 0.00 59.36 57.96 1s7r h GLU 148 Cb 0.88 0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.18 1s7r h GLU 148 CO 0.05 0.95 -0.40 1.96 -1.00 0.00 0.00 179.01 180.57 1s7r h GLN 149 N -0.08 0.00 -0.09 2.33 1.08 -1.22 -3.14 115.11 113.99 1s7r h GLN 149 Ca -0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1s7r h GLN 149 Cb 1.02 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.45 1s7r h GLN 149 CO 0.08 0.40 0.00 0.00 -0.95 0.00 0.00 178.83 178.36 1s7r n ALA 150 N -2.40 2.49 -2.47 3.87 0.00 -0.40 -4.96 120.51 116.63 1s7r n ALA 150 Ca -0.01 -0.66 -0.21 0.00 0.00 0.00 0.00 53.44 52.55 1s7r n ALA 150 Cb 0.46 -0.93 -0.00 0.00 0.00 0.00 0.00 19.45 18.98 1s7r n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s7r n GLY 151 N 1.31 -0.50 0.23 0.00 0.00 -0.59 -4.85 105.19 100.80 1s7r n GLY 151 Ca 0.16 0.02 0.05 0.00 0.00 0.00 0.00 46.02 46.25 1s7r n GLY 151 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1s7r h GLU 152 N -0.17 0.04 -0.18 1.61 4.57 -1.58 -2.63 114.58 116.24 1s7r h GLU 152 Ca -0.50 -0.01 -0.19 0.00 -1.18 0.00 0.00 59.36 57.47 1s7r h GLU 152 Cb 1.37 -0.01 0.01 0.00 -0.16 0.00 0.00 28.75 29.96 1s7r h GLU 152 CO 0.59 0.18 -0.65 0.00 -1.18 0.00 0.00 179.01 177.95 1s7r h ALA 153 N 1.83 0.32 0.00 2.92 0.00 -1.89 -1.02 119.26 121.43 1s7r h ALA 153 Ca 0.01 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 1s7r h ALA 153 Cb 0.26 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1s7r h ALA 153 CO 0.02 0.61 -0.09 1.05 0.00 0.00 0.00 179.25 180.84 1s7r h GLU 154 N 0.48 0.00 0.09 0.00 9.09 -1.78 -1.53 114.58 120.94 1s7r h GLU 154 Ca -0.03 0.00 -0.26 0.00 0.05 0.00 0.00 59.36 59.12 1s7r h GLU 154 Cb 1.27 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.37 1s7r h GLU 154 CO 0.14 0.09 -1.24 -0.09 0.05 0.00 0.00 179.01 177.96 1s7r h ARG 155 N 0.00 0.20 -0.08 1.06 2.43 -1.30 -2.95 114.38 113.74 1s7r h ARG 155 Ca -0.00 -0.34 -0.21 0.00 -0.81 0.00 0.00 59.98 58.62 1s7r h ARG 155 Cb 0.69 0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 1s7r h ARG 155 CO 0.01 1.14 -0.80 1.25 -1.51 0.00 0.00 179.97 180.05 1s7r h LEU 156 N 0.05 0.65 -1.33 3.80 6.46 -1.09 -2.87 115.31 120.98 1s7r h LEU 156 Ca -0.12 -0.45 -0.06 0.00 -0.12 0.00 0.00 57.88 57.12 1s7r h LEU 156 Cb 1.93 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 41.66 1s7r h LEU 156 CO 0.18 1.22 -0.24 -0.09 -0.62 0.00 0.00 178.44 178.89 1s7r h ARG 157 N 0.35 0.15 0.12 1.25 2.43 -1.36 0.26 114.38 117.57 1s7r h ARG 157 Ca -0.05 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 1s7r h ARG 157 Cb 1.41 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.95 1s7r h ARG 157 CO 0.15 0.39 -0.06 0.00 -1.51 0.00 0.00 179.97 178.93 1s7r h ALA 158 N 1.62 -0.17 -0.71 2.80 0.00 -1.45 -0.42 119.26 120.93 1s7r h ALA 158 Ca 0.02 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1s7r h ALA 158 Cb 0.50 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 1s7r h ALA 158 CO 0.03 -0.59 0.47 -0.92 0.00 0.00 0.00 179.25 178.24 1s7r h TYR 159 N -0.17 0.89 -0.06 0.00 3.20 -0.92 0.21 116.97 120.11 1s7r h TYR 159 Ca -0.02 0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.72 1s7r h TYR 159 Cb 0.13 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 1s7r h TYR 159 CO -0.07 0.55 -0.63 -0.07 -1.64 0.00 0.00 178.16 176.30 1s7r h LEU 160 N 0.95 0.27 0.00 2.82 3.38 -0.53 0.44 115.31 122.64 1s7r h LEU 160 Ca 0.27 -0.16 -0.21 0.00 0.09 0.00 0.00 57.88 57.86 1s7r h LEU 160 Cb -0.08 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.55 1s7r h LEU 160 CO -0.07 0.83 -1.44 -0.33 0.09 0.00 0.00 178.44 177.52 1s7r h GLU 161 N 0.17 0.00 0.00 1.13 5.08 -0.88 -3.27 114.58 116.81 1s7r h GLU 161 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1s7r h GLU 161 Cb 1.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1s7r h GLU 161 CO 0.10 0.43 0.00 0.41 -1.00 0.00 0.00 179.01 178.94 1s7r n GLY 162 N 1.44 0.36 0.27 -3.84 0.00 0.72 -4.61 105.19 99.54 1s7r n GLY 162 Ca -0.11 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.94 1s7r n GLY 162 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1s7r n THR 163 N 0.00 -0.33 -0.03 2.61 -1.04 -1.05 -1.32 114.28 113.12 1s7r n THR 163 Ca 0.00 1.73 -0.14 0.00 -2.04 0.00 0.00 64.05 63.60 1s7r n THR 163 Cb 0.00 -2.37 -0.10 0.00 -1.82 0.00 0.00 70.33 66.04 1s7r n THR 163 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1s7r h VAL 165 N -0.39 1.10 0.00 0.00 -1.51 -1.25 -2.76 116.25 111.43 1s7r h VAL 165 Ca -0.01 -0.34 -0.18 0.00 -1.23 0.00 0.00 66.70 64.95 1s7r h VAL 165 Cb 0.80 0.92 -0.03 0.00 -2.13 0.00 0.00 31.29 30.84 1s7r h VAL 165 CO 0.03 0.12 -1.34 -0.33 -1.23 0.00 0.00 177.57 174.82 1s7r h GLU 166 N 0.26 0.00 0.00 5.19 5.08 -1.47 -3.13 114.58 120.51 1s7r h GLU 166 Ca 0.06 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.24 1s7r h GLU 166 Cb 0.11 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 1s7r h GLU 166 CO -0.00 0.35 -1.10 -1.49 -1.00 0.00 0.00 179.01 175.77 1s7r h TRP 167 N 0.00 0.00 -0.13 4.33 4.06 -1.26 -2.28 115.95 120.67 1s7r h TRP 167 Ca -0.15 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.78 1s7r h TRP 167 Cb 1.61 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.77 1s7r h TRP 167 CO 0.00 0.74 0.03 1.25 -3.56 0.00 0.00 178.44 176.90 1s7r h LEU 168 N 0.00 0.20 -0.16 -4.49 5.85 -1.62 0.77 115.31 115.87 1s7r h LEU 168 Ca -0.10 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.43 1s7r h LEU 168 Cb 1.65 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.57 1s7r h LEU 168 CO 0.08 0.39 -0.19 0.03 -0.34 0.00 0.00 178.44 178.41 1s7r h ARG 169 N 0.01 -0.22 -0.73 1.25 3.08 -1.60 0.19 114.38 116.36 1s7r h ARG 169 Ca 0.04 0.01 0.13 0.00 0.07 0.00 0.00 59.98 60.23 1s7r h ARG 169 Cb 0.27 0.05 -0.13 0.00 0.08 0.00 0.00 29.97 30.23 1s7r h ARG 169 CO 0.00 -0.14 -0.34 -0.09 -1.07 0.00 0.00 179.97 178.33 1s7r h ARG 170 N -0.23 -0.09 -0.32 0.04 9.65 -1.22 -2.60 114.38 119.61 1s7r h ARG 170 Ca 0.11 0.01 -0.13 0.00 -1.10 0.00 0.00 59.98 58.87 1s7r h ARG 170 Cb 0.38 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.97 1s7r h ARG 170 CO -0.29 -0.06 -0.31 1.88 2.80 0.00 0.00 179.97 183.99 1s7r h TYR 171 N -0.10 0.81 0.00 2.20 0.05 0.33 -1.73 116.97 118.52 1s7r h TYR 171 Ca 0.28 -0.21 -0.01 0.00 0.05 0.00 0.00 58.73 58.85 1s7r h TYR 171 Cb 0.57 -0.18 -0.00 0.00 1.01 0.00 0.00 36.73 38.12 1s7r h TYR 171 CO -0.71 0.92 -0.04 -0.07 -1.05 0.00 0.00 178.16 177.21 1s7r h LEU 172 N 0.59 0.00 0.00 3.88 3.38 -0.28 -1.53 115.31 121.35 1s7r h LEU 172 Ca 0.07 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.75 1s7r h LEU 172 Cb 0.82 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 1s7r h LEU 172 CO 0.07 0.04 -1.56 1.17 0.09 0.00 0.00 178.44 178.25 1s7r n LYS 173 N -4.28 0.58 -0.23 1.13 4.81 -1.04 -2.58 118.16 116.56 1s7r n LYS 173 Ca -0.03 0.50 0.03 0.00 -0.87 0.00 0.00 58.31 57.94 1s7r n LYS 173 Cb 0.13 -1.69 0.15 0.00 0.02 0.00 0.00 35.03 33.63 1s7r n LYS 173 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 1s7r h ASN 174 N -0.95 0.15 -2.28 3.14 4.21 -1.25 -2.10 115.58 116.50 1s7r h ASN 174 Ca -0.43 0.11 -0.62 0.00 1.21 0.00 0.00 56.30 56.57 1s7r h ASN 174 Cb 1.40 0.12 -0.40 0.00 -1.12 0.00 0.00 38.32 38.32 1s7r h ASN 174 CO -0.24 0.06 -0.43 0.61 -1.29 0.00 0.00 177.43 176.14 1s7r n GLY 175 N -1.32 5.17 0.11 2.83 0.00 -0.58 -4.83 105.19 106.57 1s7r n GLY 175 Ca 0.12 -2.77 -0.17 0.00 0.00 0.00 0.00 46.02 43.20 1s7r n GLY 175 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1s7r h ASN 176 N 3.88 0.41 -0.24 1.61 -0.73 -1.10 -2.18 115.58 117.24 1s7r h ASN 176 Ca 0.19 -0.53 0.07 0.00 1.87 0.00 0.00 56.30 57.90 1s7r h ASN 176 Cb 0.59 -0.13 -0.01 0.00 0.27 0.00 0.00 38.32 39.03 1s7r h ASN 176 CO 0.89 1.43 0.20 0.00 -0.37 0.00 0.00 177.43 179.58 1s7r h ALA 177 N 0.50 2.07 0.00 1.57 0.00 -1.86 -2.67 119.26 118.87 1s7r h ALA 177 Ca -0.22 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.51 1s7r h ALA 177 Cb 2.01 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.79 1s7r h ALA 177 CO 0.18 -0.32 -1.51 2.41 0.00 0.00 0.00 179.25 180.01 1s7r n THR 178 N -4.18 1.39 0.17 0.00 -1.04 -1.25 -4.23 114.28 105.14 1s7r n THR 178 Ca 0.03 -0.05 0.03 0.00 -2.04 0.00 0.00 64.05 62.02 1s7r n THR 178 Cb 0.34 -2.06 0.39 0.00 -1.82 0.00 0.00 70.33 67.18 1s7r n THR 178 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1s7r h LEU 179 N -0.85 0.07 -3.05 -4.42 3.38 -1.44 -2.98 115.31 106.02 1s7r h LEU 179 Ca -0.27 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1s7r h LEU 179 Cb 1.15 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1s7r h LEU 179 CO -0.16 0.35 0.00 0.18 0.09 0.00 0.00 178.44 178.90 1s7r n LEU 180 N -4.18 4.19 -4.92 1.67 4.77 -1.01 -4.97 117.00 112.55 1s7r n LEU 180 Ca -0.02 -2.36 -0.27 0.00 -0.03 0.00 0.00 56.01 53.33 1s7r n LEU 180 Cb 0.35 -0.49 0.09 0.00 -2.33 0.00 0.00 43.42 41.03 1s7r n LEU 180 CO 0.38 0.81 0.71 0.00 -1.33 0.00 0.00 177.39 177.96 1s7r s ARG 181 N -1.66 1.99 -0.32 3.23 1.70 -1.13 -5.02 118.95 117.73 1s7r s ARG 181 Ca 0.44 -0.12 -0.02 0.00 -0.47 0.00 0.00 55.73 55.56 1s7r s ARG 181 Cb 0.28 -2.06 0.12 0.00 -0.57 0.00 0.00 34.95 32.72 1s7r s ARG 181 CO 0.23 -1.47 0.17 0.99 -1.08 0.00 0.00 175.30 174.13 1s7r s THR 182 N -3.43 0.05 -0.21 4.99 2.01 -1.26 -4.58 115.64 113.21 1s7r s THR 182 Ca 0.62 -1.22 -0.29 0.00 0.31 0.00 0.00 61.69 61.11 1s7r s THR 182 Cb -0.10 -1.06 -0.00 0.00 0.01 0.00 0.00 72.50 71.35 1s7r s THR 182 CO 0.47 -0.85 1.15 -1.81 -0.69 0.00 0.00 174.62 172.89 1s7r s ASP 183 N 1.60 7.00 0.58 3.53 1.01 0.38 -4.71 116.67 126.07 1s7r s ASP 183 Ca 0.13 1.49 -0.18 0.00 0.71 0.00 0.00 52.55 54.70 1s7r s ASP 183 Cb -0.19 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 41.16 1s7r s ASP 183 CO -0.19 -0.74 1.11 -0.44 0.21 0.00 0.00 175.17 175.12 1s7r s SER 184 N 1.65 5.54 0.40 0.27 0.01 -1.26 -1.71 113.70 118.60 1s7r s SER 184 Ca 0.49 2.09 -0.23 0.00 1.31 0.00 0.00 55.95 59.61 1s7r s SER 184 Cb -0.18 -2.57 -0.10 0.00 0.21 0.00 0.00 66.02 63.38 1s7r s SER 184 CO 0.11 -1.34 0.96 -2.16 0.41 0.00 0.00 173.24 171.22 1s7r s PRO 185 N -3.60 4.31 -0.12 12.44 0.04 -1.26 -4.33 135.00 142.47 1s7r s PRO 185 Ca 0.70 1.22 -0.01 0.00 0.04 0.00 0.00 61.00 62.95 1s7r s PRO 185 Cb -0.22 -2.38 -0.02 0.00 0.04 0.00 0.00 34.50 31.92 1s7r s PRO 185 CO 0.32 0.03 -0.09 0.15 0.04 0.00 0.00 177.00 177.45 1s7r s LYS 186 N -2.80 3.28 0.30 4.56 1.02 -1.00 -4.90 119.74 120.20 1s7r s LYS 186 Ca 0.58 -0.61 0.11 0.00 0.02 0.00 0.00 55.97 56.08 1s7r s LYS 186 Cb -0.13 -2.69 -0.05 0.00 -0.52 0.00 0.00 37.83 34.44 1s7r s LYS 186 CO 0.18 0.34 -0.17 0.00 -0.92 0.00 0.00 175.35 174.77 1s7r s ALA 187 N 0.05 2.80 0.39 5.17 0.00 -1.26 -1.08 121.76 127.83 1s7r s ALA 187 Ca -0.03 -1.94 -0.13 0.00 0.00 0.00 0.00 51.96 49.87 1s7r s ALA 187 Cb -0.14 -0.20 0.05 0.00 0.00 0.00 0.00 23.12 22.83 1s7r s ALA 187 CO 0.04 0.22 0.74 -3.38 0.00 0.00 0.00 175.76 173.38 1s7r s HIS 188 N -2.54 0.30 -0.01 0.00 -3.43 -0.95 -5.01 115.29 103.65 1s7r s HIS 188 Ca 0.31 -0.92 0.01 0.00 -0.80 0.00 0.00 55.06 53.66 1s7r s HIS 188 Cb -0.03 0.70 0.00 0.00 -1.43 0.00 0.00 32.58 31.82 1s7r s HIS 188 CO 0.15 -1.53 -0.04 0.08 -2.00 0.00 0.00 174.74 171.41 1s7r s VAL 189 N -2.32 0.31 0.16 -5.38 1.01 -1.26 -0.93 120.40 112.00 1s7r s VAL 189 Ca 0.18 -0.14 0.10 0.00 0.00 0.00 0.00 61.98 62.12 1s7r s VAL 189 Cb -0.04 -0.29 -0.04 0.00 0.00 0.00 0.00 36.38 36.00 1s7r s VAL 189 CO 0.13 0.11 -0.18 0.42 0.00 0.00 0.00 175.10 175.58 1s7r s THR 190 N 0.11 2.75 -0.08 3.92 -4.23 0.32 -4.69 115.64 113.75 1s7r s THR 190 Ca -0.01 -1.75 0.04 0.00 -1.18 0.00 0.00 61.69 58.79 1s7r s THR 190 Cb -0.04 -2.32 -0.02 0.00 1.34 0.00 0.00 72.50 71.47 1s7r s THR 190 CO -0.00 -0.04 -0.19 -2.28 -0.54 0.00 0.00 174.62 171.57 1s7r s HIS 191 N -1.50 2.62 -0.04 3.99 2.46 -1.26 -2.28 115.29 119.28 1s7r s HIS 191 Ca 0.21 -0.54 -0.02 0.00 0.47 0.00 0.00 55.06 55.18 1s7r s HIS 191 Cb -0.09 -1.68 0.03 0.00 -0.13 0.00 0.00 32.58 30.71 1s7r s HIS 191 CO 0.11 -0.10 0.09 -1.01 -2.47 0.00 0.00 174.74 171.37 1s7r s HIS 192 N -0.18 -0.09 0.94 3.88 3.76 -0.62 -5.01 115.29 117.98 1s7r s HIS 192 Ca -0.02 0.30 -0.11 0.00 -0.15 0.00 0.00 55.06 55.08 1s7r s HIS 192 Cb -0.14 -0.09 0.15 0.00 1.11 0.00 0.00 32.58 33.62 1s7r s HIS 192 CO 0.03 -0.11 1.09 -1.12 -0.85 0.00 0.00 174.74 173.79 1s7r s SER 193 N 0.78 3.02 -0.28 1.40 0.01 -1.26 -1.30 113.70 116.06 1s7r s SER 193 Ca -0.06 1.60 -0.22 0.00 1.31 0.00 0.00 55.95 58.58 1s7r s SER 193 Cb -0.08 -2.26 0.12 0.00 0.21 0.00 0.00 66.02 64.01 1s7r s SER 193 CO -0.03 -2.94 0.98 -0.60 0.41 0.00 0.00 173.24 171.05 1s7r s ARG 194 N -4.82 0.50 0.75 12.44 3.52 -1.19 -4.67 118.95 125.49 1s7r s ARG 194 Ca 0.65 0.68 -0.15 0.00 -0.13 0.00 0.00 55.73 56.78 1s7r s ARG 194 Cb -0.20 0.20 0.05 0.00 -1.56 0.00 0.00 34.95 33.44 1s7r s ARG 194 CO 0.58 -0.07 1.22 -2.14 -0.81 0.00 0.00 175.30 174.08 1s7r s PRO 195 N 0.64 2.00 0.00 5.12 0.02 -1.26 -3.24 135.00 138.27 1s7r s PRO 195 Ca -0.01 1.82 0.00 0.00 0.02 0.00 0.00 61.00 62.82 1s7r s PRO 195 Cb -0.05 -1.81 0.00 0.00 0.02 0.00 0.00 34.50 32.66 1s7r s PRO 195 CO -0.09 -1.96 0.00 -1.91 -0.33 0.00 0.00 177.00 172.71 1s7r n GLU 196 N -2.82 0.00 -3.36 5.54 2.13 -1.26 -3.90 120.64 116.97 1s7r n GLU 196 Ca 0.14 0.17 -0.18 0.00 0.66 0.00 0.00 57.16 57.95 1s7r n GLU 196 Cb 0.50 -2.41 0.07 0.00 0.27 0.00 0.00 31.44 29.88 1s7r n GLU 196 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1s7r n ASP 197 N 0.67 -4.24 -4.69 4.31 9.92 -1.24 -5.02 116.55 116.27 1s7r n ASP 197 Ca 0.00 -0.49 -0.27 0.00 -0.53 0.00 0.00 54.79 53.50 1s7r n ASP 197 Cb 0.00 -4.44 -0.09 0.00 -0.64 0.00 0.00 41.12 35.95 1s7r n ASP 197 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1s7r s LYS 198 N -5.74 2.09 -0.22 -1.24 3.01 -1.20 -2.80 119.74 113.64 1s7r s LYS 198 Ca 0.30 -2.03 -0.18 0.00 -1.01 0.00 0.00 55.97 53.05 1s7r s LYS 198 Cb -0.13 -1.78 0.06 0.00 -1.01 0.00 0.00 37.83 34.97 1s7r s LYS 198 CO 0.63 -0.12 0.58 0.08 0.51 0.00 0.00 175.35 177.03 1s7r s VAL 199 N -2.68 -0.00 -0.22 3.17 1.01 0.43 -3.14 120.40 118.97 1s7r s VAL 199 Ca 0.35 0.01 -0.10 0.00 0.00 0.00 0.00 61.98 62.25 1s7r s VAL 199 Cb 0.07 -0.82 -0.05 0.00 0.00 0.00 0.00 36.38 35.58 1s7r s VAL 199 CO 0.19 0.01 0.13 -0.89 0.00 0.00 0.00 175.10 174.53 1s7r s THR 200 N 0.67 5.16 -0.30 3.92 2.01 -0.42 -0.13 115.64 126.54 1s7r s THR 200 Ca -0.03 0.11 -0.02 0.00 0.31 0.00 0.00 61.69 62.06 1s7r s THR 200 Cb -0.05 -3.38 0.05 0.00 0.01 0.00 0.00 72.50 69.13 1s7r s THR 200 CO -0.04 0.38 0.01 -0.76 -0.69 0.00 0.00 174.62 173.51 1s7r s LEU 201 N 0.88 3.94 -0.21 4.42 1.43 -0.54 -1.59 118.68 127.02 1s7r s LEU 201 Ca 0.06 -1.29 -0.08 0.00 -1.03 0.00 0.00 54.13 51.80 1s7r s LEU 201 Cb -0.13 -1.72 -0.04 0.00 0.03 0.00 0.00 46.19 44.33 1s7r s LEU 201 CO 0.03 -0.27 0.09 -0.60 0.23 0.00 0.00 176.35 175.83 1s7r s ARG 202 N 1.25 3.98 -0.39 1.70 3.52 -0.97 -1.09 118.95 126.95 1s7r s ARG 202 Ca -0.05 -0.33 -0.15 0.00 -0.13 0.00 0.00 55.73 55.07 1s7r s ARG 202 Cb -0.20 -3.33 0.01 0.00 -1.56 0.00 0.00 34.95 29.88 1s7r s ARG 202 CO -0.01 0.16 0.35 0.00 -0.81 0.00 0.00 175.30 174.99 1s7r s TRP 204 N 1.88 3.56 -0.06 0.00 0.52 -0.10 -2.16 118.94 122.58 1s7r s TRP 204 Ca 0.08 0.85 0.00 0.00 0.02 0.00 0.00 56.10 57.06 1s7r s TRP 204 Cb -0.18 -2.21 0.02 0.00 -1.15 0.00 0.00 33.47 29.95 1s7r s TRP 204 CO 0.11 0.46 -0.04 0.00 0.02 0.00 0.00 176.95 177.50 1s7r s ALA 205 N -1.48 0.79 0.33 0.98 0.00 -0.50 -2.25 121.76 119.63 1s7r s ALA 205 Ca 0.37 -0.15 0.04 0.00 0.00 0.00 0.00 51.96 52.21 1s7r s ALA 205 Cb -0.14 -0.57 -0.06 0.00 0.00 0.00 0.00 23.12 22.35 1s7r s ALA 205 CO 0.19 -0.17 0.07 -0.51 0.00 0.00 0.00 175.76 175.34 1s7r s LEU 206 N 1.27 2.13 -1.34 0.00 1.43 -0.24 -2.19 118.68 119.74 1s7r s LEU 206 Ca -0.05 -1.42 -0.15 0.00 -1.03 0.00 0.00 54.13 51.48 1s7r s LEU 206 Cb -0.14 -0.33 0.01 0.00 0.03 0.00 0.00 46.19 45.77 1s7r s LEU 206 CO -0.02 -0.66 0.45 0.61 0.23 0.00 0.00 176.35 176.96 1s7r n GLY 207 N -0.71 -0.52 3.21 -3.19 0.00 -1.19 -2.37 105.19 100.41 1s7r n GLY 207 Ca -0.03 0.27 -0.17 0.00 0.00 0.00 0.00 46.02 46.09 1s7r n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1s7r s PHE 208 N -3.85 1.25 -0.23 1.61 -0.12 -1.12 -4.46 117.98 111.05 1s7r s PHE 208 Ca 0.24 -0.57 -0.19 0.00 -0.05 0.00 0.00 56.93 56.36 1s7r s PHE 208 Cb -0.12 -0.67 0.06 0.00 -0.63 0.00 0.00 43.02 41.67 1s7r s PHE 208 CO 0.94 0.08 0.61 -0.47 -0.05 0.00 0.00 175.22 176.33 1s7r s TYR 209 N -2.05 -0.74 1.04 3.49 6.14 -0.69 -0.85 117.35 123.69 1s7r s TYR 209 Ca 0.05 1.71 -0.15 0.00 0.64 0.00 0.00 57.07 59.32 1s7r s TYR 209 Cb -0.05 0.30 0.21 0.00 0.42 0.00 0.00 41.96 42.84 1s7r s TYR 209 CO 0.02 -0.36 1.15 -2.14 0.64 0.00 0.00 175.55 174.85 1s7r s PRO 210 N 0.64 0.10 0.63 4.97 0.02 -1.26 -0.47 135.00 139.64 1s7r s PRO 210 Ca -0.03 0.10 0.35 0.00 0.02 0.00 0.00 61.00 61.45 1s7r s PRO 210 Cb -0.05 -1.74 1.99 0.00 0.02 0.00 0.00 34.50 34.73 1s7r s PRO 210 CO -0.04 -2.86 2.23 0.00 -0.33 0.00 0.00 177.00 176.00 1s7r h ALA 211 N -1.97 1.38 -2.48 -1.55 0.00 -1.93 -3.43 119.26 109.28 1s7r h ALA 211 Ca -0.49 -0.00 -0.53 0.00 0.00 0.00 0.00 54.91 53.89 1s7r h ALA 211 Cb 1.31 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.11 1s7r h ALA 211 CO 0.48 -0.11 0.64 0.34 0.00 0.00 0.00 179.25 180.60 1s7r s ASP 212 N -5.51 6.99 0.20 0.00 2.15 -1.26 -4.95 116.67 114.29 1s7r s ASP 212 Ca -0.05 2.09 -0.22 0.00 0.43 0.00 0.00 52.55 54.81 1s7r s ASP 212 Cb 0.14 -2.58 0.05 0.00 -0.30 0.00 0.00 42.92 40.23 1s7r s ASP 212 CO 0.47 -0.55 0.63 -0.51 -0.17 0.00 0.00 175.17 175.04 1s7r s ILE 213 N 1.27 0.00 -0.03 4.11 2.07 -1.26 -4.63 121.20 122.73 1s7r s ILE 213 Ca 0.61 -0.37 -0.01 0.00 -1.41 0.00 0.00 60.65 59.46 1s7r s ILE 213 Cb -0.31 -1.36 0.02 0.00 0.13 0.00 0.00 42.46 40.95 1s7r s ILE 213 CO 0.29 -0.01 0.06 -0.89 -1.91 0.00 0.00 174.94 172.47 1s7r s THR 214 N -3.81 -0.04 -0.11 4.00 2.01 -0.55 -4.96 115.64 112.18 1s7r s THR 214 Ca 0.05 0.15 0.03 0.00 0.31 0.00 0.00 61.69 62.23 1s7r s THR 214 Cb -0.03 -0.11 0.00 0.00 0.01 0.00 0.00 72.50 72.38 1s7r s THR 214 CO -0.06 0.06 -0.23 -0.76 -0.69 0.00 0.00 174.62 172.94 1s7r s LEU 215 N 0.79 2.13 0.06 4.42 1.43 -1.26 -0.66 118.68 125.60 1s7r s LEU 215 Ca -0.06 -0.56 0.04 0.00 -1.03 0.00 0.00 54.13 52.52 1s7r s LEU 215 Cb -0.09 -1.43 -0.03 0.00 0.03 0.00 0.00 46.19 44.67 1s7r s LEU 215 CO -0.03 0.14 -0.13 0.42 0.23 0.00 0.00 176.35 176.98 1s7r s THR 216 N 0.46 1.00 -0.15 5.49 -4.23 -0.14 -4.95 115.64 113.12 1s7r s THR 216 Ca -0.16 -1.17 -0.10 0.00 -1.18 0.00 0.00 61.69 59.08 1s7r s THR 216 Cb -0.17 -0.96 -0.05 0.00 1.34 0.00 0.00 72.50 72.66 1s7r s THR 216 CO 0.06 -0.19 0.19 0.26 -0.54 0.00 0.00 174.62 174.40 1s7r s TRP 217 N -1.16 3.51 0.44 3.99 0.52 -1.26 0.44 118.94 125.42 1s7r s TRP 217 Ca -0.02 0.50 0.05 0.00 0.02 0.00 0.00 56.10 56.65 1s7r s TRP 217 Cb -0.09 -2.13 -0.06 0.00 -1.15 0.00 0.00 33.47 30.04 1s7r s TRP 217 CO 0.02 0.46 0.03 -0.65 0.02 0.00 0.00 176.95 176.83 1s7r s GLN 218 N -0.21 2.06 -0.30 4.98 -0.21 0.30 -2.55 119.66 123.73 1s7r s GLN 218 Ca 0.13 -2.16 0.06 0.00 0.02 0.00 0.00 55.36 53.41 1s7r s GLN 218 Cb -0.12 -1.65 0.19 0.00 1.00 0.00 0.00 33.01 32.43 1s7r s GLN 218 CO 0.02 -0.15 0.57 -1.17 -2.12 0.00 0.00 175.29 172.44 1s7r s LEU 219 N -3.79 -1.53 -1.73 2.90 2.96 -1.16 -1.39 118.68 114.95 1s7r s LEU 219 Ca 0.28 0.04 -0.00 0.00 -0.22 0.00 0.00 54.13 54.23 1s7r s LEU 219 Cb 0.07 1.92 0.00 0.00 0.50 0.00 0.00 46.19 48.68 1s7r s LEU 219 CO 0.14 -0.30 0.01 0.59 -1.32 0.00 0.00 176.35 175.47 1s7r n ASN 220 N 5.33 -5.77 -0.00 3.68 5.03 -1.26 -3.33 115.26 118.95 1s7r n ASN 220 Ca 0.05 -0.02 0.00 0.00 0.87 0.00 0.00 54.58 55.48 1s7r n ASN 220 Cb 0.54 -4.79 0.00 0.00 -1.02 0.00 0.00 39.78 34.51 1s7r n ASN 220 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1s7r n GLY 221 N -1.02 1.96 3.64 7.41 0.00 -1.26 -5.12 105.19 110.80 1s7r n GLY 221 Ca -0.24 -0.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.71 1s7r n GLY 221 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1s7r s GLU 222 N -1.06 0.66 0.62 1.61 -1.05 -1.21 -5.17 118.70 113.09 1s7r s GLU 222 Ca 0.00 1.21 -0.17 0.00 -0.15 0.00 0.00 54.97 55.86 1s7r s GLU 222 Cb 0.00 0.25 -0.02 0.00 -0.44 0.00 0.00 34.13 33.92 1s7r s GLU 222 CO 0.00 -0.15 1.11 -1.21 0.95 0.00 0.00 175.26 175.96 1s7r s GLU 223 N 1.81 3.01 -0.42 -4.83 2.02 -1.26 -2.98 118.70 116.05 1s7r s GLU 223 Ca -0.09 1.46 0.05 0.00 0.02 0.00 0.00 54.97 56.41 1s7r s GLU 223 Cb -0.06 -1.97 0.43 0.00 0.10 0.00 0.00 34.13 32.62 1s7r s GLU 223 CO -0.19 -1.09 1.17 1.28 0.02 0.00 0.00 175.26 176.44 1s7r n LEU 224 N -2.01 4.88 -0.45 1.80 4.32 -1.06 -4.89 117.00 119.59 1s7r n LEU 224 Ca 0.11 -5.10 0.40 0.00 -0.02 0.00 0.00 56.01 51.40 1s7r n LEU 224 Cb 0.52 -0.46 0.75 0.00 -1.62 0.00 0.00 43.42 42.61 1s7r n LEU 224 CO 0.46 2.19 1.36 0.40 -1.22 0.00 0.00 177.39 180.58 1s7r h ILE 225 N 2.46 0.26 0.00 -0.08 5.03 -1.95 -2.16 117.51 121.08 1s7r h ILE 225 Ca 0.33 -0.01 -0.00 0.00 -0.12 0.00 0.00 64.86 65.05 1s7r h ILE 225 Cb 1.02 0.23 0.00 0.00 -3.03 0.00 0.00 36.82 35.03 1s7r h ILE 225 CO 0.86 0.01 -0.00 1.56 -0.68 0.00 0.00 178.15 179.89 1s7r h GLN 226 N 0.03 -0.01 -0.88 2.37 7.50 -2.01 -3.30 115.11 118.82 1s7r h GLN 226 Ca 0.71 0.00 -0.13 0.00 0.50 0.00 0.00 58.65 59.73 1s7r h GLN 226 Cb 2.72 0.00 -0.08 0.00 0.05 0.00 0.00 27.48 30.18 1s7r h GLN 226 CO -0.06 0.75 0.16 -0.25 -1.50 0.00 0.00 178.83 177.93 1s7r n ASP 227 N -4.66 3.44 -3.52 1.46 9.92 -0.84 -4.84 116.55 117.51 1s7r n ASP 227 Ca -0.08 -2.65 -0.11 0.00 -0.53 0.00 0.00 54.79 51.42 1s7r n ASP 227 Cb 0.37 -0.64 0.04 0.00 -0.64 0.00 0.00 41.12 40.25 1s7r n ASP 227 CO 0.00 0.00 0.00 0.23 0.13 0.00 0.00 177.20 177.56 1s7r n MET 228 N 0.01 0.67 -3.15 -1.24 2.81 -1.05 -4.17 117.12 111.00 1s7r n MET 228 Ca 0.22 -1.62 0.05 0.00 -1.81 0.00 0.00 57.70 54.54 1s7r n MET 228 Cb 0.92 -0.18 -0.01 0.00 -0.71 0.00 0.00 33.22 33.24 1s7r n MET 228 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 1s7r s GLU 229 N -3.50 0.36 0.41 0.03 2.12 -0.18 -4.93 118.70 113.01 1s7r s GLU 229 Ca 0.33 0.58 0.07 0.00 0.36 0.00 0.00 54.97 56.32 1s7r s GLU 229 Cb -0.02 0.32 -0.05 0.00 0.26 0.00 0.00 34.13 34.63 1s7r s GLU 229 CO 0.21 -0.44 0.19 -0.48 -0.54 0.00 0.00 175.26 174.20 1s7r s LEU 230 N 2.91 3.13 -0.05 2.70 2.34 -1.26 -0.76 118.68 127.69 1s7r s LEU 230 Ca 0.11 -1.07 0.06 0.00 0.06 0.00 0.00 54.13 53.29 1s7r s LEU 230 Cb -0.11 -1.46 -0.02 0.00 -0.56 0.00 0.00 46.19 44.04 1s7r s LEU 230 CO -0.17 -0.54 -0.23 0.68 -1.06 0.00 0.00 176.35 175.02 1s7r s VAL 231 N -2.59 2.25 0.11 1.48 -7.23 -1.00 -5.01 120.40 108.41 1s7r s VAL 231 Ca 0.41 -1.01 -0.35 0.00 -1.81 0.00 0.00 61.98 59.22 1s7r s VAL 231 Cb 0.04 -1.82 -0.17 0.00 0.56 0.00 0.00 36.38 34.99 1s7r s VAL 231 CO 0.23 0.58 1.12 -0.62 -0.31 0.00 0.00 175.10 176.09 1s7r n GLU 232 N 2.68 0.75 -1.44 4.82 1.02 -1.26 -4.43 120.64 122.78 1s7r n GLU 232 Ca -0.17 0.27 -0.44 0.00 -0.02 0.00 0.00 57.16 56.80 1s7r n GLU 232 Cb 0.52 -1.75 -0.01 0.00 -0.02 0.00 0.00 31.44 30.18 1s7r n GLU 232 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 1s7r n THR 233 N 1.59 1.70 -4.11 2.62 -1.04 -1.26 -4.90 114.28 108.88 1s7r n THR 233 Ca 0.17 -0.50 -0.15 0.00 -2.04 0.00 0.00 64.05 61.54 1s7r n THR 233 Cb 0.19 -0.41 -0.11 0.00 -1.82 0.00 0.00 70.33 68.18 1s7r n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1s7r s ARG 234 N -1.35 0.66 0.16 -2.82 1.70 -0.48 -4.96 118.95 111.86 1s7r s ARG 234 Ca 0.62 -0.88 -0.30 0.00 -0.47 0.00 0.00 55.73 54.70 1s7r s ARG 234 Cb -0.71 -0.47 -0.08 0.00 -0.57 0.00 0.00 34.95 33.13 1s7r s ARG 234 CO 0.59 0.09 1.32 -2.14 -1.08 0.00 0.00 175.30 174.08 1s7r s PRO 235 N -1.84 4.37 -0.16 3.89 0.02 -1.26 -1.58 135.00 138.44 1s7r s PRO 235 Ca -0.05 2.03 0.17 0.00 0.02 0.00 0.00 61.00 63.16 1s7r s PRO 235 Cb -0.09 -3.23 0.72 0.00 0.02 0.00 0.00 34.50 31.93 1s7r s PRO 235 CO 0.01 -0.31 1.64 0.00 -0.33 0.00 0.00 177.00 178.01 1s7r n ALA 236 N 3.17 3.31 -0.83 -1.55 0.00 0.14 -4.89 120.51 119.86 1s7r n ALA 236 Ca 0.08 -1.76 0.00 0.00 0.00 0.00 0.00 53.44 51.76 1s7r n ALA 236 Cb 0.43 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.88 1s7r n ALA 236 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1s7r n GLY 237 N 0.79 0.64 1.20 0.00 0.00 -1.26 -4.85 105.19 101.71 1s7r n GLY 237 Ca 0.26 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.30 1s7r n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1s7r n ASP 238 N 0.00 0.66 -0.84 1.61 5.75 -1.26 -4.99 116.55 117.48 1s7r n ASP 238 Ca 0.00 -1.99 -0.10 0.00 -0.01 0.00 0.00 54.79 52.69 1s7r n ASP 238 Cb 0.00 -0.25 -0.04 0.00 -1.03 0.00 0.00 41.12 39.80 1s7r n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1s7r n GLY 239 N 0.34 0.94 3.37 6.12 0.00 -1.26 -5.05 105.19 109.65 1s7r n GLY 239 Ca 0.03 -0.55 -0.19 0.00 0.00 0.00 0.00 46.02 45.31 1s7r n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s7r s THR 240 N -2.40 1.46 0.41 2.61 -4.23 -1.26 -4.86 115.64 107.38 1s7r s THR 240 Ca 0.00 -2.11 0.07 0.00 -1.18 0.00 0.00 61.69 58.47 1s7r s THR 240 Cb 0.00 -2.30 -0.06 0.00 1.34 0.00 0.00 72.50 71.48 1s7r s THR 240 CO 0.00 -0.40 0.14 -0.36 -0.54 0.00 0.00 174.62 173.46 1s7r s PHE 241 N -3.14 2.59 0.03 3.99 0.40 -0.03 0.25 117.98 122.07 1s7r s PHE 241 Ca 0.27 -0.61 -0.17 0.00 -0.60 0.00 0.00 56.93 55.83 1s7r s PHE 241 Cb 0.03 -1.91 0.03 0.00 0.51 0.00 0.00 43.02 41.68 1s7r s PHE 241 CO 0.09 0.25 0.37 1.14 0.70 0.00 0.00 175.22 177.77 1s7r s GLN 242 N -3.86 0.84 0.01 0.44 -2.07 -0.62 -2.78 119.66 111.62 1s7r s GLN 242 Ca 0.40 -0.34 -0.05 0.00 -1.82 0.00 0.00 55.36 53.55 1s7r s GLN 242 Cb 0.05 0.37 -0.01 0.00 -1.09 0.00 0.00 33.01 32.34 1s7r s GLN 242 CO 0.21 -0.27 0.08 0.21 -1.32 0.00 0.00 175.29 174.20 1s7r s LYS 243 N -2.19 0.44 0.03 9.60 2.20 -0.93 -1.38 119.74 127.51 1s7r s LYS 243 Ca -0.07 -0.51 0.03 0.00 -0.36 0.00 0.00 55.97 55.06 1s7r s LYS 243 Cb -0.02 0.17 -0.02 0.00 -1.51 0.00 0.00 37.83 36.46 1s7r s LYS 243 CO -0.01 -0.10 -0.11 1.67 -0.36 0.00 0.00 175.35 176.45 1s7r s TRP 244 N -1.55 0.92 -0.05 4.03 1.48 -1.26 -1.42 118.94 121.10 1s7r s TRP 244 Ca -0.14 -0.33 0.01 0.00 -1.06 0.00 0.00 56.10 54.58 1s7r s TRP 244 Cb -0.08 -0.56 0.02 0.00 -1.16 0.00 0.00 33.47 31.70 1s7r s TRP 244 CO 0.00 -0.01 -0.07 0.00 -4.06 0.00 0.00 176.95 172.81 1s7r s ALA 245 N -0.80 0.88 0.32 2.67 0.00 -0.92 -2.36 121.76 121.53 1s7r s ALA 245 Ca -0.01 -0.18 0.09 0.00 0.00 0.00 0.00 51.96 51.86 1s7r s ALA 245 Cb -0.07 -0.48 -0.05 0.00 0.00 0.00 0.00 23.12 22.52 1s7r s ALA 245 CO 0.01 0.02 0.02 -1.54 0.00 0.00 0.00 175.76 174.26 1s7r s SER 246 N 0.84 4.32 -0.01 0.00 1.04 0.06 -0.83 113.70 119.13 1s7r s SER 246 Ca -0.12 -0.87 -0.13 0.00 0.48 0.00 0.00 55.95 55.32 1s7r s SER 246 Cb -0.15 -0.63 0.02 0.00 0.10 0.00 0.00 66.02 65.36 1s7r s SER 246 CO 0.01 -0.17 0.26 0.54 0.98 0.00 0.00 173.24 174.87 1s7r s VAL 247 N -2.45 0.06 -0.40 5.02 0.11 -0.25 -1.01 120.40 121.49 1s7r s VAL 247 Ca 0.34 -0.52 -0.11 0.00 -2.93 0.00 0.00 61.98 58.76 1s7r s VAL 247 Cb -0.02 -0.56 0.04 0.00 -1.53 0.00 0.00 36.38 34.31 1s7r s VAL 247 CO 0.20 -0.29 0.24 -0.69 -3.33 0.00 0.00 175.10 171.23 1s7r s VAL 248 N -1.31 4.59 0.25 2.04 1.01 -1.26 -1.47 120.40 124.25 1s7r s VAL 248 Ca -0.14 -1.01 0.09 0.00 0.00 0.00 0.00 61.98 60.93 1s7r s VAL 248 Cb -0.06 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 1s7r s VAL 248 CO 0.03 -0.34 -0.01 0.68 0.00 0.00 0.00 175.10 175.46 1s7r s VAL 249 N 1.54 3.46 0.09 2.92 -7.23 0.82 -4.91 120.40 117.08 1s7r s VAL 249 Ca 0.02 -1.86 -0.30 0.00 -1.81 0.00 0.00 61.98 58.03 1s7r s VAL 249 Cb -0.21 -2.83 -0.05 0.00 0.56 0.00 0.00 36.38 33.85 1s7r s VAL 249 CO 0.06 -0.34 0.95 -2.16 -0.31 0.00 0.00 175.10 173.30 1s7r s PRO 250 N -3.57 4.67 0.26 4.82 0.04 -1.26 -0.43 135.00 139.54 1s7r s PRO 250 Ca 0.31 1.43 -0.28 0.00 0.04 0.00 0.00 61.00 62.49 1s7r s PRO 250 Cb -0.07 -3.39 -0.15 0.00 0.04 0.00 0.00 34.50 30.94 1s7r s PRO 250 CO 0.20 0.18 0.89 -0.11 0.04 0.00 0.00 177.00 178.20 1s7r n LEU 251 N 2.93 1.02 0.00 -3.56 7.94 -1.12 -2.05 117.00 122.16 1s7r n LEU 251 Ca 0.03 1.17 0.00 0.00 -1.11 0.00 0.00 56.01 56.09 1s7r n LEU 251 Cb 0.49 -1.20 0.00 0.00 0.53 0.00 0.00 43.42 43.24 1s7r n LEU 251 CO 0.51 -1.80 0.00 0.61 -1.11 0.00 0.00 177.39 175.60 1s7r n GLY 252 N 1.44 2.91 0.81 -3.96 0.00 -1.26 -4.83 105.19 100.30 1s7r n GLY 252 Ca 0.12 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.16 1s7r n GLY 252 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1s7r n LYS 253 N -0.82 1.83 0.13 1.61 5.02 -0.87 -4.59 118.16 120.47 1s7r n LYS 253 Ca 0.00 -3.40 0.12 0.00 -2.02 0.00 0.00 58.31 53.01 1s7r n LYS 253 Cb 0.00 -1.71 0.15 0.00 -0.02 0.00 0.00 35.03 33.44 1s7r n LYS 253 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 1s7r h GLU 254 N 1.13 0.00 -0.07 1.97 4.11 -1.88 -3.25 114.58 116.59 1s7r h GLU 254 Ca 0.06 0.00 0.02 0.00 0.07 0.00 0.00 59.36 59.51 1s7r h GLU 254 Cb 1.11 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 1s7r h GLU 254 CO 0.12 0.00 0.07 -0.56 0.07 0.00 0.00 179.01 178.71 1s7r h GLN 255 N 0.00 0.00 0.00 1.06 3.07 -1.92 -2.85 115.11 114.47 1s7r h GLN 255 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1s7r h GLN 255 Cb 0.90 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.46 1s7r h GLN 255 CO 0.00 0.00 -0.66 0.66 0.09 0.00 0.00 178.83 178.92 1s7r n TYR 256 N -3.88 0.02 -3.55 0.06 4.01 -1.23 -4.86 117.16 107.74 1s7r n TYR 256 Ca -0.01 0.01 -0.38 0.00 -0.16 0.00 0.00 57.90 57.35 1s7r n TYR 256 Cb 0.17 -0.20 -0.06 0.00 -0.31 0.00 0.00 39.34 38.94 1s7r n TYR 256 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1s7r s TYR 257 N -3.01 3.68 0.06 -0.72 1.51 -1.08 -4.30 117.35 113.50 1s7r s TYR 257 Ca 0.10 0.90 0.06 0.00 -1.01 0.00 0.00 57.07 57.11 1s7r s TYR 257 Cb 0.17 -2.26 -0.03 0.00 -0.11 0.00 0.00 41.96 39.74 1s7r s TYR 257 CO 0.75 0.61 -0.17 0.95 -1.11 0.00 0.00 175.55 176.58 1s7r s THR 258 N -0.88 1.32 -0.01 -0.71 -4.23 -0.49 -4.64 115.64 105.99 1s7r s THR 258 Ca 0.22 -1.23 0.01 0.00 -1.18 0.00 0.00 61.69 59.50 1s7r s THR 258 Cb -0.16 -1.21 -0.04 0.00 1.34 0.00 0.00 72.50 72.44 1s7r s THR 258 CO 0.11 -0.05 0.02 0.00 -0.54 0.00 0.00 174.62 174.17 1s7r s HIS 260 N -1.10 1.31 -0.15 0.00 3.76 0.17 -1.58 115.29 117.71 1s7r s HIS 260 Ca 0.20 -0.51 0.01 0.00 -0.15 0.00 0.00 55.06 54.61 1s7r s HIS 260 Cb -0.12 -1.02 -0.00 0.00 1.11 0.00 0.00 32.58 32.55 1s7r s HIS 260 CO 0.10 -0.31 -0.16 0.08 -0.85 0.00 0.00 174.74 173.61 1s7r s VAL 261 N 0.94 2.67 -0.17 -0.90 1.01 -0.60 -0.96 120.40 122.39 1s7r s VAL 261 Ca -0.10 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1s7r s VAL 261 Cb -0.15 -2.12 0.00 0.00 0.00 0.00 0.00 36.38 34.12 1s7r s VAL 261 CO 0.00 0.52 -0.16 -0.31 0.00 0.00 0.00 175.10 175.16 1s7r s TYR 262 N 0.69 2.79 0.11 5.22 2.02 0.16 -1.47 117.35 126.88 1s7r s TYR 262 Ca -0.07 -1.17 -0.24 0.00 -0.37 0.00 0.00 57.07 55.21 1s7r s TYR 262 Cb -0.16 -1.91 0.07 0.00 -0.40 0.00 0.00 41.96 39.56 1s7r s TYR 262 CO 0.02 -0.56 0.60 -1.58 -1.57 0.00 0.00 175.55 172.46 1s7r s HIS 263 N 0.98 -0.54 0.27 2.71 2.46 -1.26 -1.48 115.29 118.42 1s7r s HIS 263 Ca -0.02 0.47 -0.01 0.00 0.47 0.00 0.00 55.06 55.97 1s7r s HIS 263 Cb -0.15 0.51 0.48 0.00 -0.13 0.00 0.00 32.58 33.29 1s7r s HIS 263 CO -0.03 -0.79 1.82 1.96 -2.47 0.00 0.00 174.74 175.24 1s7r h GLN 264 N 2.25 0.88 -0.11 2.88 4.20 -1.93 -0.28 115.11 123.00 1s7r h GLN 264 Ca -0.32 -0.05 0.00 0.00 0.06 0.00 0.00 58.65 58.33 1s7r h GLN 264 Cb 1.27 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.85 1s7r h GLN 264 CO 0.39 0.58 0.00 0.41 -0.67 0.00 0.00 178.83 179.54 1s7r n GLY 265 N -1.34 -0.70 2.99 3.46 0.00 -1.26 -4.58 105.19 103.76 1s7r n GLY 265 Ca 0.17 -0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 1s7r n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s7r s LEU 266 N -0.90 4.59 0.40 0.99 1.43 -0.12 -4.57 118.68 120.50 1s7r s LEU 266 Ca 0.01 -3.00 0.23 0.00 -1.03 0.00 0.00 54.13 50.33 1s7r s LEU 266 Cb 0.00 -1.70 1.25 0.00 0.03 0.00 0.00 46.19 45.77 1s7r s LEU 266 CO 0.00 -0.26 1.67 -0.65 0.23 0.00 0.00 176.35 177.35 1s7r h PRO 267 N 6.61 0.22 -4.31 1.29 0.11 -1.81 -3.37 132.00 130.74 1s7r h PRO 267 Ca -0.05 -0.01 -0.39 0.00 0.11 0.00 0.00 66.00 65.66 1s7r h PRO 267 Cb 0.90 -0.05 -0.31 0.00 0.11 0.00 0.00 31.00 31.65 1s7r h PRO 267 CO 0.70 0.15 -0.77 -1.83 -0.21 0.00 0.00 178.00 176.04 1s7r s GLU 268 N -5.45 0.72 0.86 1.05 -1.05 -1.26 -5.13 118.70 108.44 1s7r s GLU 268 Ca -0.09 -0.19 -0.13 0.00 -0.15 0.00 0.00 54.97 54.41 1s7r s GLU 268 Cb 0.29 -0.70 0.07 0.00 -0.44 0.00 0.00 34.13 33.34 1s7r s GLU 268 CO 0.81 0.05 0.87 -2.30 0.95 0.00 0.00 175.26 175.64 1s7r n PRO 269 N 3.42 -0.07 -3.29 -4.83 -0.02 -1.26 -4.97 135.00 123.97 1s7r n PRO 269 Ca -0.19 0.04 -0.35 0.00 -2.02 0.00 0.00 63.50 60.98 1s7r n PRO 269 Cb 0.54 -2.17 -0.06 0.00 -0.02 0.00 0.00 33.50 31.79 1s7r n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1s7r s LEU 270 N -3.79 4.30 -0.09 2.45 1.43 -0.54 -4.86 118.68 117.58 1s7r s LEU 270 Ca 0.66 1.15 -0.01 0.00 -1.03 0.00 0.00 54.13 54.90 1s7r s LEU 270 Cb -0.26 -3.44 0.03 0.00 0.03 0.00 0.00 46.19 42.55 1s7r s LEU 270 CO 0.58 0.05 -0.01 -0.89 0.23 0.00 0.00 176.35 176.31 1s7r s THR 271 N -1.55 0.47 0.02 5.49 2.01 -1.25 -1.56 115.64 119.26 1s7r s THR 271 Ca 0.41 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.44 1s7r s THR 271 Cb -0.15 -0.63 -0.02 0.00 0.01 0.00 0.00 72.50 71.72 1s7r s THR 271 CO 0.20 0.24 -0.02 -1.48 -0.69 0.00 0.00 174.62 172.86 1s7r s LEU 272 N 1.93 2.18 -0.01 4.42 0.05 -0.61 -4.93 118.68 121.71 1s7r s LEU 272 Ca 0.05 -0.38 -0.06 0.00 0.05 0.00 0.00 54.13 53.79 1s7r s LEU 272 Cb -0.13 0.07 -0.02 0.00 -2.05 0.00 0.00 46.19 44.06 1s7r s LEU 272 CO -0.06 -0.22 -0.12 -2.11 -0.55 0.00 0.00 176.35 173.29 1s7r n ARG 273 N 1.97 0.18 -3.64 1.48 1.85 -1.26 0.04 116.66 117.28 1s7r n ARG 273 Ca -0.21 0.07 -0.02 0.00 -1.00 0.00 0.00 57.85 56.69 1s7r n ARG 273 Cb 0.56 -0.79 -0.04 0.00 -1.05 0.00 0.00 32.46 31.14 1s7r n ARG 273 CO 0.00 0.00 0.00 -0.46 -0.01 0.00 0.00 177.63 177.16 1s7r s TRP 274 N -2.21 -0.05 -1.16 2.89 -0.00 -1.26 -4.85 118.94 112.30 1s7r s TRP 274 Ca -0.10 0.09 -0.11 0.00 -0.00 0.00 0.00 56.10 55.98 1s7r s TRP 274 Cb 0.01 0.49 0.23 0.00 -0.00 0.00 0.00 33.47 34.21 1s7r s TRP 274 CO 0.15 -0.05 1.29 -1.91 -0.00 0.00 0.00 176.95 176.42 1s7r n GLU 275 N 0.49 3.52 0.00 5.86 2.13 -1.26 -5.11 120.64 126.27 1s7r n GLU 275 Ca -0.00 -4.19 0.00 0.00 0.66 0.00 0.00 57.16 53.62 1s7r n GLU 275 Cb 0.59 -2.76 0.00 0.00 0.27 0.00 0.00 31.44 29.54 1s7r n GLU 275 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42