#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 3.05 0.32 1.61 0.04 -1.26 -3.64 135.00 135.12 1s7r s PRO 2 Ca 0.00 0.08 0.05 0.00 0.04 0.00 0.00 61.00 61.18 1s7r s PRO 2 Cb 0.00 -2.27 -0.03 0.00 0.04 0.00 0.00 34.50 32.24 1s7r s PRO 2 CO 0.00 -0.62 0.23 -1.01 0.04 0.00 0.00 177.00 175.64 1s7r s HIS 3 N -2.97 1.67 -0.14 0.56 3.76 -0.25 -4.98 115.29 112.94 1s7r s HIS 3 Ca 0.53 -1.56 -0.29 0.00 -0.15 0.00 0.00 55.06 53.59 1s7r s HIS 3 Cb -0.11 -0.76 0.08 0.00 1.11 0.00 0.00 32.58 32.91 1s7r s HIS 3 CO 0.46 -0.75 0.75 -1.54 -0.85 0.00 0.00 174.74 172.81 1s7r s SER 4 N -3.37 -0.64 -0.12 1.40 1.04 -1.26 -0.53 113.70 110.21 1s7r s SER 4 Ca 0.38 0.89 -0.14 0.00 0.48 0.00 0.00 55.95 57.57 1s7r s SER 4 Cb 0.03 0.79 -0.05 0.00 0.10 0.00 0.00 66.02 66.90 1s7r s SER 4 CO 0.23 -0.45 0.33 -0.22 0.98 0.00 0.00 173.24 174.11 1s7r s LEU 5 N -0.66 4.30 -0.09 2.42 2.96 -0.79 -2.31 118.68 124.50 1s7r s LEU 5 Ca -0.06 0.63 -0.02 0.00 -0.22 0.00 0.00 54.13 54.46 1s7r s LEU 5 Cb -0.02 -2.43 0.03 0.00 0.50 0.00 0.00 46.19 44.28 1s7r s LEU 5 CO 0.06 0.15 0.02 -0.13 -1.32 0.00 0.00 176.35 175.13 1s7r s ARG 6 N 0.10 0.49 -0.20 1.98 0.52 0.36 -2.22 118.95 119.98 1s7r s ARG 6 Ca 0.19 0.05 -0.10 0.00 -0.52 0.00 0.00 55.73 55.35 1s7r s ARG 6 Cb -0.14 -1.13 -0.05 0.00 0.52 0.00 0.00 34.95 34.15 1s7r s ARG 6 CO 0.06 -0.38 0.14 0.71 0.02 0.00 0.00 175.30 175.86 1s7r s TYR 7 N 1.99 3.40 -0.41 -0.53 2.02 0.17 0.49 117.35 124.48 1s7r s TYR 7 Ca 0.04 0.34 -0.03 0.00 -0.37 0.00 0.00 57.07 57.05 1s7r s TYR 7 Cb -0.13 -2.18 0.11 0.00 -0.40 0.00 0.00 41.96 39.36 1s7r s TYR 7 CO -0.06 0.26 0.20 -0.06 -1.57 0.00 0.00 175.55 174.33 1s7r s PHE 8 N 0.44 3.59 -0.08 2.71 0.08 0.14 -2.09 117.98 122.77 1s7r s PHE 8 Ca 0.08 -2.42 0.01 0.00 0.12 0.00 0.00 56.93 54.73 1s7r s PHE 8 Cb -0.11 -3.23 -0.03 0.00 -0.57 0.00 0.00 43.02 39.08 1s7r s PHE 8 CO -0.01 -0.97 -0.10 0.54 -0.10 0.00 0.00 175.22 174.57 1s7r s VAL 9 N 1.14 3.37 -0.02 -0.44 0.11 -0.54 -1.21 120.40 122.82 1s7r s VAL 9 Ca 0.08 -0.59 0.04 0.00 -2.93 0.00 0.00 61.98 58.59 1s7r s VAL 9 Cb -0.23 -2.37 -0.01 0.00 -1.53 0.00 0.00 36.38 32.24 1s7r s VAL 9 CO -0.04 0.58 -0.15 -0.89 -3.33 0.00 0.00 175.10 171.26 1s7r s THR 10 N -0.51 1.21 0.09 5.04 2.01 -0.64 -1.31 115.64 121.52 1s7r s THR 10 Ca 0.07 -0.63 0.07 0.00 0.31 0.00 0.00 61.69 61.51 1s7r s THR 10 Cb -0.12 -1.02 -0.03 0.00 0.01 0.00 0.00 72.50 71.34 1s7r s THR 10 CO 0.02 0.35 -0.19 0.00 -0.69 0.00 0.00 174.62 174.11 1s7r s ALA 11 N -0.22 1.58 -0.30 7.40 0.00 -0.45 -1.24 121.76 128.53 1s7r s ALA 11 Ca 0.03 -1.14 -0.04 0.00 0.00 0.00 0.00 51.96 50.81 1s7r s ALA 11 Cb -0.07 -0.21 0.19 0.00 0.00 0.00 0.00 23.12 23.03 1s7r s ALA 11 CO 0.00 0.30 0.76 0.54 0.00 0.00 0.00 175.76 177.36 1s7r s VAL 12 N -1.15 -0.76 0.58 0.00 0.11 -0.65 -1.63 120.40 116.91 1s7r s VAL 12 Ca 0.04 0.00 -0.20 0.00 -2.93 0.00 0.00 61.98 58.89 1s7r s VAL 12 Cb -0.10 -0.96 -0.04 0.00 -1.53 0.00 0.00 36.38 33.76 1s7r s VAL 12 CO 0.03 0.00 1.30 -0.94 -3.33 0.00 0.00 175.10 172.17 1s7r s SER 13 N 2.89 5.11 -0.41 3.54 1.04 -0.68 -1.77 113.70 123.41 1s7r s SER 13 Ca 0.13 2.64 0.06 0.00 0.48 0.00 0.00 55.95 59.26 1s7r s SER 13 Cb -0.12 -2.62 0.20 0.00 0.10 0.00 0.00 66.02 63.58 1s7r s SER 13 CO -0.19 -1.67 0.42 -2.11 0.98 0.00 0.00 173.24 170.67 1s7r n ARG 14 N -1.35 0.47 -1.52 4.02 1.85 -1.26 -4.21 116.66 114.66 1s7r n ARG 14 Ca 0.12 -3.25 -0.46 0.00 -1.00 0.00 0.00 57.85 53.26 1s7r n ARG 14 Cb 0.47 -1.52 -0.02 0.00 -1.05 0.00 0.00 32.46 30.34 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 2.23 0.83 0.00 2.89 -0.02 -1.26 -1.10 135.00 138.58 1s7r n PRO 15 Ca 0.26 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 1s7r n PRO 15 Cb 0.49 -1.54 0.00 0.00 -0.02 0.00 0.00 33.50 32.43 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 1.57 2.98 0.20 -1.23 0.00 -1.26 -4.80 105.19 102.64 1s7r n GLY 16 Ca 0.13 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.24 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 2.19 0.00 0.99 4.77 -0.26 -5.12 117.00 119.57 1s7r n LEU 17 Ca 0.00 -3.02 0.00 0.00 -0.03 0.00 0.00 56.01 52.96 1s7r n LEU 17 Cb 0.00 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 40.69 1s7r n LEU 17 CO 0.00 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.44 1s7r n GLY 18 N -1.25 -1.81 3.71 -0.72 0.00 -1.24 -4.96 105.19 98.93 1s7r n GLY 18 Ca 0.15 -1.94 -0.35 0.00 0.00 0.00 0.00 46.02 43.88 1s7r n GLY 18 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s7r s GLU 19 N 0.00 2.07 1.04 1.61 0.41 -1.26 -4.46 118.70 118.11 1s7r s GLU 19 Ca 0.00 1.88 -0.13 0.00 -0.41 0.00 0.00 54.97 56.32 1s7r s GLU 19 Cb 0.00 -1.81 0.16 0.00 -1.78 0.00 0.00 34.13 30.70 1s7r s GLU 19 CO 0.00 -1.92 0.79 -2.30 -0.49 0.00 0.00 175.26 171.35 1s7r n PRO 20 N -2.66 -1.22 -3.00 0.39 -0.02 -1.26 -4.75 135.00 122.48 1s7r n PRO 20 Ca 0.14 -0.31 -0.41 0.00 -2.02 0.00 0.00 63.50 60.90 1s7r n PRO 20 Cb 0.49 -2.11 -0.05 0.00 -0.02 0.00 0.00 33.50 31.81 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 -4.19 4.25 -0.13 -0.52 6.06 -0.73 -4.91 118.95 118.78 1s7r s ARG 21 Ca 0.64 0.82 0.02 0.00 -2.50 0.00 0.00 55.73 54.70 1s7r s ARG 21 Cb -0.22 -3.58 0.01 0.00 0.06 0.00 0.00 34.95 31.23 1s7r s ARG 21 CO 0.63 -0.29 -0.18 -0.47 -2.50 0.00 0.00 175.30 172.49 1s7r s TYR 22 N 2.07 2.30 0.21 5.12 5.04 -1.26 -1.64 117.35 129.18 1s7r s TYR 22 Ca 0.33 -1.16 0.07 0.00 -2.44 0.00 0.00 57.07 53.88 1s7r s TYR 22 Cb -0.16 -1.62 -0.05 0.00 0.35 0.00 0.00 41.96 40.49 1s7r s TYR 22 CO 0.11 -0.57 -0.13 1.41 -1.34 0.00 0.00 175.55 175.03 1s7r s MET 23 N 1.01 1.33 -0.13 4.97 -2.45 -0.37 -1.42 119.30 122.23 1s7r s MET 23 Ca -0.05 -1.60 -0.06 0.00 -1.25 0.00 0.00 55.69 52.73 1s7r s MET 23 Cb -0.15 -1.07 0.06 0.00 1.25 0.00 0.00 34.83 34.92 1s7r s MET 23 CO -0.04 0.16 0.31 -1.21 1.05 0.00 0.00 175.02 175.29 1s7r s GLU 24 N -3.66 0.25 0.02 4.11 2.02 -0.52 -1.62 118.70 119.30 1s7r s GLU 24 Ca 0.23 0.67 0.05 0.00 0.02 0.00 0.00 54.97 55.94 1s7r s GLU 24 Cb 0.00 -0.05 -0.02 0.00 0.10 0.00 0.00 34.13 34.16 1s7r s GLU 24 CO 0.07 -0.19 -0.16 0.08 0.02 0.00 0.00 175.26 175.08 1s7r s VAL 25 N 1.59 1.26 -0.03 2.63 1.01 -0.35 -0.74 120.40 125.78 1s7r s VAL 25 Ca -0.07 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.02 1s7r s VAL 25 Cb -0.10 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.17 1s7r s VAL 25 CO -0.10 0.16 -0.14 -0.83 0.00 0.00 0.00 175.10 174.18 1s7r s GLY 26 N -0.90 0.75 -0.06 4.51 0.00 0.13 0.25 107.32 112.00 1s7r s GLY 26 Ca 0.04 -0.59 0.01 0.00 0.00 0.00 0.00 44.72 44.18 1s7r s GLY 26 CO 0.01 -0.36 -0.06 -0.19 0.00 0.00 0.00 173.10 172.49 1s7r s TYR 27 N -0.08 0.98 -0.40 1.90 1.51 0.18 -1.03 117.35 120.41 1s7r s TYR 27 Ca 0.00 -0.34 -0.10 0.00 -1.01 0.00 0.00 57.07 55.63 1s7r s TYR 27 Cb -0.08 -0.84 0.06 0.00 -0.11 0.00 0.00 41.96 40.99 1s7r s TYR 27 CO 0.01 -0.26 0.23 0.08 -1.11 0.00 0.00 175.55 174.49 1s7r s VAL 28 N 1.06 4.31 -0.63 0.71 1.01 -0.86 0.14 120.40 126.14 1s7r s VAL 28 Ca -0.08 -1.20 -0.12 0.00 0.00 0.00 0.00 61.98 60.57 1s7r s VAL 28 Cb -0.14 -3.54 0.02 0.00 0.00 0.00 0.00 36.38 32.71 1s7r s VAL 28 CO -0.01 -0.39 0.64 0.47 0.00 0.00 0.00 175.10 175.82 1s7r n ASP 29 N 4.94 -6.65 0.00 3.32 8.00 -0.98 -2.52 116.55 122.66 1s7r n ASP 29 Ca -0.11 -0.16 0.00 0.00 0.71 0.00 0.00 54.79 55.23 1s7r n ASP 29 Cb 0.44 -3.70 0.00 0.00 -0.02 0.00 0.00 41.12 37.84 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 -1.29 -0.68 -4.13 -2.24 8.00 -1.26 -4.87 116.55 110.07 1s7r n ASP 30 Ca -0.07 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.10 1s7r n ASP 30 Cb 0.58 -1.84 -0.14 0.00 -0.02 0.00 0.00 41.12 39.69 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 -1.84 2.58 0.09 -3.53 2.01 -1.05 -5.00 115.64 108.90 1s7r s THR 31 Ca 0.00 -1.46 -0.31 0.00 0.31 0.00 0.00 61.69 60.23 1s7r s THR 31 Cb 0.00 -2.48 -0.09 0.00 0.01 0.00 0.00 72.50 69.94 1s7r s THR 31 CO 0.00 -0.03 1.82 -0.70 -0.69 0.00 0.00 174.62 175.02 1s7r s GLU 32 N 1.19 4.15 0.00 4.92 2.12 -1.26 -2.02 118.70 127.80 1s7r s GLU 32 Ca -0.06 2.53 0.00 0.00 0.36 0.00 0.00 54.97 57.80 1s7r s GLU 32 Cb -0.19 -3.74 0.00 0.00 0.26 0.00 0.00 34.13 30.45 1s7r s GLU 32 CO -0.03 -0.85 0.00 1.97 -0.54 0.00 0.00 175.26 175.81 1s7r n PHE 33 N 6.16 0.00 -3.81 5.30 -1.74 -0.20 -4.49 117.46 118.68 1s7r n PHE 33 Ca 0.18 0.00 -0.12 0.00 -0.56 0.00 0.00 57.45 56.95 1s7r n PHE 33 Cb 0.39 0.00 -0.09 0.00 1.52 0.00 0.00 39.48 41.31 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 -1.06 0.08 -0.08 1.97 -7.23 -0.95 -1.83 120.40 111.31 1s7r s VAL 34 Ca 0.00 -0.65 -0.12 0.00 -1.81 0.00 0.00 61.98 59.40 1s7r s VAL 34 Cb 0.00 -0.64 0.03 0.00 0.56 0.00 0.00 36.38 36.33 1s7r s VAL 34 CO 0.00 -0.36 0.31 -0.60 -0.31 0.00 0.00 175.10 174.15 1s7r s ARG 35 N -1.69 0.49 0.01 4.82 3.52 -1.12 0.18 118.95 125.16 1s7r s ARG 35 Ca -0.12 0.19 0.00 0.00 -0.13 0.00 0.00 55.73 55.67 1s7r s ARG 35 Cb -0.05 0.23 -0.01 0.00 -1.56 0.00 0.00 34.95 33.56 1s7r s ARG 35 CO 0.01 -0.10 -0.02 0.12 -0.81 0.00 0.00 175.30 174.51 1s7r s PHE 36 N -0.42 0.15 -0.29 5.12 5.36 0.08 -1.73 117.98 126.25 1s7r s PHE 36 Ca -0.05 -0.23 0.01 0.00 -0.96 0.00 0.00 56.93 55.70 1s7r s PHE 36 Cb -0.04 -0.10 0.18 0.00 -0.34 0.00 0.00 43.02 42.72 1s7r s PHE 36 CO 0.02 -0.08 0.53 0.34 -1.46 0.00 0.00 175.22 174.57 1s7r s ASP 37 N -0.62 -0.94 0.00 6.13 -1.08 -1.26 -1.44 116.67 117.46 1s7r s ASP 37 Ca -0.06 0.40 0.06 0.00 -0.52 0.00 0.00 52.55 52.42 1s7r s ASP 37 Cb -0.04 1.81 0.32 0.00 -1.46 0.00 0.00 42.92 43.54 1s7r s ASP 37 CO -0.00 -0.29 0.88 -1.54 0.52 0.00 0.00 175.17 174.74 1s7r n SER 38 N 5.41 0.00 -1.10 -0.34 3.41 -0.51 -0.58 113.62 119.91 1s7r n SER 38 Ca 0.00 -0.04 0.12 0.00 -0.26 0.00 0.00 58.87 58.69 1s7r n SER 38 Cb 0.51 -0.10 0.18 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 -1.10 3.33 -4.67 4.04 9.92 -1.26 -4.89 116.55 121.92 1s7r n ASP 39 Ca 0.04 -2.00 -0.29 0.00 -0.53 0.00 0.00 54.79 52.01 1s7r n ASP 39 Cb 0.03 -0.17 0.18 0.00 -0.64 0.00 0.00 41.12 40.52 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 -1.65 0.89 0.08 2.24 0.00 0.26 -4.94 121.76 118.64 1s7r s ALA 40 Ca 0.35 -0.33 -0.29 0.00 0.00 0.00 0.00 51.96 51.70 1s7r s ALA 40 Cb 0.22 -3.13 -0.17 0.00 0.00 0.00 0.00 23.12 20.04 1s7r s ALA 40 CO 0.31 -2.88 1.67 0.93 0.00 0.00 0.00 175.76 175.79 1s7r h GLU 41 N -1.93 -0.51 -3.16 0.00 5.08 -1.94 -3.37 114.58 108.75 1s7r h GLU 41 Ca -0.55 0.03 -0.62 0.00 -1.00 0.00 0.00 59.36 57.22 1s7r h GLU 41 Cb 1.33 0.12 -0.41 0.00 0.50 0.00 0.00 28.75 30.29 1s7r h GLU 41 CO 0.57 -0.34 -0.68 1.21 -1.00 0.00 0.00 179.01 178.77 1s7r s ASN 42 N -4.73 4.00 -0.33 1.42 3.04 -1.26 -5.07 114.94 112.01 1s7r s ASN 42 Ca -0.16 -2.93 -0.28 0.00 0.04 0.00 0.00 52.86 49.54 1s7r s ASN 42 Cb 0.05 -1.35 -0.04 0.00 -1.54 0.00 0.00 41.25 38.37 1s7r s ASN 42 CO 0.64 -0.23 2.05 -2.16 -3.04 0.00 0.00 177.10 174.36 1s7r s PRO 43 N -0.12 3.02 -0.16 0.43 0.04 -1.26 -4.92 135.00 132.03 1s7r s PRO 43 Ca 0.18 1.59 -0.12 0.00 0.04 0.00 0.00 61.00 62.69 1s7r s PRO 43 Cb -0.22 -4.34 0.05 0.00 0.04 0.00 0.00 34.50 30.03 1s7r s PRO 43 CO -0.02 -2.23 0.41 -0.98 0.04 0.00 0.00 177.00 174.23 1s7r s ARG 44 N 6.41 0.45 -0.01 4.56 1.70 -1.26 -5.00 118.95 125.79 1s7r s ARG 44 Ca 0.89 0.65 -0.37 0.00 -0.47 0.00 0.00 55.73 56.44 1s7r s ARG 44 Cb -0.25 0.14 -0.16 0.00 -0.57 0.00 0.00 34.95 34.11 1s7r s ARG 44 CO 0.32 -0.09 1.52 0.66 -1.08 0.00 0.00 175.30 176.63 1s7r n TYR 45 N 3.38 1.83 -4.21 5.89 4.02 -1.26 -4.78 117.16 122.03 1s7r n TYR 45 Ca -0.17 0.50 -0.19 0.00 -0.01 0.00 0.00 57.90 58.03 1s7r n TYR 45 Cb 0.56 -2.42 -0.12 0.00 -0.02 0.00 0.00 39.34 37.34 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 1.62 0.88 0.47 -0.72 -1.05 -0.70 -4.91 118.70 114.29 1s7r s GLU 46 Ca 0.88 -0.97 -0.22 0.00 -0.15 0.00 0.00 54.97 54.51 1s7r s GLU 46 Cb -0.92 -0.93 -0.07 0.00 -0.44 0.00 0.00 34.13 31.77 1s7r s GLU 46 CO 0.51 0.21 1.14 -1.25 0.95 0.00 0.00 175.26 176.82 1s7r s PRO 47 N -1.70 3.74 -0.11 -4.83 0.04 -1.26 -2.81 135.00 128.06 1s7r s PRO 47 Ca -0.00 1.71 0.15 0.00 0.04 0.00 0.00 61.00 62.89 1s7r s PRO 47 Cb -0.10 -2.34 0.26 0.00 0.04 0.00 0.00 34.50 32.36 1s7r s PRO 47 CO 0.02 -0.55 1.13 0.54 0.04 0.00 0.00 177.00 178.18 1s7r n ARG 48 N -0.59 1.06 -3.64 4.56 5.12 -0.76 -4.89 116.66 117.51 1s7r n ARG 48 Ca 0.08 -2.37 -0.03 0.00 -1.93 0.00 0.00 57.85 53.60 1s7r n ARG 48 Cb 0.49 -1.30 -0.07 0.00 -1.16 0.00 0.00 32.46 30.42 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 -2.35 -2.26 0.26 7.54 0.00 -1.26 -4.55 121.76 119.14 1s7r s ALA 49 Ca 0.27 2.14 -0.02 0.00 0.00 0.00 0.00 51.96 54.35 1s7r s ALA 49 Cb 0.24 -1.70 0.50 0.00 0.00 0.00 0.00 23.12 22.17 1s7r s ALA 49 CO 0.01 -0.32 1.77 0.00 0.00 0.00 0.00 175.76 177.21 1s7r h ARG 50 N 5.70 0.62 0.00 0.00 3.08 -1.96 0.48 114.38 122.31 1s7r h ARG 50 Ca -0.28 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.73 1s7r h ARG 50 Cb 1.19 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 31.10 1s7r h ARG 50 CO 0.19 0.41 0.00 -2.67 -1.07 0.00 0.00 179.97 176.83 1s7r n TRP 51 N -4.85 0.69 1.13 3.04 4.27 -1.26 -1.24 117.44 119.21 1s7r n TRP 51 Ca 0.16 0.35 0.12 0.00 -3.89 0.00 0.00 57.50 54.24 1s7r n TRP 51 Cb 0.40 -1.05 0.28 0.00 -1.36 0.00 0.00 31.31 29.58 1s7r n TRP 51 CO 0.00 0.00 0.00 -1.33 -2.29 0.00 0.00 177.69 174.07 1s7r n MET 52 N -2.20 0.51 -0.09 -2.67 2.81 0.16 -3.73 117.12 111.91 1s7r n MET 52 Ca -0.01 -0.32 -0.07 0.00 -1.81 0.00 0.00 57.70 55.49 1s7r n MET 52 Cb 0.06 -1.49 0.10 0.00 -0.71 0.00 0.00 33.22 31.18 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 0.78 0.78 -0.94 0.03 5.08 -1.20 -3.18 114.58 115.94 1s7r h GLU 53 Ca 0.00 -0.30 0.18 0.00 -1.00 0.00 0.00 59.36 58.24 1s7r h GLU 53 Cb 0.52 -0.05 -0.17 0.00 0.50 0.00 0.00 28.75 29.55 1s7r h GLU 53 CO 0.00 0.91 -0.27 1.04 -1.00 0.00 0.00 179.01 179.69 1s7r n GLN 54 N -4.13 -0.12 -1.58 2.33 6.02 -1.24 -4.50 117.38 114.16 1s7r n GLN 54 Ca 0.01 1.45 -0.46 0.00 -0.01 0.00 0.00 57.00 57.99 1s7r n GLN 54 Cb 0.41 -2.17 -0.02 0.00 1.02 0.00 0.00 30.24 29.48 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 -5.48 1.26 -2.05 -1.09 -0.58 -1.20 -4.97 120.64 106.52 1s7r n GLU 55 Ca 0.13 0.44 -0.29 0.00 -0.42 0.00 0.00 57.16 57.03 1s7r n GLU 55 Cb 0.44 -1.83 0.19 0.00 -0.57 0.00 0.00 31.44 29.68 1s7r n GLU 55 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1s7r s GLY 56 N -0.45 1.81 0.23 0.62 0.00 -1.26 -4.95 107.32 103.31 1s7r s GLY 56 Ca 0.62 -1.41 -0.07 0.00 0.00 0.00 0.00 44.72 43.86 1s7r s GLY 56 CO 0.58 -0.61 1.78 -2.55 0.00 0.00 0.00 173.10 172.29 1s7r h PRO 57 N -1.57 0.58 -0.41 2.90 0.11 -1.95 -2.62 132.00 129.05 1s7r h PRO 57 Ca -0.42 -0.03 0.08 0.00 0.11 0.00 0.00 66.00 65.73 1s7r h PRO 57 Cb 1.22 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 32.13 1s7r h PRO 57 CO 0.33 0.38 -0.01 1.49 -0.21 0.00 0.00 178.00 179.99 1s7r h GLU 58 N 0.60 0.09 0.15 1.05 4.81 -2.00 -2.74 114.58 116.55 1s7r h GLU 58 Ca 0.35 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.59 1s7r h GLU 58 Cb 0.38 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.69 1s7r h GLU 58 CO -0.27 0.06 -0.42 -0.92 -0.73 0.00 0.00 179.01 176.72 1s7r h TYR 59 N 0.10 -1.19 -0.13 0.92 5.03 -1.84 -2.13 116.97 117.72 1s7r h TYR 59 Ca 0.20 0.03 0.04 0.00 2.58 0.00 0.00 58.73 61.58 1s7r h TYR 59 Cb 0.29 0.50 -0.01 0.00 1.55 0.00 0.00 36.73 39.06 1s7r h TYR 59 CO -0.28 -0.53 0.16 -1.49 -1.32 0.00 0.00 178.16 174.70 1s7r h TRP 60 N -0.68 0.00 0.09 -3.82 4.06 -1.54 0.05 115.95 114.12 1s7r h TRP 60 Ca 0.01 0.00 -0.29 0.00 2.06 0.00 0.00 58.89 60.67 1s7r h TRP 60 Cb 0.69 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.84 1s7r h TRP 60 CO -0.35 0.00 -1.49 1.49 -3.56 0.00 0.00 178.44 174.53 1s7r h GLU 61 N 0.00 0.18 -0.14 0.49 4.57 -1.17 -2.75 114.58 115.76 1s7r h GLU 61 Ca 0.06 -0.31 -0.04 0.00 -1.18 0.00 0.00 59.36 57.89 1s7r h GLU 61 Cb 0.39 0.12 -0.00 0.00 -0.16 0.00 0.00 28.75 29.09 1s7r h GLU 61 CO -0.00 1.02 -0.08 0.00 -1.18 0.00 0.00 179.01 178.77 1s7r h ARG 62 N 0.05 0.30 -0.61 1.92 3.08 -0.40 -1.54 114.38 117.19 1s7r h ARG 62 Ca -0.22 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 59.69 1s7r h ARG 62 Cb 1.98 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 32.00 1s7r h ARG 62 CO 0.15 0.64 0.35 0.93 -1.07 0.00 0.00 179.97 180.97 1s7r h GLU 63 N -0.04 0.84 0.00 0.04 4.39 -1.34 -1.24 114.58 117.23 1s7r h GLU 63 Ca 0.03 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 59.62 1s7r h GLU 63 Cb 0.55 -0.17 -0.00 0.00 -0.10 0.00 0.00 28.75 29.03 1s7r h GLU 63 CO 0.02 0.62 -0.10 1.15 -1.16 0.00 0.00 179.01 179.54 1s7r h THR 64 N 0.83 0.47 0.00 1.13 2.02 -1.43 -0.01 112.91 115.92 1s7r h THR 64 Ca 0.22 -0.49 -0.09 0.00 0.77 0.00 0.00 66.41 66.81 1s7r h THR 64 Cb 0.01 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 1s7r h THR 64 CO -0.04 0.10 -0.60 1.56 0.37 0.00 0.00 175.52 176.91 1s7r h GLN 65 N 0.00 0.00 -0.01 6.66 1.08 -0.80 -2.89 115.11 119.16 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 0.33 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.76 1s7r h GLN 65 CO 0.01 0.66 0.09 1.57 -0.95 0.00 0.00 178.83 180.21 1s7r h LYS 66 N -1.00 0.00 0.13 1.46 2.10 -1.15 0.29 116.57 118.40 1s7r h LYS 66 Ca -0.14 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.50 1s7r h LYS 66 Cb 0.88 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.21 1s7r h LYS 66 CO -0.08 0.00 -0.06 0.00 -2.00 0.00 0.00 179.45 177.30 1s7r h ALA 67 N 1.82 -0.17 -0.37 0.07 0.00 -1.11 -2.18 119.26 117.32 1s7r h ALA 67 Ca 0.00 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.71 1s7r h ALA 67 Cb 0.19 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1s7r h ALA 67 CO -0.00 -0.32 0.25 0.87 0.00 0.00 0.00 179.25 180.05 1s7r h LYS 68 N -0.72 0.37 -0.08 0.00 1.79 -0.35 0.33 116.57 117.89 1s7r h LYS 68 Ca -0.02 -0.02 -0.03 0.00 -2.18 0.00 0.00 60.65 58.40 1s7r h LYS 68 Cb 0.53 -0.08 -0.00 0.00 -1.58 0.00 0.00 32.23 31.09 1s7r h LYS 68 CO 0.03 0.24 -0.06 0.78 -1.08 0.00 0.00 179.45 179.36 1s7r h GLY 69 N 0.38 0.20 0.45 3.86 0.00 -0.72 -2.77 103.07 104.48 1s7r h GLY 69 Ca 0.15 -0.19 0.08 0.00 0.00 0.00 0.00 47.33 47.37 1s7r h GLY 69 CO -0.03 0.18 0.23 3.43 0.00 0.00 0.00 176.54 180.34 1s7r h ASN 70 N -0.20 0.24 -0.43 0.19 2.35 -0.90 -1.56 115.58 115.26 1s7r h ASN 70 Ca 0.02 0.07 0.09 0.00 -0.55 0.00 0.00 56.30 55.92 1s7r h ASN 70 Cb 0.53 0.04 -0.09 0.00 0.05 0.00 0.00 38.32 38.86 1s7r h ASN 70 CO 0.02 0.15 -0.14 -0.08 -1.65 0.00 0.00 177.43 175.73 1s7r h GLU 71 N 0.42 -0.04 -0.41 0.81 4.81 -0.97 -0.01 114.58 119.19 1s7r h GLU 71 Ca 0.29 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.48 1s7r h GLU 71 Cb 0.33 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.69 1s7r h GLU 71 CO -0.28 -0.03 0.07 1.96 -0.73 0.00 0.00 179.01 180.01 1s7r h GLN 72 N -0.04 0.62 -0.55 1.92 1.08 -1.13 -2.02 115.11 114.99 1s7r h GLN 72 Ca 0.21 -0.12 -0.11 0.00 -1.45 0.00 0.00 58.65 57.19 1s7r h GLN 72 Cb 0.36 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.67 1s7r h GLN 72 CO -0.47 0.58 -0.07 1.03 -0.95 0.00 0.00 178.83 178.95 1s7r h SER 73 N 0.60 1.00 1.45 1.46 0.87 -0.17 -2.48 113.55 116.28 1s7r h SER 73 Ca 0.13 -0.31 -0.08 0.00 -1.23 0.00 0.00 61.79 60.30 1s7r h SER 73 Cb 0.27 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 1s7r h SER 73 CO 0.00 1.09 -0.39 -0.26 -0.53 0.00 0.00 176.83 176.74 1s7r h PHE 74 N 0.90 0.00 -0.37 2.24 0.04 -0.76 0.23 116.94 119.22 1s7r h PHE 74 Ca 0.15 0.00 0.04 0.00 2.80 0.00 0.00 57.97 60.96 1s7r h PHE 74 Cb 0.62 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.73 1s7r h PHE 74 CO 0.04 0.39 0.13 0.00 -0.60 0.00 0.00 178.31 178.27 1s7r h ARG 75 N 0.00 0.28 -0.05 1.51 -0.00 -1.07 -0.12 114.38 114.93 1s7r h ARG 75 Ca -0.00 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.98 59.45 1s7r h ARG 75 Cb 1.22 -0.06 -0.00 0.00 0.00 0.00 0.00 29.97 31.12 1s7r h ARG 75 CO 0.05 0.19 0.00 0.28 0.00 0.00 0.00 179.97 180.49 1s7r h VAL 76 N 0.29 1.23 -1.01 2.04 2.07 -0.99 -2.82 116.25 117.06 1s7r h VAL 76 Ca 0.17 -0.71 0.23 0.00 0.82 0.00 0.00 66.70 67.22 1s7r h VAL 76 Cb 0.15 1.62 -0.11 0.00 -1.52 0.00 0.00 31.29 31.42 1s7r h VAL 76 CO -0.17 0.19 0.62 0.44 0.02 0.00 0.00 177.57 178.68 1s7r h ASP 77 N -0.19 0.62 -0.29 0.57 3.32 -0.35 -1.71 116.42 118.39 1s7r h ASP 77 Ca 0.01 0.10 -0.18 0.00 0.02 0.00 0.00 57.03 56.99 1s7r h ASP 77 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1s7r h ASP 77 CO 0.00 0.15 -0.53 -0.07 -1.72 0.00 0.00 179.24 177.07 1s7r h LEU 78 N 0.56 0.97 -0.79 1.55 3.38 -0.78 -1.62 115.31 118.59 1s7r h LEU 78 Ca 0.60 -0.53 -0.09 0.00 0.09 0.00 0.00 57.88 57.95 1s7r h LEU 78 Cb 1.22 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.68 1s7r h LEU 78 CO -0.38 1.31 -0.04 -0.09 0.09 0.00 0.00 178.44 179.34 1s7r h ARG 79 N 0.65 0.88 -0.47 1.13 2.43 -1.21 -3.05 114.38 114.75 1s7r h ARG 79 Ca 0.02 -0.27 -0.08 0.00 -0.81 0.00 0.00 59.98 58.84 1s7r h ARG 79 Cb 1.14 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.58 1s7r h ARG 79 CO 0.12 0.90 -0.01 1.15 -1.51 0.00 0.00 179.97 180.61 1s7r h THR 80 N 0.81 1.26 0.00 0.20 2.02 -1.09 -2.18 112.91 113.93 1s7r h THR 80 Ca 0.15 -1.08 -0.03 0.00 0.77 0.00 0.00 66.41 66.21 1s7r h THR 80 Cb 0.53 1.02 -0.00 0.00 -1.74 0.00 0.00 68.15 67.96 1s7r h THR 80 CO 0.03 0.38 -0.13 -0.07 0.37 0.00 0.00 175.52 176.09 1s7r h LEU 81 N 0.69 0.00 -0.48 2.58 4.07 -1.33 -1.38 115.31 119.46 1s7r h LEU 81 Ca 0.13 0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.10 1s7r h LEU 81 Cb 0.53 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.24 1s7r h LEU 81 CO 0.03 0.13 0.32 -0.07 -1.08 0.00 0.00 178.44 177.77 1s7r h LEU 82 N 0.00 0.55 -0.07 1.67 3.38 -1.28 -1.03 115.31 118.53 1s7r h LEU 82 Ca -0.00 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1s7r h LEU 82 Cb 0.60 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1s7r h LEU 82 CO 0.02 0.39 -0.12 1.23 0.09 0.00 0.00 178.44 180.05 1s7r h GLY 83 N 0.65 0.23 0.12 0.83 0.00 -1.24 0.50 103.07 104.16 1s7r h GLY 83 Ca 0.18 -0.26 0.05 0.00 0.00 0.00 0.00 47.33 47.30 1s7r h GLY 83 CO -0.04 0.24 -0.32 -0.97 0.00 0.00 0.00 176.54 175.44 1s7r h TYR 84 N -0.26 -0.89 -0.09 5.60 0.05 -1.11 -1.10 116.97 119.17 1s7r h TYR 84 Ca 0.01 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.83 1s7r h TYR 84 Cb 0.68 0.41 0.00 0.00 1.01 0.00 0.00 36.73 38.84 1s7r h TYR 84 CO 0.11 -0.40 0.00 0.66 -1.05 0.00 0.00 178.16 177.48 1s7r n TYR 85 N -5.41 0.18 -4.42 4.88 4.01 -0.40 -4.91 117.16 111.10 1s7r n TYR 85 Ca -0.03 -0.08 -0.36 0.00 -0.16 0.00 0.00 57.90 57.27 1s7r n TYR 85 Cb 0.33 -0.05 -0.09 0.00 -0.31 0.00 0.00 39.34 39.22 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 -0.11 -0.35 -4.90 7.72 4.13 -0.42 -4.94 115.26 116.39 1s7r n ASN 86 Ca 0.04 -1.26 -0.30 0.00 1.68 0.00 0.00 54.58 54.74 1s7r n ASN 86 Cb 0.18 -1.59 -0.04 0.00 -1.54 0.00 0.00 39.78 36.79 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 -7.30 3.62 0.24 3.52 -0.21 0.17 -5.00 119.66 114.70 1s7r s GLN 87 Ca 0.39 -0.09 -0.21 0.00 0.02 0.00 0.00 55.36 55.48 1s7r s GLN 87 Cb -0.23 -2.79 -0.09 0.00 1.00 0.00 0.00 33.01 30.91 1s7r s GLN 87 CO 1.01 0.39 0.77 -1.54 -2.12 0.00 0.00 175.29 173.79 1s7r s SER 88 N -2.72 7.12 0.60 5.90 1.04 -1.26 -4.57 113.70 119.81 1s7r s SER 88 Ca 0.42 1.50 0.25 0.00 0.48 0.00 0.00 55.95 58.60 1s7r s SER 88 Cb -0.12 -2.45 1.36 0.00 0.10 0.00 0.00 66.02 64.92 1s7r s SER 88 CO 0.26 0.02 1.75 0.11 0.98 0.00 0.00 173.24 176.36 1s7r h LYS 89 N 3.40 0.00 -0.00 4.02 1.79 -1.98 -3.16 116.57 120.64 1s7r h LYS 89 Ca -0.48 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 57.99 1s7r h LYS 89 Cb 1.19 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 1s7r h LYS 89 CO 0.65 0.00 -0.10 0.41 -1.08 0.00 0.00 179.45 179.33 1s7r n GLY 90 N -1.25 -0.93 3.91 3.86 0.00 -1.26 -4.86 105.19 104.65 1s7r n GLY 90 Ca -0.02 -0.26 -0.20 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 -2.45 1.72 -0.23 -0.02 0.00 -1.20 -4.85 107.32 100.31 1s7r s GLY 91 Ca 0.30 -1.59 -0.11 0.00 0.00 0.00 0.00 44.72 43.32 1s7r s GLY 91 CO 0.47 -1.51 0.19 -0.45 0.00 0.00 0.00 173.10 171.80 1s7r s SER 92 N -4.07 6.18 0.19 1.64 0.15 -1.26 -4.63 113.70 111.90 1s7r s SER 92 Ca 0.43 0.20 0.10 0.00 0.70 0.00 0.00 55.95 57.37 1s7r s SER 92 Cb -0.07 -2.12 -0.04 0.00 -1.71 0.00 0.00 66.02 62.07 1s7r s SER 92 CO 0.28 0.07 -0.21 -1.00 1.20 0.00 0.00 173.24 173.59 1s7r s HIS 93 N 0.95 2.06 -0.08 3.44 4.02 -1.26 -4.95 115.29 119.47 1s7r s HIS 93 Ca 0.09 -0.41 0.05 0.00 1.02 0.00 0.00 55.06 55.81 1s7r s HIS 93 Cb -0.13 -1.01 -0.01 0.00 -1.02 0.00 0.00 32.58 30.42 1s7r s HIS 93 CO 0.04 0.45 -0.25 0.99 1.02 0.00 0.00 174.74 176.99 1s7r s THR 94 N -1.98 2.05 0.02 1.30 2.01 -1.26 -1.68 115.64 116.09 1s7r s THR 94 Ca 0.20 -1.04 0.02 0.00 0.31 0.00 0.00 61.69 61.17 1s7r s THR 94 Cb -0.06 -1.75 -0.04 0.00 0.01 0.00 0.00 72.50 70.66 1s7r s THR 94 CO 0.09 0.56 0.01 -0.63 -0.69 0.00 0.00 174.62 173.96 1s7r s ILE 95 N 0.06 4.18 -0.01 1.82 1.01 -0.64 -0.41 121.20 127.21 1s7r s ILE 95 Ca -0.10 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 59.90 1s7r s ILE 95 Cb -0.16 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.42 1s7r s ILE 95 CO 0.06 0.32 -0.04 -1.10 0.00 0.00 0.00 174.94 174.18 1s7r s GLN 96 N -1.73 0.37 -0.06 2.79 -0.21 -0.62 -1.35 119.66 118.85 1s7r s GLN 96 Ca 0.21 -0.12 0.02 0.00 0.02 0.00 0.00 55.36 55.50 1s7r s GLN 96 Cb -0.12 -0.39 0.01 0.00 1.00 0.00 0.00 33.01 33.52 1s7r s GLN 96 CO 0.12 0.05 -0.10 0.08 -2.12 0.00 0.00 175.29 173.32 1s7r s VAL 97 N 0.13 0.96 -0.18 1.09 1.01 -0.43 -1.52 120.40 121.46 1s7r s VAL 97 Ca -0.01 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 61.57 1s7r s VAL 97 Cb -0.04 -0.89 -0.01 0.00 0.00 0.00 0.00 36.38 35.44 1s7r s VAL 97 CO -0.00 0.31 -0.10 -0.51 0.00 0.00 0.00 175.10 174.80 1s7r s ILE 98 N 0.69 3.03 -0.02 2.22 -1.16 -0.13 -1.46 121.20 124.36 1s7r s ILE 98 Ca -0.13 -0.63 -0.05 0.00 -0.51 0.00 0.00 60.65 59.33 1s7r s ILE 98 Cb -0.15 -2.33 0.00 0.00 0.61 0.00 0.00 42.46 40.59 1s7r s ILE 98 CO 0.03 0.48 0.12 -0.55 -2.81 0.00 0.00 174.94 172.20 1s7r s SER 99 N 1.06 -0.03 0.00 4.50 0.15 -0.89 0.99 113.70 119.49 1s7r s SER 99 Ca 0.00 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.63 1s7r s SER 99 Cb -0.15 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.39 1s7r s SER 99 CO -0.02 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.81 1s7r n GLY 100 N 2.17 -1.22 3.24 9.45 0.00 -0.73 0.43 105.19 118.53 1s7r n GLY 100 Ca -0.18 -1.27 -0.13 0.00 0.00 0.00 0.00 46.02 44.44 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 0.07 3.46 0.19 0.00 -1.05 0.35 -1.89 118.70 119.83 1s7r s GLU 102 Ca -0.01 -0.52 0.03 0.00 -0.15 0.00 0.00 54.97 54.32 1s7r s GLU 102 Cb -0.03 -2.94 -0.05 0.00 -0.44 0.00 0.00 34.13 30.68 1s7r s GLU 102 CO 0.01 0.50 -0.03 0.14 0.95 0.00 0.00 175.26 176.82 1s7r s VAL 103 N -1.76 0.96 0.80 1.83 -7.23 0.31 -2.07 120.40 113.25 1s7r s VAL 103 Ca 0.36 -2.02 -0.04 0.00 -1.81 0.00 0.00 61.98 58.46 1s7r s VAL 103 Cb -0.11 -2.13 0.17 0.00 0.56 0.00 0.00 36.38 34.87 1s7r s VAL 103 CO 0.29 -0.50 1.10 -0.83 -0.31 0.00 0.00 175.10 174.85 1s7r s GLY 104 N -3.22 1.76 0.44 2.32 0.00 -0.68 -1.09 107.32 106.84 1s7r s GLY 104 Ca 0.24 -1.77 0.24 0.00 0.00 0.00 0.00 44.72 43.43 1s7r s GLY 104 CO 0.05 -1.09 1.79 1.48 0.00 0.00 0.00 173.10 175.33 1s7r h SER 105 N -0.87 0.00 0.35 1.64 4.64 -1.90 0.12 113.55 117.54 1s7r h SER 105 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1s7r h SER 105 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1s7r h SER 105 CO 0.35 0.20 0.00 -0.90 -0.87 0.00 0.00 176.83 175.62 1s7r n ASP 106 N -3.31 0.00 0.00 4.97 5.75 -1.26 -4.88 116.55 117.82 1s7r n ASP 106 Ca 0.01 0.06 0.00 0.00 -0.01 0.00 0.00 54.79 54.85 1s7r n ASP 106 Cb 0.45 -0.30 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 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 0.22 0.70 3.85 6.12 0.00 0.43 -5.03 105.19 111.49 1s7r n GLY 107 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.07 3.98 0.03 1.61 0.52 -1.25 -4.76 118.95 119.01 1s7r s ARG 108 Ca 0.00 0.70 -0.37 0.00 -0.52 0.00 0.00 55.73 55.55 1s7r s ARG 108 Cb 0.00 -2.37 -0.16 0.00 0.52 0.00 0.00 34.95 32.94 1s7r s ARG 108 CO 0.00 0.06 1.48 -0.11 0.02 0.00 0.00 175.30 176.75 1s7r n LEU 109 N -0.69 2.12 -0.06 2.53 7.94 -1.26 -1.69 117.00 125.89 1s7r n LEU 109 Ca 0.04 1.10 -0.05 0.00 -1.11 0.00 0.00 56.01 55.99 1s7r n LEU 109 Cb 0.53 -1.23 -0.11 0.00 0.53 0.00 0.00 43.42 43.15 1s7r n LEU 109 CO 0.42 -0.76 -0.90 -0.11 -1.11 0.00 0.00 177.39 174.94 1s7r n LEU 110 N 3.38 0.00 0.00 -1.96 7.94 -0.88 -4.77 117.00 120.71 1s7r n LEU 110 Ca 0.20 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.10 1s7r n LEU 110 Cb 0.20 0.28 0.00 0.00 0.53 0.00 0.00 43.42 44.44 1s7r n LEU 110 CO 0.66 0.28 0.00 -1.14 -1.11 0.00 0.00 177.39 176.08 1s7r n ARG 111 N -2.42 0.00 -4.31 1.96 0.63 -1.11 -4.98 116.66 106.43 1s7r n ARG 111 Ca -0.19 0.00 -0.16 0.00 -0.92 0.00 0.00 57.85 56.58 1s7r n ARG 111 Cb 0.86 0.00 -0.10 0.00 0.45 0.00 0.00 32.46 33.66 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 1.56 -0.24 5.14 0.00 -1.26 -0.50 107.32 112.01 1s7r s GLY 112 Ca 0.00 -1.77 -0.32 0.00 0.00 0.00 0.00 44.72 42.63 1s7r s GLY 112 CO 0.00 -1.62 1.27 -2.52 0.00 0.00 0.00 173.10 170.24 1s7r s TYR 113 N -3.58 -0.11 -0.20 1.90 -0.85 -0.88 -4.87 117.35 108.76 1s7r s TYR 113 Ca 0.31 0.14 -0.07 0.00 -0.52 0.00 0.00 57.07 56.93 1s7r s TYR 113 Cb 0.07 0.49 0.09 0.00 0.38 0.00 0.00 41.96 42.99 1s7r s TYR 113 CO 0.09 -0.12 0.42 -1.14 -1.52 0.00 0.00 175.55 173.28 1s7r s GLN 114 N -1.50 0.32 -0.03 -3.49 0.74 -1.25 -1.77 119.66 112.69 1s7r s GLN 114 Ca 0.08 1.01 0.05 0.00 0.05 0.00 0.00 55.36 56.56 1s7r s GLN 114 Cb -0.01 0.30 -0.01 0.00 1.10 0.00 0.00 33.01 34.39 1s7r s GLN 114 CO -0.05 -0.27 -0.19 -0.65 -0.55 0.00 0.00 175.29 173.58 1s7r s GLN 115 N 2.61 1.73 0.09 1.67 -0.21 0.28 -2.56 119.66 123.27 1s7r s GLN 115 Ca -0.01 -0.68 0.09 0.00 0.02 0.00 0.00 55.36 54.78 1s7r s GLN 115 Cb -0.12 -1.58 -0.04 0.00 1.00 0.00 0.00 33.01 32.27 1s7r s GLN 115 CO -0.13 0.35 -0.21 0.71 -2.12 0.00 0.00 175.29 173.90 1s7r s TYR 116 N -0.25 2.47 0.03 0.91 1.51 -0.03 -0.96 117.35 121.03 1s7r s TYR 116 Ca 0.03 -0.30 -0.04 0.00 -1.01 0.00 0.00 57.07 55.74 1s7r s TYR 116 Cb -0.09 -1.36 -0.01 0.00 -0.11 0.00 0.00 41.96 40.38 1s7r s TYR 116 CO 0.01 0.31 0.07 0.00 -1.11 0.00 0.00 175.55 174.83 1s7r s ALA 117 N -1.03 -0.00 -0.01 3.71 0.00 -0.58 -1.06 121.76 122.79 1s7r s ALA 117 Ca 0.16 -0.59 0.02 0.00 0.00 0.00 0.00 51.96 51.54 1s7r s ALA 117 Cb -0.10 0.23 -0.00 0.00 0.00 0.00 0.00 23.12 23.24 1s7r s ALA 117 CO 0.07 -0.29 -0.07 -0.47 0.00 0.00 0.00 175.76 175.00 1s7r s TYR 118 N -2.49 0.69 -1.58 0.00 5.04 -0.06 -1.60 117.35 117.35 1s7r s TYR 118 Ca -0.06 -0.14 -0.20 0.00 -2.44 0.00 0.00 57.07 54.23 1s7r s TYR 118 Cb -0.02 -0.48 0.20 0.00 0.35 0.00 0.00 41.96 42.01 1s7r s TYR 118 CO -0.04 -0.04 0.50 -0.25 -1.34 0.00 0.00 175.55 174.38 1s7r n ASP 119 N 3.10 -1.71 0.00 4.32 8.00 0.46 -1.68 116.55 129.04 1s7r n ASP 119 Ca -0.15 -0.97 0.00 0.00 0.71 0.00 0.00 54.79 54.38 1s7r n ASP 119 Cb 0.56 -1.51 0.00 0.00 -0.02 0.00 0.00 41.12 40.15 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 -0.97 3.12 3.88 0.44 0.00 -1.26 -5.00 105.19 105.40 1s7r n GLY 120 Ca 0.10 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 44.93 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 -0.86 3.04 0.01 0.00 9.92 -1.26 -0.88 116.55 126.52 1s7r n ASP 122 Ca 0.01 1.08 -0.01 0.00 -0.53 0.00 0.00 54.79 55.34 1s7r n ASP 122 Cb 0.54 -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 -0.42 0.00 -3.59 1.24 9.36 -0.22 -4.67 117.16 118.86 1s7r n TYR 123 Ca 0.07 0.00 -0.16 0.00 3.32 0.00 0.00 57.90 61.13 1s7r n TYR 123 Cb 0.42 -0.05 -0.07 0.00 -0.63 0.00 0.00 39.34 39.02 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 -1.57 0.00 -0.18 2.97 2.07 -1.08 -0.04 121.20 123.37 1s7r s ILE 124 Ca -0.03 -0.04 -0.15 0.00 -1.41 0.00 0.00 60.65 59.02 1s7r s ILE 124 Cb 0.00 -0.94 0.05 0.00 0.13 0.00 0.00 42.46 41.71 1s7r s ILE 124 CO 0.04 -0.02 0.47 0.00 -1.91 0.00 0.00 174.94 173.51 1s7r s ALA 125 N -0.59 -1.16 0.05 1.50 0.00 -0.93 -0.85 121.76 119.77 1s7r s ALA 125 Ca -0.07 1.39 -0.31 0.00 0.00 0.00 0.00 51.96 52.97 1s7r s ALA 125 Cb -0.02 -0.81 -0.07 0.00 0.00 0.00 0.00 23.12 22.22 1s7r s ALA 125 CO 0.06 -0.23 1.43 -1.17 0.00 0.00 0.00 175.76 175.85 1s7r s LEU 126 N 0.48 4.34 0.93 0.00 2.96 -1.06 -1.28 118.68 125.05 1s7r s LEU 126 Ca -0.02 2.23 -0.13 0.00 -0.22 0.00 0.00 54.13 55.99 1s7r s LEU 126 Cb -0.04 -3.57 0.15 0.00 0.50 0.00 0.00 46.19 43.23 1s7r s LEU 126 CO -0.02 -0.72 1.15 0.20 -1.32 0.00 0.00 176.35 175.63 1s7r s ASN 127 N 1.70 3.33 0.40 3.68 0.01 -0.64 -4.59 114.94 118.83 1s7r s ASN 127 Ca 0.65 0.90 0.27 0.00 -0.71 0.00 0.00 52.86 53.98 1s7r s ASN 127 Cb -0.34 -1.43 0.85 0.00 0.41 0.00 0.00 41.25 40.74 1s7r s ASN 127 CO 0.28 -2.66 1.77 -0.33 -1.51 0.00 0.00 177.10 174.66 1s7r h GLU 128 N -1.57 0.00 0.00 -0.60 4.39 -1.89 -2.43 114.58 112.48 1s7r h GLU 128 Ca -0.50 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.20 1s7r h GLU 128 Cb 1.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.97 1s7r h GLU 128 CO 0.59 0.00 0.00 -0.40 -1.16 0.00 0.00 179.01 178.04 1s7r n ASP 129 N -2.80 0.00 -1.37 1.42 5.75 -1.26 -4.88 116.55 113.42 1s7r n ASP 129 Ca 0.03 0.33 -0.17 0.00 -0.01 0.00 0.00 54.79 54.97 1s7r n ASP 129 Cb 0.39 -0.42 -0.06 0.00 -1.03 0.00 0.00 41.12 40.00 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 -1.42 -1.29 0.04 -2.12 4.32 -0.91 -4.79 117.00 110.82 1s7r n LEU 130 Ca 0.06 0.35 0.00 0.00 -0.02 0.00 0.00 56.01 56.40 1s7r n LEU 130 Cb 0.18 -2.40 0.00 0.00 -1.62 0.00 0.00 43.42 39.58 1s7r n LEU 130 CO 0.15 -0.78 -0.15 0.29 -1.22 0.00 0.00 177.39 175.69 1s7r n LYS 131 N -2.53 0.00 -2.51 3.23 5.02 -1.26 -4.55 118.16 115.56 1s7r n LYS 131 Ca -0.17 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 55.85 1s7r n LYS 131 Cb 0.56 -0.41 0.02 0.00 -0.02 0.00 0.00 35.03 35.18 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 4.21 -0.01 -0.18 -4.23 -1.26 -4.79 115.64 107.37 1s7r s THR 132 Ca 0.00 0.08 0.08 0.00 -1.18 0.00 0.00 61.69 60.67 1s7r s THR 132 Cb 0.00 -3.63 -0.02 0.00 1.34 0.00 0.00 72.50 70.19 1s7r s THR 132 CO 0.00 -0.63 -0.26 0.26 -0.54 0.00 0.00 174.62 173.45 1s7r s TRP 133 N -2.87 2.28 -0.21 3.99 0.52 -1.26 -1.63 118.94 119.77 1s7r s TRP 133 Ca 0.51 -0.43 -0.05 0.00 0.02 0.00 0.00 56.10 56.15 1s7r s TRP 133 Cb -0.10 -1.46 -0.02 0.00 -1.15 0.00 0.00 33.47 30.74 1s7r s TRP 133 CO 0.45 -0.02 -0.02 0.99 0.02 0.00 0.00 176.95 178.37 1s7r s THR 134 N -0.62 3.73 -0.05 2.01 2.01 -0.41 -4.92 115.64 117.40 1s7r s THR 134 Ca 0.10 -0.38 -0.10 0.00 0.31 0.00 0.00 61.69 61.61 1s7r s THR 134 Cb -0.10 -2.69 -0.05 0.00 0.01 0.00 0.00 72.50 69.67 1s7r s THR 134 CO -0.01 0.42 0.28 0.00 -0.69 0.00 0.00 174.62 174.62 1s7r s ALA 135 N 1.19 3.79 -0.11 7.40 0.00 -1.26 -2.20 121.76 130.57 1s7r s ALA 135 Ca 0.03 -0.44 -0.26 0.00 0.00 0.00 0.00 51.96 51.28 1s7r s ALA 135 Cb -0.15 -2.17 -0.23 0.00 0.00 0.00 0.00 23.12 20.58 1s7r s ALA 135 CO 0.00 0.56 0.83 0.00 0.00 0.00 0.00 175.76 177.15 1s7r h ALA 136 N 4.74 -0.01 -2.52 0.00 0.00 -0.73 -3.48 119.26 117.26 1s7r h ALA 136 Ca -0.53 -0.41 -0.46 0.00 0.00 0.00 0.00 54.91 53.51 1s7r h ALA 136 Cb 1.22 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.88 1s7r h ALA 136 CO 0.60 -0.06 -0.52 0.16 0.00 0.00 0.00 179.25 179.43 1s7r s ASP 137 N -6.04 1.73 0.60 0.00 1.47 -1.26 -5.05 116.67 108.12 1s7r s ASP 137 Ca -0.17 -1.67 0.40 0.00 1.18 0.00 0.00 52.55 52.28 1s7r s ASP 137 Cb -0.02 0.50 2.08 0.00 -0.34 0.00 0.00 42.92 45.15 1s7r s ASP 137 CO 0.64 -0.98 2.21 0.24 0.68 0.00 0.00 175.17 177.95 1s7r h MET 138 N 2.13 0.00 0.01 2.11 2.86 -1.98 -2.14 114.93 117.92 1s7r h MET 138 Ca -0.30 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.34 1s7r h MET 138 Cb 1.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.91 1s7r h MET 138 CO 0.45 0.00 -0.01 0.00 1.06 0.00 0.00 176.91 178.41 1s7r h ALA 139 N 2.01 -0.02 0.00 6.32 0.00 -1.96 -2.86 119.26 122.75 1s7r h ALA 139 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1s7r h ALA 139 Cb 0.09 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1s7r h ALA 139 CO 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 179.25 179.05 1s7r n ALA 140 N -2.43 1.65 0.13 0.00 0.00 -0.93 -2.30 120.51 116.64 1s7r n ALA 140 Ca -0.09 -0.05 -0.01 0.00 0.00 0.00 0.00 53.44 53.29 1s7r n ALA 140 Cb 0.31 -1.19 0.15 0.00 0.00 0.00 0.00 19.45 18.72 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 0.00 0.05 0.00 5.85 -1.16 -2.49 115.31 117.56 1s7r h LEU 141 Ca 0.00 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.72 1s7r h LEU 141 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1s7r h LEU 141 CO 0.00 0.63 -0.02 0.40 -0.34 0.00 0.00 178.44 179.10 1s7r h ILE 142 N 0.00 1.22 -0.76 4.05 2.04 -1.49 -2.74 117.51 119.82 1s7r h ILE 142 Ca -0.01 -0.91 0.14 0.00 1.00 0.00 0.00 64.86 65.09 1s7r h ILE 142 Cb 1.16 1.82 -0.10 0.00 -0.74 0.00 0.00 36.82 38.96 1s7r h ILE 142 CO 0.08 0.23 0.31 0.74 0.00 0.00 0.00 178.15 179.51 1s7r h THR 143 N -0.47 0.66 0.06 -0.27 2.02 -1.65 -0.60 112.91 112.65 1s7r h THR 143 Ca -0.01 -0.16 0.02 0.00 0.77 0.00 0.00 66.41 67.04 1s7r h THR 143 Cb 0.42 0.16 -0.04 0.00 -1.74 0.00 0.00 68.15 66.96 1s7r h THR 143 CO 0.01 0.08 -0.23 0.50 0.37 0.00 0.00 175.52 176.26 1s7r h LYS 144 N 0.46 -0.37 -0.80 6.66 3.64 -1.45 -1.78 116.57 122.93 1s7r h LYS 144 Ca 0.42 0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 59.82 1s7r h LYS 144 Cb 0.64 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.50 1s7r h LYS 144 CO -0.40 -0.25 0.49 1.25 -2.27 0.00 0.00 179.45 178.27 1s7r h HIS 145 N -0.39 1.03 -0.13 1.91 2.76 -1.08 -0.83 115.15 118.43 1s7r h HIS 145 Ca 0.04 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.24 1s7r h HIS 145 Cb 0.44 -0.34 -0.02 0.00 1.55 0.00 0.00 27.41 29.03 1s7r h HIS 145 CO -0.24 0.68 -0.02 0.87 -1.30 0.00 0.00 177.93 177.92 1s7r h LYS 146 N 1.09 0.02 0.00 5.26 1.57 -0.82 -2.58 116.57 121.12 1s7r h LYS 146 Ca 0.29 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.04 1s7r h LYS 146 Cb -0.07 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.24 1s7r h LYS 146 CO -0.06 0.01 -0.12 -1.49 -0.57 0.00 0.00 179.45 177.23 1s7r h TRP 147 N 0.02 0.00 -0.06 -1.35 6.55 -0.31 -1.76 115.95 119.05 1s7r h TRP 147 Ca 0.06 0.00 -0.19 0.00 0.95 0.00 0.00 58.89 59.71 1s7r h TRP 147 Cb 0.08 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 28.38 1s7r h TRP 147 CO -0.15 0.12 -0.78 0.93 -1.05 0.00 0.00 178.44 177.51 1s7r h GLU 148 N 0.00 0.39 0.00 0.49 5.08 -1.13 -1.60 114.58 117.81 1s7r h GLU 148 Ca -0.00 -0.34 -0.08 0.00 -1.00 0.00 0.00 59.36 57.94 1s7r h GLU 148 Cb 0.73 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 1s7r h GLU 148 CO 0.02 0.99 -0.36 1.96 -1.00 0.00 0.00 179.01 180.62 1s7r h GLN 149 N 0.25 0.00 -0.51 2.33 1.08 -1.01 -3.14 115.11 114.12 1s7r h GLN 149 Ca -0.04 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 1s7r h GLN 149 Cb 1.37 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.80 1s7r h GLN 149 CO 0.13 0.36 0.00 0.00 -0.95 0.00 0.00 178.83 178.37 1s7r n ALA 150 N -2.28 2.57 -4.24 3.87 0.00 -0.72 -4.96 120.51 114.75 1s7r n ALA 150 Ca 0.00 -1.45 -0.35 0.00 0.00 0.00 0.00 53.44 51.64 1s7r n ALA 150 Cb 0.51 -0.74 -0.04 0.00 0.00 0.00 0.00 19.45 19.19 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 0.82 -0.37 0.17 0.00 0.00 -1.04 -4.83 105.19 99.96 1s7r n GLY 151 Ca 0.20 0.13 -0.07 0.00 0.00 0.00 0.00 46.02 46.28 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 -1.49 0.32 -0.11 1.61 4.57 -1.60 -2.67 114.58 115.21 1s7r h GLU 152 Ca -0.61 -0.23 -0.03 0.00 -1.18 0.00 0.00 59.36 57.31 1s7r h GLU 152 Cb 1.38 0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 30.01 1s7r h GLU 152 CO 0.77 0.85 -0.04 0.00 -1.18 0.00 0.00 179.01 179.41 1s7r h ALA 153 N 1.09 0.16 0.00 2.92 0.00 -1.88 0.20 119.26 121.74 1s7r h ALA 153 Ca -0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.64 1s7r h ALA 153 Cb 1.17 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1s7r h ALA 153 CO 0.10 -0.08 -0.08 1.05 0.00 0.00 0.00 179.25 180.24 1s7r h GLU 154 N -0.11 0.00 -0.04 0.00 9.09 -1.80 -0.93 114.58 120.79 1s7r h GLU 154 Ca 0.03 0.00 -0.18 0.00 0.05 0.00 0.00 59.36 59.25 1s7r h GLU 154 Cb 0.47 0.00 0.01 0.00 -1.65 0.00 0.00 28.75 27.59 1s7r h GLU 154 CO 0.01 0.08 -0.69 -0.09 0.05 0.00 0.00 179.01 178.38 1s7r h ARG 155 N 0.00 0.54 -0.71 1.06 2.43 -1.19 -2.56 114.38 113.95 1s7r h ARG 155 Ca -0.00 -0.53 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 1s7r h ARG 155 Cb 0.56 0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 30.21 1s7r h ARG 155 CO 0.01 1.16 0.46 1.25 -1.51 0.00 0.00 179.97 181.34 1s7r h LEU 156 N 0.12 0.83 -0.97 3.80 6.46 -0.43 -2.40 115.31 122.72 1s7r h LEU 156 Ca -0.07 -0.03 -0.11 0.00 -0.12 0.00 0.00 57.88 57.55 1s7r h LEU 156 Cb 1.36 -0.21 -0.01 0.00 -0.73 0.00 0.00 40.66 41.07 1s7r h LEU 156 CO 0.14 0.61 -0.45 -0.09 -0.62 0.00 0.00 178.44 178.03 1s7r h ARG 157 N 0.97 0.15 0.30 1.25 2.43 -1.16 0.55 114.38 118.87 1s7r h ARG 157 Ca 0.26 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.34 1s7r h ARG 157 Cb -0.10 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.46 1s7r h ARG 157 CO -0.05 0.57 -0.15 0.00 -1.51 0.00 0.00 179.97 178.83 1s7r h ALA 158 N 1.42 -0.41 0.30 2.80 0.00 -1.18 0.25 119.26 122.45 1s7r h ALA 158 Ca 0.01 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1s7r h ALA 158 Cb 0.84 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1s7r h ALA 158 CO 0.06 -0.68 -0.41 -0.92 0.00 0.00 0.00 179.25 177.30 1s7r h TYR 159 N -0.50 -1.15 0.67 0.00 3.20 -0.96 -0.15 116.97 118.08 1s7r h TYR 159 Ca -0.04 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.82 1s7r h TYR 159 Cb 0.37 0.46 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 1s7r h TYR 159 CO -0.03 -0.55 -0.50 -0.07 -1.64 0.00 0.00 178.16 175.37 1s7r h LEU 160 N -0.77 -1.32 -2.02 2.82 3.38 0.09 -0.24 115.31 117.25 1s7r h LEU 160 Ca -0.02 0.09 0.11 0.00 0.09 0.00 0.00 57.88 58.16 1s7r h LEU 160 Cb 0.72 0.41 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 1s7r h LEU 160 CO -0.13 -0.72 0.40 -0.33 0.09 0.00 0.00 178.44 177.75 1s7r h GLU 161 N -1.13 0.00 0.00 1.13 5.08 -0.51 -3.22 114.58 115.93 1s7r h GLU 161 Ca -0.09 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1s7r h GLU 161 Cb 0.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1s7r h GLU 161 CO 0.03 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.45 1s7r n GLY 162 N -1.50 0.36 0.22 -3.84 0.00 -0.07 -4.62 105.19 95.74 1s7r n GLY 162 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.08 1s7r n GLY 162 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1s7r h THR 163 N 0.00 0.70 -0.05 2.61 2.02 -1.14 -0.91 112.91 116.15 1s7r h THR 163 Ca 0.00 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.08 1s7r h THR 163 Cb 0.00 0.41 -0.00 0.00 -1.74 0.00 0.00 68.15 66.81 1s7r h THR 163 CO 0.00 0.05 -0.01 0.00 0.37 0.00 0.00 175.52 175.93 1s7r h VAL 165 N -0.26 1.30 0.00 0.00 -1.51 -1.45 -2.18 116.25 112.16 1s7r h VAL 165 Ca 0.01 -1.51 -0.13 0.00 -1.23 0.00 0.00 66.70 63.85 1s7r h VAL 165 Cb 0.40 1.60 -0.02 0.00 -2.13 0.00 0.00 31.29 31.14 1s7r h VAL 165 CO 0.00 0.46 -0.61 -0.33 -1.23 0.00 0.00 177.57 175.86 1s7r h GLU 166 N 0.32 0.00 0.00 5.19 5.08 -1.13 -2.05 114.58 121.98 1s7r h GLU 166 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1s7r h GLU 166 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1s7r h GLU 166 CO 0.07 0.61 -0.71 -1.49 -1.00 0.00 0.00 179.01 176.49 1s7r h TRP 167 N 0.00 0.00 0.14 4.33 4.06 -1.22 -1.94 115.95 121.31 1s7r h TRP 167 Ca -0.01 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 60.94 1s7r h TRP 167 Cb 1.13 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.30 1s7r h TRP 167 CO 0.00 0.00 -0.07 1.25 -3.56 0.00 0.00 178.44 176.06 1s7r h LEU 168 N 0.00 -0.16 -0.64 -4.49 5.85 -1.21 0.22 115.31 114.89 1s7r h LEU 168 Ca 0.00 -0.29 0.07 0.00 0.84 0.00 0.00 57.88 58.51 1s7r h LEU 168 Cb 1.00 0.04 -0.10 0.00 0.37 0.00 0.00 40.66 41.97 1s7r h LEU 168 CO 0.00 0.22 -0.53 0.03 -0.34 0.00 0.00 178.44 177.82 1s7r h ARG 169 N -0.56 -0.22 -0.56 1.25 3.08 -1.47 0.20 114.38 116.10 1s7r h ARG 169 Ca -0.02 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.11 1s7r h ARG 169 Cb 0.44 0.05 -0.09 0.00 0.08 0.00 0.00 29.97 30.44 1s7r h ARG 169 CO 0.03 -0.15 -0.55 -0.09 -1.07 0.00 0.00 179.97 178.14 1s7r h ARG 170 N -0.23 -0.28 -1.01 0.04 9.65 -1.14 -2.75 114.38 118.66 1s7r h ARG 170 Ca 0.13 0.02 0.02 0.00 -1.10 0.00 0.00 59.98 59.06 1s7r h ARG 170 Cb 0.54 0.06 -0.05 0.00 -1.39 0.00 0.00 29.97 29.13 1s7r h ARG 170 CO -0.73 -0.19 0.66 1.88 2.80 0.00 0.00 179.97 184.40 1s7r h TYR 171 N -0.29 1.25 0.00 2.20 0.05 0.39 -0.22 116.97 120.36 1s7r h TYR 171 Ca 0.10 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.89 1s7r h TYR 171 Cb 0.55 -0.42 -0.00 0.00 1.01 0.00 0.00 36.73 37.87 1s7r h TYR 171 CO -0.80 0.76 -0.10 -0.07 -1.05 0.00 0.00 178.16 176.90 1s7r h LEU 172 N 1.33 0.00 0.00 3.88 3.38 -0.35 -0.81 115.31 122.73 1s7r h LEU 172 Ca 0.38 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.23 1s7r h LEU 172 Cb -0.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1s7r h LEU 172 CO -0.10 0.10 -0.99 1.17 0.09 0.00 0.00 178.44 178.71 1s7r n LYS 173 N -3.89 0.51 -0.35 1.13 4.81 -0.46 -0.98 118.16 118.93 1s7r n LYS 173 Ca -0.02 0.50 0.29 0.00 -0.87 0.00 0.00 58.31 58.20 1s7r n LYS 173 Cb 0.20 -1.67 0.54 0.00 0.02 0.00 0.00 35.03 34.12 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 -1.00 0.40 0.00 3.14 4.21 -1.05 -2.28 115.58 119.00 1s7r h ASN 174 Ca -0.19 0.19 -0.01 0.00 1.21 0.00 0.00 56.30 57.50 1s7r h ASN 174 Cb 0.93 0.16 -0.03 0.00 -1.12 0.00 0.00 38.32 38.27 1s7r h ASN 174 CO -0.11 -0.22 -0.33 0.61 -1.29 0.00 0.00 177.43 176.09 1s7r n GLY 175 N -1.34 4.41 0.33 2.83 0.00 -0.32 -4.81 105.19 106.30 1s7r n GLY 175 Ca 0.34 -1.11 0.22 0.00 0.00 0.00 0.00 46.02 45.47 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 0.52 0.45 0.67 1.61 -0.73 -0.44 0.84 115.58 118.50 1s7r h ASN 176 Ca -0.02 0.19 -0.00 0.00 1.87 0.00 0.00 56.30 58.34 1s7r h ASN 176 Cb 1.10 0.15 -0.00 0.00 0.27 0.00 0.00 38.32 39.84 1s7r h ASN 176 CO 0.01 -0.13 -0.02 0.00 -0.37 0.00 0.00 177.43 176.92 1s7r h ALA 177 N 1.84 1.02 0.00 1.57 0.00 -1.85 -2.10 119.26 119.74 1s7r h ALA 177 Ca 0.71 -0.02 -0.37 0.00 0.00 0.00 0.00 54.91 55.23 1s7r h ALA 177 Cb 1.58 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.31 1s7r h ALA 177 CO -0.61 0.02 -2.25 2.41 0.00 0.00 0.00 179.25 178.82 1s7r n THR 178 N -3.15 1.23 0.14 0.00 -1.04 0.07 -4.41 114.28 107.13 1s7r n THR 178 Ca -0.01 -0.34 0.03 0.00 -2.04 0.00 0.00 64.05 61.70 1s7r n THR 178 Cb 0.24 -1.72 0.03 0.00 -1.82 0.00 0.00 70.33 67.05 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 -0.69 0.00 -2.41 -4.42 3.38 -1.02 -3.25 115.31 106.90 1s7r h LEU 179 Ca -0.56 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.41 1s7r h LEU 179 Cb 1.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.29 1s7r h LEU 179 CO -0.31 0.45 0.00 0.18 0.09 0.00 0.00 178.44 178.85 1s7r n LEU 180 N -3.16 3.42 0.00 1.67 4.77 -0.79 -4.96 117.00 117.95 1s7r n LEU 180 Ca 0.01 -1.61 -0.17 0.00 -0.03 0.00 0.00 56.01 54.21 1s7r n LEU 180 Cb 0.72 -0.28 0.13 0.00 -2.33 0.00 0.00 43.42 41.66 1s7r n LEU 180 CO 0.40 0.77 0.44 -2.11 -1.33 0.00 0.00 177.39 175.56 1s7r n ARG 181 N 1.38 -1.34 -3.21 3.23 1.85 -1.23 -5.03 116.66 112.30 1s7r n ARG 181 Ca 0.19 -1.11 -0.01 0.00 -1.00 0.00 0.00 57.85 55.92 1s7r n ARG 181 Cb 0.57 -0.85 -0.02 0.00 -1.05 0.00 0.00 32.46 31.11 1s7r n ARG 181 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 1s7r s THR 182 N -2.45 -0.85 -0.27 8.89 2.01 -1.26 -4.60 115.64 117.12 1s7r s THR 182 Ca 0.42 -0.12 -0.22 0.00 0.31 0.00 0.00 61.69 62.08 1s7r s THR 182 Cb -0.02 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.48 1s7r s THR 182 CO 0.31 -0.12 0.71 -1.81 -0.69 0.00 0.00 174.62 173.02 1s7r s ASP 183 N 2.71 6.66 0.43 3.53 1.01 0.30 -4.84 116.67 126.47 1s7r s ASP 183 Ca 0.10 0.76 -0.23 0.00 0.71 0.00 0.00 52.55 53.90 1s7r s ASP 183 Cb -0.11 -2.38 -0.09 0.00 1.01 0.00 0.00 42.92 41.36 1s7r s ASP 183 CO -0.28 -0.47 1.06 -0.44 0.21 0.00 0.00 175.17 175.26 1s7r s SER 184 N 1.48 6.57 0.44 0.27 0.01 -1.26 -1.05 113.70 120.16 1s7r s SER 184 Ca 0.30 2.03 -0.22 0.00 1.31 0.00 0.00 55.95 59.37 1s7r s SER 184 Cb -0.15 -2.58 -0.09 0.00 0.21 0.00 0.00 66.02 63.41 1s7r s SER 184 CO 0.09 -0.62 1.02 -2.16 0.41 0.00 0.00 173.24 171.98 1s7r s PRO 185 N -2.73 4.02 -0.12 12.44 0.04 -1.26 -4.43 135.00 142.96 1s7r s PRO 185 Ca 0.61 1.37 -0.01 0.00 0.04 0.00 0.00 61.00 63.01 1s7r s PRO 185 Cb -0.21 -2.28 -0.03 0.00 0.04 0.00 0.00 34.50 32.02 1s7r s PRO 185 CO 0.26 -0.24 -0.07 0.15 0.04 0.00 0.00 177.00 177.14 1s7r s LYS 186 N -2.93 3.27 0.20 4.56 1.02 -0.97 -4.90 119.74 119.99 1s7r s LYS 186 Ca 0.63 -0.57 0.07 0.00 0.02 0.00 0.00 55.97 56.12 1s7r s LYS 186 Cb -0.17 -2.73 -0.05 0.00 -0.52 0.00 0.00 37.83 34.36 1s7r s LYS 186 CO 0.21 0.39 -0.13 0.00 -0.92 0.00 0.00 175.35 174.91 1s7r s ALA 187 N -0.06 1.90 0.38 5.17 0.00 -1.26 -1.41 121.76 126.48 1s7r s ALA 187 Ca 0.00 -1.64 -0.14 0.00 0.00 0.00 0.00 51.96 50.18 1s7r s ALA 187 Cb -0.13 -0.02 0.06 0.00 0.00 0.00 0.00 23.12 23.02 1s7r s ALA 187 CO 0.03 0.01 0.76 -2.39 0.00 0.00 0.00 175.76 174.17 1s7r n HIS 188 N -0.35 -2.30 -4.18 0.00 1.44 -1.01 -5.01 115.22 103.80 1s7r n HIS 188 Ca -0.08 -1.81 -0.16 0.00 -2.01 0.00 0.00 57.72 53.66 1s7r n HIS 188 Cb 0.61 0.89 -0.14 0.00 0.12 0.00 0.00 29.99 31.47 1s7r n HIS 188 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 1s7r s VAL 189 N -2.15 0.52 0.19 0.61 1.01 -1.26 -1.06 120.40 118.27 1s7r s VAL 189 Ca 0.16 -0.46 0.11 0.00 0.00 0.00 0.00 61.98 61.79 1s7r s VAL 189 Cb -0.05 -0.47 -0.04 0.00 0.00 0.00 0.00 36.38 35.81 1s7r s VAL 189 CO 0.12 0.02 -0.22 0.42 0.00 0.00 0.00 175.10 175.44 1s7r s THR 190 N -0.43 2.48 -0.04 3.92 -4.23 0.58 -4.73 115.64 113.19 1s7r s THR 190 Ca -0.00 -1.98 0.07 0.00 -1.18 0.00 0.00 61.69 58.60 1s7r s THR 190 Cb -0.04 -2.20 -0.01 0.00 1.34 0.00 0.00 72.50 71.59 1s7r s THR 190 CO -0.00 -0.12 -0.25 -2.28 -0.54 0.00 0.00 174.62 171.43 1s7r s HIS 191 N -1.68 2.37 -0.07 3.99 2.46 -1.26 -2.38 115.29 118.72 1s7r s HIS 191 Ca 0.21 -0.60 -0.04 0.00 0.47 0.00 0.00 55.06 55.10 1s7r s HIS 191 Cb -0.08 -1.55 0.03 0.00 -0.13 0.00 0.00 32.58 30.86 1s7r s HIS 191 CO 0.11 -0.14 0.16 -1.01 -2.47 0.00 0.00 174.74 171.38 1s7r s HIS 192 N -0.34 -0.18 0.97 3.88 3.76 -0.70 -5.01 115.29 117.67 1s7r s HIS 192 Ca 0.02 0.50 -0.12 0.00 -0.15 0.00 0.00 55.06 55.31 1s7r s HIS 192 Cb -0.12 -0.03 0.17 0.00 1.11 0.00 0.00 32.58 33.71 1s7r s HIS 192 CO 0.02 -0.15 1.09 -1.12 -0.85 0.00 0.00 174.74 173.72 1s7r s SER 193 N 0.91 2.71 -0.28 1.40 0.01 -1.26 -1.59 113.70 115.60 1s7r s SER 193 Ca -0.07 1.61 -0.23 0.00 1.31 0.00 0.00 55.95 58.57 1s7r s SER 193 Cb -0.09 -2.27 0.12 0.00 0.21 0.00 0.00 66.02 64.00 1s7r s SER 193 CO -0.05 -3.14 0.99 -0.60 0.41 0.00 0.00 173.24 170.85 1s7r s ARG 194 N -4.76 0.52 0.73 12.44 3.52 -1.20 -4.67 118.95 125.53 1s7r s ARG 194 Ca 0.65 0.66 -0.15 0.00 -0.13 0.00 0.00 55.73 56.77 1s7r s ARG 194 Cb -0.21 0.23 0.04 0.00 -1.56 0.00 0.00 34.95 33.46 1s7r s ARG 194 CO 0.59 -0.07 1.20 -2.14 -0.81 0.00 0.00 175.30 174.07 1s7r s PRO 195 N 0.44 2.16 0.00 5.12 0.02 -1.26 -3.47 135.00 138.01 1s7r s PRO 195 Ca 0.01 1.72 0.00 0.00 0.02 0.00 0.00 61.00 62.74 1s7r s PRO 195 Cb -0.05 -1.84 0.00 0.00 0.02 0.00 0.00 34.50 32.63 1s7r s PRO 195 CO -0.07 -1.81 0.00 -1.91 -0.33 0.00 0.00 177.00 172.88 1s7r n GLU 196 N -2.75 0.00 -3.51 5.54 2.13 -1.26 -3.85 120.64 116.94 1s7r n GLU 196 Ca 0.13 0.29 -0.19 0.00 0.66 0.00 0.00 57.16 58.05 1s7r n GLU 196 Cb 0.50 -2.88 0.08 0.00 0.27 0.00 0.00 31.44 29.42 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 1.16 -2.72 -4.65 4.31 9.92 -1.25 -5.02 116.55 118.31 1s7r n ASP 197 Ca 0.00 -0.64 -0.27 0.00 -0.53 0.00 0.00 54.79 53.35 1s7r n ASP 197 Cb 0.00 -4.92 -0.10 0.00 -0.64 0.00 0.00 41.12 35.46 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 -5.65 2.02 -0.20 -1.24 3.01 -1.23 -3.12 119.74 113.33 1s7r s LYS 198 Ca 0.12 -2.06 -0.16 0.00 -1.01 0.00 0.00 55.97 52.86 1s7r s LYS 198 Cb -0.05 -1.71 0.06 0.00 -1.01 0.00 0.00 37.83 35.11 1s7r s LYS 198 CO 0.74 -0.07 0.52 0.08 0.51 0.00 0.00 175.35 177.14 1s7r s VAL 199 N -2.69 -0.01 -0.25 3.17 1.01 0.73 -3.24 120.40 119.12 1s7r s VAL 199 Ca 0.36 0.02 -0.10 0.00 0.00 0.00 0.00 61.98 62.26 1s7r s VAL 199 Cb 0.09 -0.74 -0.05 0.00 0.00 0.00 0.00 36.38 35.68 1s7r s VAL 199 CO 0.19 0.01 0.15 -0.89 0.00 0.00 0.00 175.10 174.56 1s7r s THR 200 N 0.72 5.14 -0.31 3.92 2.01 -0.62 0.05 115.64 126.54 1s7r s THR 200 Ca -0.04 0.10 -0.03 0.00 0.31 0.00 0.00 61.69 62.04 1s7r s THR 200 Cb -0.05 -3.41 0.05 0.00 0.01 0.00 0.00 72.50 69.10 1s7r s THR 200 CO -0.05 0.32 0.03 -0.76 -0.69 0.00 0.00 174.62 173.47 1s7r s LEU 201 N 1.31 4.01 -0.22 4.42 1.43 -0.71 -1.71 118.68 127.21 1s7r s LEU 201 Ca 0.07 -1.24 -0.09 0.00 -1.03 0.00 0.00 54.13 51.83 1s7r s LEU 201 Cb -0.14 -1.75 -0.05 0.00 0.03 0.00 0.00 46.19 44.28 1s7r s LEU 201 CO 0.06 -0.28 0.12 -0.60 0.23 0.00 0.00 176.35 175.89 1s7r s ARG 202 N 1.29 4.05 -0.38 1.70 3.52 -1.00 -1.21 118.95 126.92 1s7r s ARG 202 Ca -0.04 -0.29 -0.16 0.00 -0.13 0.00 0.00 55.73 55.11 1s7r s ARG 202 Cb -0.20 -3.42 0.01 0.00 -1.56 0.00 0.00 34.95 29.78 1s7r s ARG 202 CO -0.00 0.15 0.38 0.00 -0.81 0.00 0.00 175.30 175.02 1s7r s TRP 204 N 2.02 3.53 -0.04 0.00 0.52 -0.22 -2.16 118.94 122.58 1s7r s TRP 204 Ca 0.11 0.57 0.01 0.00 0.02 0.00 0.00 56.10 56.81 1s7r s TRP 204 Cb -0.17 -2.00 0.02 0.00 -1.15 0.00 0.00 33.47 30.17 1s7r s TRP 204 CO 0.12 0.52 -0.04 0.00 0.02 0.00 0.00 176.95 177.57 1s7r s ALA 205 N -1.49 0.63 0.26 0.98 0.00 -0.41 -2.40 121.76 119.34 1s7r s ALA 205 Ca 0.35 -0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.31 1s7r s ALA 205 Cb -0.13 -0.42 -0.05 0.00 0.00 0.00 0.00 23.12 22.52 1s7r s ALA 205 CO 0.21 -0.04 0.03 -0.51 0.00 0.00 0.00 175.76 175.46 1s7r s LEU 206 N 0.96 2.07 -1.28 0.00 1.43 -0.50 -2.16 118.68 119.21 1s7r s LEU 206 Ca -0.10 -1.29 -0.17 0.00 -1.03 0.00 0.00 54.13 51.53 1s7r s LEU 206 Cb -0.14 -0.23 0.01 0.00 0.03 0.00 0.00 46.19 45.86 1s7r s LEU 206 CO -0.00 -0.58 0.57 0.61 0.23 0.00 0.00 176.35 177.18 1s7r n GLY 207 N -0.49 -0.65 3.22 -3.19 0.00 -1.13 -2.30 105.19 100.66 1s7r n GLY 207 Ca -0.03 0.31 -0.17 0.00 0.00 0.00 0.00 46.02 46.13 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 -3.72 1.29 -0.22 1.61 -0.12 -1.13 -4.45 117.98 111.24 1s7r s PHE 208 Ca 0.31 -0.58 -0.19 0.00 -0.05 0.00 0.00 56.93 56.42 1s7r s PHE 208 Cb -0.14 -0.68 0.06 0.00 -0.63 0.00 0.00 43.02 41.63 1s7r s PHE 208 CO 0.92 0.10 0.58 -0.47 -0.05 0.00 0.00 175.22 176.29 1s7r s TYR 209 N -2.17 -0.67 1.11 3.49 6.14 -0.21 -0.47 117.35 124.56 1s7r s TYR 209 Ca 0.07 1.59 -0.17 0.00 0.64 0.00 0.00 57.07 59.20 1s7r s TYR 209 Cb -0.05 0.26 0.24 0.00 0.42 0.00 0.00 41.96 42.84 1s7r s TYR 209 CO 0.02 -0.33 1.14 -2.14 0.64 0.00 0.00 175.55 174.88 1s7r s PRO 210 N 0.51 -0.46 0.57 4.97 0.02 -1.26 -0.54 135.00 138.82 1s7r s PRO 210 Ca -0.02 0.01 0.27 0.00 0.02 0.00 0.00 61.00 61.28 1s7r s PRO 210 Cb -0.04 -1.68 1.70 0.00 0.02 0.00 0.00 34.50 34.49 1s7r s PRO 210 CO -0.02 -3.22 2.23 0.00 -0.33 0.00 0.00 177.00 175.66 1s7r h ALA 211 N -2.23 1.62 -2.54 -1.55 0.00 -1.93 -3.43 119.26 109.20 1s7r h ALA 211 Ca -0.47 -0.00 -0.53 0.00 0.00 0.00 0.00 54.91 53.90 1s7r h ALA 211 Cb 1.30 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.11 1s7r h ALA 211 CO 0.42 0.01 0.70 0.34 0.00 0.00 0.00 179.25 180.71 1s7r s ASP 212 N -6.36 6.87 0.10 0.00 2.15 -1.26 -4.96 116.67 113.21 1s7r s ASP 212 Ca -0.05 2.28 -0.25 0.00 0.43 0.00 0.00 52.55 54.96 1s7r s ASP 212 Cb 0.15 -2.59 0.08 0.00 -0.30 0.00 0.00 42.92 40.27 1s7r s ASP 212 CO 0.58 -0.62 0.71 -0.51 -0.17 0.00 0.00 175.17 175.16 1s7r s ILE 213 N 1.07 0.00 -0.02 4.11 2.07 -1.26 -4.61 121.20 122.56 1s7r s ILE 213 Ca 0.63 -0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.87 1s7r s ILE 213 Cb -0.36 -1.01 0.02 0.00 0.13 0.00 0.00 42.46 41.25 1s7r s ILE 213 CO 0.30 0.00 0.00 -0.89 -1.91 0.00 0.00 174.94 172.45 1s7r s THR 214 N -3.51 0.09 -0.10 4.00 2.01 -0.68 -4.97 115.64 112.49 1s7r s THR 214 Ca 0.03 0.09 0.03 0.00 0.31 0.00 0.00 61.69 62.14 1s7r s THR 214 Cb -0.01 -0.18 -0.01 0.00 0.01 0.00 0.00 72.50 72.31 1s7r s THR 214 CO -0.11 0.10 -0.19 -0.76 -0.69 0.00 0.00 174.62 172.97 1s7r s LEU 215 N 0.77 2.41 0.05 4.42 1.43 -1.25 -0.67 118.68 125.83 1s7r s LEU 215 Ca -0.07 -0.42 0.03 0.00 -1.03 0.00 0.00 54.13 52.64 1s7r s LEU 215 Cb -0.10 -1.50 -0.02 0.00 0.03 0.00 0.00 46.19 44.59 1s7r s LEU 215 CO -0.02 0.19 -0.10 0.42 0.23 0.00 0.00 176.35 177.08 1s7r s THR 216 N 0.17 0.73 -0.14 5.49 -4.23 0.14 -4.94 115.64 112.86 1s7r s THR 216 Ca -0.10 -1.10 -0.11 0.00 -1.18 0.00 0.00 61.69 59.20 1s7r s THR 216 Cb -0.16 -0.75 -0.05 0.00 1.34 0.00 0.00 72.50 72.88 1s7r s THR 216 CO 0.06 -0.29 0.23 0.26 -0.54 0.00 0.00 174.62 174.34 1s7r s TRP 217 N -1.25 3.52 0.46 3.99 0.52 -1.26 0.87 118.94 125.79 1s7r s TRP 217 Ca -0.06 0.56 0.04 0.00 0.02 0.00 0.00 56.10 56.66 1s7r s TRP 217 Cb -0.09 -2.19 -0.04 0.00 -1.15 0.00 0.00 33.47 30.00 1s7r s TRP 217 CO 0.01 0.43 0.05 -0.65 0.02 0.00 0.00 176.95 176.81 1s7r s GLN 218 N -0.15 2.11 -0.29 4.98 -0.21 0.29 -2.50 119.66 123.89 1s7r s GLN 218 Ca 0.15 -2.21 0.04 0.00 0.02 0.00 0.00 55.36 53.36 1s7r s GLN 218 Cb -0.13 -1.65 0.20 0.00 1.00 0.00 0.00 33.01 32.43 1s7r s GLN 218 CO 0.04 -0.23 0.63 -1.17 -2.12 0.00 0.00 175.29 172.43 1s7r s LEU 219 N -3.84 -1.52 -1.62 2.90 2.96 -1.15 -1.68 118.68 114.72 1s7r s LEU 219 Ca 0.22 0.22 -0.02 0.00 -0.22 0.00 0.00 54.13 54.33 1s7r s LEU 219 Cb 0.05 1.99 0.01 0.00 0.50 0.00 0.00 46.19 48.73 1s7r s LEU 219 CO 0.12 -0.28 0.25 0.59 -1.32 0.00 0.00 176.35 175.71 1s7r n ASN 220 N 5.40 -5.73 -0.01 3.68 5.03 -1.26 -3.29 115.26 119.08 1s7r n ASN 220 Ca 0.05 -0.12 0.00 0.00 0.87 0.00 0.00 54.58 55.38 1s7r n ASN 220 Cb 0.54 -4.72 0.00 0.00 -1.02 0.00 0.00 39.78 34.58 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 -1.20 1.62 3.64 7.41 0.00 -1.26 -5.11 105.19 110.29 1s7r n GLY 221 Ca -0.18 -0.13 -0.06 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.34 0.64 0.70 1.61 -1.05 -1.21 -5.17 118.70 112.88 1s7r s GLU 222 Ca 0.00 1.15 -0.13 0.00 -0.15 0.00 0.00 54.97 55.83 1s7r s GLU 222 Cb 0.00 0.18 0.02 0.00 -0.44 0.00 0.00 34.13 33.89 1s7r s GLU 222 CO 0.00 -0.14 1.11 -1.21 0.95 0.00 0.00 175.26 175.96 1s7r s GLU 223 N 1.69 2.61 -0.42 -4.83 2.02 -1.26 -2.95 118.70 115.55 1s7r s GLU 223 Ca -0.09 1.32 0.06 0.00 0.02 0.00 0.00 54.97 56.28 1s7r s GLU 223 Cb -0.05 -1.93 0.43 0.00 0.10 0.00 0.00 34.13 32.67 1s7r s GLU 223 CO -0.19 -1.39 1.11 1.28 0.02 0.00 0.00 175.26 176.08 1s7r n LEU 224 N -2.79 4.49 -0.37 1.80 4.32 -1.04 -4.90 117.00 118.51 1s7r n LEU 224 Ca 0.10 -5.07 0.38 0.00 -0.02 0.00 0.00 56.01 51.40 1s7r n LEU 224 Cb 0.52 -0.39 0.74 0.00 -1.62 0.00 0.00 43.42 42.68 1s7r n LEU 224 CO 0.50 2.18 1.35 0.40 -1.22 0.00 0.00 177.39 180.59 1s7r h ILE 225 N 2.59 0.28 0.00 -0.08 5.03 -1.95 -2.17 117.51 121.22 1s7r h ILE 225 Ca 0.28 0.00 -0.03 0.00 -0.12 0.00 0.00 64.86 64.99 1s7r h ILE 225 Cb 0.99 0.30 -0.00 0.00 -3.03 0.00 0.00 36.82 35.08 1s7r h ILE 225 CO 0.82 0.00 -0.18 1.56 -0.68 0.00 0.00 178.15 179.67 1s7r h GLN 226 N 0.00 0.00 -0.89 2.37 7.50 -2.01 -3.32 115.11 118.76 1s7r h GLN 226 Ca 0.61 0.00 -0.14 0.00 0.50 0.00 0.00 58.65 59.62 1s7r h GLN 226 Cb 2.57 0.00 -0.08 0.00 0.05 0.00 0.00 27.48 30.02 1s7r h GLN 226 CO -0.01 0.79 0.18 -0.25 -1.50 0.00 0.00 178.83 178.04 1s7r n ASP 227 N -4.62 3.45 -4.55 1.46 9.92 -0.85 -4.84 116.55 116.52 1s7r n ASP 227 Ca -0.11 -2.67 -0.17 0.00 -0.53 0.00 0.00 54.79 51.30 1s7r n ASP 227 Cb 0.41 -0.64 0.06 0.00 -0.64 0.00 0.00 41.12 40.31 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 -0.03 0.60 -3.15 -1.24 2.81 -1.02 -4.13 117.12 110.95 1s7r n MET 228 Ca 0.23 -2.71 0.05 0.00 -1.81 0.00 0.00 57.70 53.45 1s7r n MET 228 Cb 0.94 -0.24 -0.01 0.00 -0.71 0.00 0.00 33.22 33.20 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 -4.35 0.42 0.40 0.03 2.12 -0.28 -4.94 118.70 112.09 1s7r s GLU 229 Ca 0.54 0.70 0.08 0.00 0.36 0.00 0.00 54.97 56.64 1s7r s GLU 229 Cb -0.04 0.38 -0.05 0.00 0.26 0.00 0.00 34.13 34.68 1s7r s GLU 229 CO 0.34 -0.50 0.16 -0.48 -0.54 0.00 0.00 175.26 174.24 1s7r s LEU 230 N 2.89 3.12 -0.05 2.70 2.34 -1.26 -1.04 118.68 127.38 1s7r s LEU 230 Ca 0.13 -1.04 0.06 0.00 0.06 0.00 0.00 54.13 53.34 1s7r s LEU 230 Cb -0.12 -1.46 -0.02 0.00 -0.56 0.00 0.00 46.19 44.03 1s7r s LEU 230 CO -0.18 -0.49 -0.23 0.68 -1.06 0.00 0.00 176.35 175.07 1s7r s VAL 231 N -2.57 2.27 0.14 1.48 -7.23 -1.03 -5.01 120.40 108.45 1s7r s VAL 231 Ca 0.40 -1.00 -0.33 0.00 -1.81 0.00 0.00 61.98 59.24 1s7r s VAL 231 Cb 0.03 -1.83 -0.17 0.00 0.56 0.00 0.00 36.38 34.97 1s7r s VAL 231 CO 0.22 0.57 0.94 -0.62 -0.31 0.00 0.00 175.10 175.91 1s7r n GLU 232 N 2.77 0.54 -1.43 4.82 1.02 -1.26 -4.42 120.64 122.68 1s7r n GLU 232 Ca -0.17 0.19 -0.43 0.00 -0.02 0.00 0.00 57.16 56.73 1s7r n GLU 232 Cb 0.52 -1.54 -0.00 0.00 -0.02 0.00 0.00 31.44 30.40 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 0.98 1.62 -4.08 2.62 -1.04 -1.26 -4.88 114.28 108.25 1s7r n THR 233 Ca 0.17 -0.50 -0.12 0.00 -2.04 0.00 0.00 64.05 61.56 1s7r n THR 233 Cb 0.21 -0.39 -0.11 0.00 -1.82 0.00 0.00 70.33 68.22 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 0.58 0.23 -2.82 1.70 -0.47 -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 -0.68 -0.23 -0.09 0.00 -0.57 0.00 0.00 34.95 33.37 1s7r s ARG 234 CO 0.59 0.02 1.33 -2.14 -1.08 0.00 0.00 175.30 174.02 1s7r s PRO 235 N -2.11 4.37 -0.04 3.89 0.02 -1.26 -1.57 135.00 138.30 1s7r s PRO 235 Ca -0.05 2.12 0.20 0.00 0.02 0.00 0.00 61.00 63.28 1s7r s PRO 235 Cb -0.06 -3.16 0.62 0.00 0.02 0.00 0.00 34.50 31.92 1s7r s PRO 235 CO -0.01 -0.25 1.53 0.00 -0.33 0.00 0.00 177.00 177.93 1s7r n ALA 236 N 2.23 2.57 -0.61 -1.55 0.00 0.24 -4.88 120.51 118.52 1s7r n ALA 236 Ca 0.05 -1.40 0.00 0.00 0.00 0.00 0.00 53.44 52.09 1s7r n ALA 236 Cb 0.42 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.99 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 1.30 0.73 1.50 0.00 0.00 -1.26 -4.89 105.19 102.57 1s7r n GLY 237 Ca 0.23 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.28 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 0.85 -0.88 1.61 5.75 -1.26 -4.98 116.55 117.64 1s7r n ASP 238 Ca 0.00 -2.00 -0.11 0.00 -0.01 0.00 0.00 54.79 52.67 1s7r n ASP 238 Cb 0.00 -0.26 -0.04 0.00 -1.03 0.00 0.00 41.12 39.79 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 0.43 1.15 3.37 6.12 0.00 -1.26 -5.04 105.19 109.95 1s7r n GLY 239 Ca 0.03 -0.51 -0.19 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.42 1.70 0.46 2.61 -4.23 -1.26 -4.85 115.64 107.64 1s7r s THR 240 Ca 0.00 -2.19 0.06 0.00 -1.18 0.00 0.00 61.69 58.39 1s7r s THR 240 Cb 0.00 -2.16 -0.02 0.00 1.34 0.00 0.00 72.50 71.66 1s7r s THR 240 CO 0.00 -0.51 0.28 -0.36 -0.54 0.00 0.00 174.62 173.49 1s7r s PHE 241 N -2.99 2.30 0.02 3.99 0.40 0.38 0.83 117.98 122.90 1s7r s PHE 241 Ca 0.25 -0.66 -0.23 0.00 -0.60 0.00 0.00 56.93 55.69 1s7r s PHE 241 Cb 0.01 -1.97 0.05 0.00 0.51 0.00 0.00 43.02 41.61 1s7r s PHE 241 CO 0.08 -0.07 0.51 1.14 0.70 0.00 0.00 175.22 177.58 1s7r s GLN 242 N -4.06 0.97 0.02 0.44 -2.07 -0.61 -2.82 119.66 111.53 1s7r s GLN 242 Ca 0.38 -0.14 -0.04 0.00 -1.82 0.00 0.00 55.36 53.75 1s7r s GLN 242 Cb 0.00 0.45 -0.01 0.00 -1.09 0.00 0.00 33.01 32.36 1s7r s GLN 242 CO 0.22 -0.33 0.06 0.21 -1.32 0.00 0.00 175.29 174.13 1s7r s LYS 243 N -2.02 0.44 0.01 9.60 2.20 -0.92 -1.36 119.74 127.70 1s7r s LYS 243 Ca -0.08 -0.58 0.02 0.00 -0.36 0.00 0.00 55.97 54.98 1s7r s LYS 243 Cb -0.01 0.17 -0.01 0.00 -1.51 0.00 0.00 37.83 36.47 1s7r s LYS 243 CO 0.02 -0.10 -0.06 1.67 -0.36 0.00 0.00 175.35 176.52 1s7r s TRP 244 N -1.74 0.55 -0.04 4.03 1.48 -1.26 -1.28 118.94 120.68 1s7r s TRP 244 Ca -0.13 -0.22 0.02 0.00 -1.06 0.00 0.00 56.10 54.72 1s7r s TRP 244 Cb -0.07 -0.35 0.01 0.00 -1.16 0.00 0.00 33.47 31.91 1s7r s TRP 244 CO -0.01 -0.03 -0.09 0.00 -4.06 0.00 0.00 176.95 172.76 1s7r s ALA 245 N -0.51 0.90 0.34 2.67 0.00 -0.92 -2.45 121.76 121.79 1s7r s ALA 245 Ca -0.02 -0.29 0.09 0.00 0.00 0.00 0.00 51.96 51.75 1s7r s ALA 245 Cb -0.05 -0.39 -0.05 0.00 0.00 0.00 0.00 23.12 22.63 1s7r s ALA 245 CO 0.00 0.11 0.01 -1.54 0.00 0.00 0.00 175.76 174.34 1s7r s SER 246 N 0.44 4.16 -0.07 0.00 1.04 -0.21 -0.30 113.70 118.76 1s7r s SER 246 Ca -0.07 -1.00 -0.16 0.00 0.48 0.00 0.00 55.95 55.19 1s7r s SER 246 Cb -0.11 -0.52 0.03 0.00 0.10 0.00 0.00 66.02 65.52 1s7r s SER 246 CO 0.01 -0.25 0.38 0.54 0.98 0.00 0.00 173.24 174.90 1s7r s VAL 247 N -2.53 0.03 -0.40 5.02 0.11 -0.35 -1.13 120.40 121.16 1s7r s VAL 247 Ca 0.35 -0.25 -0.14 0.00 -2.93 0.00 0.00 61.98 59.01 1s7r s VAL 247 Cb 0.00 -0.63 0.02 0.00 -1.53 0.00 0.00 36.38 34.25 1s7r s VAL 247 CO 0.19 -0.14 0.27 -0.69 -3.33 0.00 0.00 175.10 171.41 1s7r s VAL 248 N -0.72 5.06 0.24 2.04 1.01 -1.26 -1.74 120.40 125.02 1s7r s VAL 248 Ca -0.08 -0.72 0.09 0.00 0.00 0.00 0.00 61.98 61.26 1s7r s VAL 248 Cb -0.04 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 1s7r s VAL 248 CO 0.03 -0.29 0.03 0.68 0.00 0.00 0.00 175.10 175.55 1s7r s VAL 249 N 1.64 3.68 0.11 2.92 -7.23 0.11 -4.92 120.40 116.71 1s7r s VAL 249 Ca 0.04 -1.72 -0.30 0.00 -1.81 0.00 0.00 61.98 58.19 1s7r s VAL 249 Cb -0.19 -2.95 -0.06 0.00 0.56 0.00 0.00 36.38 33.75 1s7r s VAL 249 CO 0.09 -0.31 1.00 -2.16 -0.31 0.00 0.00 175.10 173.41 1s7r s PRO 250 N -3.55 4.65 0.33 4.82 0.04 -1.26 -0.19 135.00 139.83 1s7r s PRO 250 Ca 0.31 1.51 -0.26 0.00 0.04 0.00 0.00 61.00 62.60 1s7r s PRO 250 Cb -0.07 -3.37 -0.14 0.00 0.04 0.00 0.00 34.50 30.96 1s7r s PRO 250 CO 0.20 0.13 0.81 -0.11 0.04 0.00 0.00 177.00 178.08 1s7r n LEU 251 N 2.90 0.96 0.00 -3.56 7.94 -1.18 -2.08 117.00 121.98 1s7r n LEU 251 Ca 0.03 1.08 0.00 0.00 -1.11 0.00 0.00 56.01 56.01 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 0.52 -2.04 0.00 0.61 -1.11 0.00 0.00 177.39 175.37 1s7r n GLY 252 N 1.48 2.94 0.93 -3.96 0.00 -1.26 -4.81 105.19 100.51 1s7r n GLY 252 Ca 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.23 2.02 0.15 1.61 5.02 -0.88 -4.61 118.16 120.23 1s7r n LYS 253 Ca 0.00 -3.48 0.12 0.00 -2.02 0.00 0.00 58.31 52.93 1s7r n LYS 253 Cb 0.00 -1.74 0.10 0.00 -0.02 0.00 0.00 35.03 33.37 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 1.27 0.00 -0.06 1.97 4.11 -1.88 -3.29 114.58 116.70 1s7r h GLU 254 Ca 0.08 0.00 0.02 0.00 0.07 0.00 0.00 59.36 59.53 1s7r h GLU 254 Cb 1.13 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.38 1s7r h GLU 254 CO 0.17 0.00 0.06 -0.56 0.07 0.00 0.00 179.01 178.75 1s7r h GLN 255 N 0.00 0.00 0.00 1.06 3.07 -1.92 -2.68 115.11 114.64 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 0.97 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.53 1s7r h GLN 255 CO 0.00 0.00 -0.69 0.66 0.09 0.00 0.00 178.83 178.89 1s7r n TYR 256 N -3.96 0.12 -3.37 0.06 4.01 -1.24 -4.85 117.16 107.93 1s7r n TYR 256 Ca -0.01 0.03 -0.38 0.00 -0.16 0.00 0.00 57.90 57.38 1s7r n TYR 256 Cb 0.16 -0.30 -0.06 0.00 -0.31 0.00 0.00 39.34 38.83 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 -3.06 3.73 0.05 -0.72 1.51 -1.01 -4.30 117.35 113.54 1s7r s TYR 257 Ca 0.09 1.10 0.06 0.00 -1.01 0.00 0.00 57.07 57.30 1s7r s TYR 257 Cb 0.16 -2.42 -0.02 0.00 -0.11 0.00 0.00 41.96 39.56 1s7r s TYR 257 CO 0.74 0.54 -0.16 0.95 -1.11 0.00 0.00 175.55 176.51 1s7r s THR 258 N -0.79 1.30 -0.02 -0.71 -4.23 -0.68 -4.62 115.64 105.89 1s7r s THR 258 Ca 0.26 -1.12 -0.01 0.00 -1.18 0.00 0.00 61.69 59.65 1s7r s THR 258 Cb -0.18 -1.17 -0.04 0.00 1.34 0.00 0.00 72.50 72.46 1s7r s THR 258 CO 0.15 0.03 0.05 0.00 -0.54 0.00 0.00 174.62 174.31 1s7r s HIS 260 N -1.10 1.35 -0.13 0.00 3.76 0.25 -1.52 115.29 117.91 1s7r s HIS 260 Ca 0.20 -0.48 0.02 0.00 -0.15 0.00 0.00 55.06 54.65 1s7r s HIS 260 Cb -0.12 -1.00 0.01 0.00 1.11 0.00 0.00 32.58 32.58 1s7r s HIS 260 CO 0.10 -0.26 -0.19 0.08 -0.85 0.00 0.00 174.74 173.63 1s7r s VAL 261 N 0.66 1.84 -0.11 -0.90 1.01 -0.44 -0.68 120.40 121.78 1s7r s VAL 261 Ca -0.14 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.02 1s7r s VAL 261 Cb -0.15 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 1s7r s VAL 261 CO 0.03 0.51 -0.19 -0.31 0.00 0.00 0.00 175.10 175.14 1s7r s TYR 262 N 0.91 2.68 0.03 5.22 2.02 0.16 -1.02 117.35 127.35 1s7r s TYR 262 Ca -0.06 -0.82 -0.28 0.00 -0.37 0.00 0.00 57.07 55.54 1s7r s TYR 262 Cb -0.15 -1.77 0.09 0.00 -0.40 0.00 0.00 41.96 39.74 1s7r s TYR 262 CO -0.02 -0.29 0.92 -1.58 -1.57 0.00 0.00 175.55 173.01 1s7r s HIS 263 N 0.29 -0.28 0.27 2.71 2.46 -1.26 -1.69 115.29 117.80 1s7r s HIS 263 Ca -0.14 0.11 -0.01 0.00 0.47 0.00 0.00 55.06 55.49 1s7r s HIS 263 Cb -0.17 0.56 0.47 0.00 -0.13 0.00 0.00 32.58 33.31 1s7r s HIS 263 CO 0.07 -0.60 1.87 1.96 -2.47 0.00 0.00 174.74 175.57 1s7r h GLN 264 N 2.00 1.08 -0.17 2.88 4.20 -1.93 -1.04 115.11 122.13 1s7r h GLN 264 Ca -0.22 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.42 1s7r h GLN 264 Cb 1.24 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 28.77 1s7r h GLN 264 CO 0.29 0.71 0.00 0.41 -0.67 0.00 0.00 178.83 179.58 1s7r n GLY 265 N -1.36 -0.40 2.96 3.46 0.00 -1.26 -4.59 105.19 104.00 1s7r n GLY 265 Ca 0.17 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.92 4.67 0.40 0.99 1.43 -0.39 -4.66 118.68 120.20 1s7r s LEU 266 Ca 0.05 -3.35 0.24 0.00 -1.03 0.00 0.00 54.13 50.04 1s7r s LEU 266 Cb 0.03 -1.68 1.34 0.00 0.03 0.00 0.00 46.19 45.91 1s7r s LEU 266 CO 0.03 -0.19 1.61 -0.65 0.23 0.00 0.00 176.35 177.39 1s7r h PRO 267 N 6.12 0.09 -4.38 1.29 0.11 -1.81 -3.35 132.00 130.07 1s7r h PRO 267 Ca 0.02 -0.01 -0.44 0.00 0.11 0.00 0.00 66.00 65.69 1s7r h PRO 267 Cb 0.84 -0.02 -0.32 0.00 0.11 0.00 0.00 31.00 31.61 1s7r h PRO 267 CO 0.71 0.06 -0.79 -1.83 -0.21 0.00 0.00 178.00 175.95 1s7r s GLU 268 N -5.44 1.05 0.97 1.05 -1.05 -1.26 -5.12 118.70 108.89 1s7r s GLU 268 Ca -0.09 -0.25 -0.13 0.00 -0.15 0.00 0.00 54.97 54.35 1s7r s GLU 268 Cb 0.31 -0.97 0.05 0.00 -0.44 0.00 0.00 34.13 33.09 1s7r s GLU 268 CO 0.80 0.03 0.42 -2.30 0.95 0.00 0.00 175.26 175.16 1s7r n PRO 269 N 3.65 -0.43 -3.42 -4.83 -0.02 -1.26 -4.96 135.00 123.72 1s7r n PRO 269 Ca -0.22 -0.09 -0.36 0.00 -2.02 0.00 0.00 63.50 60.82 1s7r n PRO 269 Cb 0.53 -1.87 -0.06 0.00 -0.02 0.00 0.00 33.50 32.07 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 -1.45 4.40 -0.11 2.45 1.43 -0.19 -4.86 118.68 120.34 1s7r s LEU 270 Ca 0.57 1.02 -0.01 0.00 -1.03 0.00 0.00 54.13 54.69 1s7r s LEU 270 Cb -0.20 -3.02 0.03 0.00 0.03 0.00 0.00 46.19 43.02 1s7r s LEU 270 CO 0.67 0.19 -0.05 -0.89 0.23 0.00 0.00 176.35 176.49 1s7r s THR 271 N -1.32 0.87 0.01 5.49 2.01 -1.25 -1.32 115.64 120.13 1s7r s THR 271 Ca 0.33 -0.22 -0.01 0.00 0.31 0.00 0.00 61.69 62.09 1s7r s THR 271 Cb -0.16 -0.95 -0.01 0.00 0.01 0.00 0.00 72.50 71.39 1s7r s THR 271 CO 0.18 0.31 -0.00 -1.48 -0.69 0.00 0.00 174.62 172.94 1s7r s LEU 272 N 1.77 2.11 0.02 4.42 0.05 -0.57 -4.93 118.68 121.54 1s7r s LEU 272 Ca 0.05 -0.40 -0.05 0.00 0.05 0.00 0.00 54.13 53.77 1s7r s LEU 272 Cb -0.13 0.18 -0.02 0.00 -2.05 0.00 0.00 46.19 44.17 1s7r s LEU 272 CO -0.08 -0.28 -0.09 -2.11 -0.55 0.00 0.00 176.35 173.24 1s7r n ARG 273 N 1.73 0.14 -3.64 1.48 1.85 -1.26 0.15 116.66 117.11 1s7r n ARG 273 Ca -0.23 0.06 -0.03 0.00 -1.00 0.00 0.00 57.85 56.66 1s7r n ARG 273 Cb 0.56 -0.75 -0.04 0.00 -1.05 0.00 0.00 32.46 31.18 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 -2.23 -0.06 -1.15 2.89 -0.00 -1.26 -4.86 118.94 112.26 1s7r s TRP 274 Ca -0.08 0.09 -0.10 0.00 -0.00 0.00 0.00 56.10 56.01 1s7r s TRP 274 Cb 0.01 0.49 0.24 0.00 -0.00 0.00 0.00 33.47 34.22 1s7r s TRP 274 CO 0.12 -0.06 1.30 -1.91 -0.00 0.00 0.00 176.95 176.40 1s7r n GLU 275 N 0.41 3.60 0.00 5.86 2.13 -1.26 -5.11 120.64 126.28 1s7r n GLU 275 Ca 0.00 -4.23 0.00 0.00 0.66 0.00 0.00 57.16 53.59 1s7r n GLU 275 Cb 0.58 -2.71 0.00 0.00 0.27 0.00 0.00 31.44 29.58 1s7r n GLU 275 CO 0.00 0.00 0.00 -2.30 -0.41 0.00 0.00 177.13 174.42