#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s7x s PRO 2 N 0.00 3.01 0.16 1.61 0.02 -1.26 -4.02 135.00 134.52 1s7x s PRO 2 Ca 0.00 1.50 -0.01 0.00 0.02 0.00 0.00 61.00 62.51 1s7x s PRO 2 Cb 0.00 -1.97 -0.04 0.00 0.02 0.00 0.00 34.50 32.51 1s7x s PRO 2 CO 0.00 -1.10 0.08 -1.01 -0.33 0.00 0.00 177.00 174.64 1s7x s HIS 3 N -2.08 0.99 0.07 6.54 3.76 -0.77 -4.95 115.29 118.85 1s7x s HIS 3 Ca 0.70 -1.27 -0.24 0.00 -0.15 0.00 0.00 55.06 54.10 1s7x s HIS 3 Cb -0.22 -0.53 0.06 0.00 1.11 0.00 0.00 32.58 33.00 1s7x s HIS 3 CO 0.35 -0.53 0.57 -1.54 -0.85 0.00 0.00 174.74 172.74 1s7x s SER 4 N -3.10 -0.52 -0.00 1.40 1.04 -1.26 -1.07 113.70 110.19 1s7x s SER 4 Ca 0.29 0.19 0.04 0.00 0.48 0.00 0.00 55.95 56.95 1s7x s SER 4 Cb 0.07 0.54 -0.01 0.00 0.10 0.00 0.00 66.02 66.72 1s7x s SER 4 CO 0.05 -0.79 -0.12 -0.32 0.98 0.00 0.00 173.24 173.05 1s7x s MET 5 N -2.72 0.92 0.02 4.02 1.75 -0.27 -1.23 119.30 121.80 1s7x s MET 5 Ca -0.04 -0.44 0.00 0.00 -1.25 0.00 0.00 55.69 53.97 1s7x s MET 5 Cb -0.00 -0.89 -0.02 0.00 2.84 0.00 0.00 34.83 36.75 1s7x s MET 5 CO -0.04 0.24 -0.04 1.03 -0.65 0.00 0.00 175.02 175.57 1s7x s ARG 6 N -0.34 0.33 -0.14 4.11 1.81 -0.71 -1.70 118.95 122.30 1s7x s ARG 6 Ca 0.04 -0.58 0.01 0.00 -1.72 0.00 0.00 55.73 53.48 1s7x s ARG 6 Cb -0.05 0.02 -0.00 0.00 -0.45 0.00 0.00 34.95 34.47 1s7x s ARG 6 CO -0.00 -0.03 -0.17 0.71 -0.68 0.00 0.00 175.30 175.13 1s7x s TYR 7 N -1.31 2.73 -0.26 -0.53 1.51 0.99 -0.26 117.35 120.23 1s7x s TYR 7 Ca -0.13 -1.05 -0.04 0.00 -1.01 0.00 0.00 57.07 54.83 1s7x s TYR 7 Cb -0.09 -1.85 0.01 0.00 -0.11 0.00 0.00 41.96 39.92 1s7x s TYR 7 CO -0.01 -0.46 0.01 -0.06 -1.11 0.00 0.00 175.55 173.92 1s7x s PHE 8 N 0.69 3.08 0.07 2.71 0.40 -0.18 -1.65 117.98 123.10 1s7x s PHE 8 Ca -0.08 -1.16 0.09 0.00 -0.60 0.00 0.00 56.93 55.18 1s7x s PHE 8 Cb -0.16 -2.15 -0.03 0.00 0.51 0.00 0.00 43.02 41.18 1s7x s PHE 8 CO 0.02 -0.62 -0.23 -1.21 0.70 0.00 0.00 175.22 173.87 1s7x s GLU 9 N 1.44 1.78 -0.04 0.44 2.02 -0.14 -1.01 118.70 123.19 1s7x s GLU 9 Ca 0.02 -1.14 -0.03 0.00 0.02 0.00 0.00 54.97 53.84 1s7x s GLU 9 Cb -0.16 -2.03 0.01 0.00 0.10 0.00 0.00 34.13 32.05 1s7x s GLU 9 CO -0.01 0.50 0.10 0.99 0.02 0.00 0.00 175.26 176.86 1s7x s THR 10 N -0.93 -0.01 -0.08 3.63 2.01 0.18 -1.36 115.64 119.07 1s7x s THR 10 Ca 0.14 0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.17 1s7x s THR 10 Cb -0.10 -0.15 0.02 0.00 0.01 0.00 0.00 72.50 72.28 1s7x s THR 10 CO 0.05 0.01 -0.07 0.00 -0.69 0.00 0.00 174.62 173.92 1s7x s ALA 11 N 0.20 1.08 -0.08 7.40 0.00 -0.16 -1.04 121.76 129.17 1s7x s ALA 11 Ca -0.01 -0.35 0.04 0.00 0.00 0.00 0.00 51.96 51.64 1s7x s ALA 11 Cb -0.02 -0.71 -0.00 0.00 0.00 0.00 0.00 23.12 22.39 1s7x s ALA 11 CO -0.01 -0.22 -0.22 0.08 0.00 0.00 0.00 175.76 175.40 1s7x s VAL 12 N 1.34 1.89 -0.02 0.00 1.01 -0.33 -1.34 120.40 122.96 1s7x s VAL 12 Ca -0.03 -0.94 0.02 0.00 0.00 0.00 0.00 61.98 61.03 1s7x s VAL 12 Cb -0.14 -1.63 -0.03 0.00 0.00 0.00 0.00 36.38 34.58 1s7x s VAL 12 CO -0.03 0.52 -0.05 -0.94 0.00 0.00 0.00 175.10 174.61 1s7x s SER 13 N 0.21 4.79 0.05 3.32 1.04 -0.13 -1.14 113.70 121.83 1s7x s SER 13 Ca -0.13 -0.06 0.05 0.00 0.48 0.00 0.00 55.95 56.29 1s7x s SER 13 Cb -0.16 -1.19 -0.02 0.00 0.10 0.00 0.00 66.02 64.75 1s7x s SER 13 CO 0.06 0.31 -0.15 -0.13 0.98 0.00 0.00 173.24 174.31 1s7x s ARG 14 N -1.27 0.97 0.59 4.02 1.81 -1.26 -1.82 118.95 121.99 1s7x s ARG 14 Ca 0.16 -0.82 0.29 0.00 -1.72 0.00 0.00 55.73 53.64 1s7x s ARG 14 Cb -0.11 -1.00 1.79 0.00 -0.45 0.00 0.00 34.95 35.18 1s7x s ARG 14 CO 0.06 0.24 2.25 -1.00 -0.68 0.00 0.00 175.30 176.18 1s7x h PRO 15 N 4.79 0.00 -0.08 3.54 0.13 -1.85 -1.73 132.00 136.79 1s7x h PRO 15 Ca -0.39 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.53 1s7x h PRO 15 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1s7x h PRO 15 CO 0.43 0.00 -0.79 0.78 -0.23 0.00 0.00 178.00 178.20 1s7x h GLY 16 N 0.02 0.57 -2.77 1.56 0.00 -1.96 -3.46 103.07 97.03 1s7x h GLY 16 Ca -0.00 -0.84 -0.50 0.00 0.00 0.00 0.00 47.33 45.99 1s7x h GLY 16 CO 0.00 0.74 0.06 1.08 0.00 0.00 0.00 176.54 178.43 1s7x s LEU 17 N -8.04 3.95 0.01 3.11 1.43 -0.65 -5.02 118.68 113.48 1s7x s LEU 17 Ca -0.07 1.11 -0.16 0.00 -1.03 0.00 0.00 54.13 53.98 1s7x s LEU 17 Cb 0.10 -3.95 -0.09 0.00 0.03 0.00 0.00 46.19 42.28 1s7x s LEU 17 CO 0.86 -0.29 0.99 -0.08 0.23 0.00 0.00 176.35 178.06 1s7x h GLU 18 N 1.71 -0.56 -6.50 1.70 4.81 -1.94 -3.46 114.58 110.35 1s7x h GLU 18 Ca -0.47 0.04 -0.64 0.00 -0.13 0.00 0.00 59.36 58.16 1s7x h GLU 18 Cb 1.18 0.13 -0.16 0.00 0.63 0.00 0.00 28.75 30.53 1s7x h GLU 18 CO 0.65 -0.37 -0.77 -1.21 -0.73 0.00 0.00 179.01 176.58 1s7x s GLU 19 N -3.83 1.80 0.55 1.92 0.41 -1.26 -5.06 118.70 113.22 1s7x s GLU 19 Ca -0.08 -1.42 -0.17 0.00 -0.41 0.00 0.00 54.97 52.89 1s7x s GLU 19 Cb 0.01 -2.00 -0.06 0.00 -1.78 0.00 0.00 34.13 30.30 1s7x s GLU 19 CO 0.25 0.41 1.03 -1.25 -0.49 0.00 0.00 175.26 175.21 1s7x s PRO 20 N -2.82 3.62 -0.02 0.39 0.04 -1.26 -4.86 135.00 130.09 1s7x s PRO 20 Ca 0.23 1.14 -0.21 0.00 0.04 0.00 0.00 61.00 62.20 1s7x s PRO 20 Cb -0.08 -2.08 -0.05 0.00 0.04 0.00 0.00 34.50 32.33 1s7x s PRO 20 CO 0.13 -0.56 0.62 0.50 0.04 0.00 0.00 177.00 177.73 1s7x s ARG 21 N -3.93 4.36 -0.14 4.56 3.52 -0.29 -4.85 118.95 122.17 1s7x s ARG 21 Ca 0.62 0.76 -0.01 0.00 -0.13 0.00 0.00 55.73 56.98 1s7x s ARG 21 Cb -0.14 -3.37 -0.01 0.00 -1.56 0.00 0.00 34.95 29.87 1s7x s ARG 21 CO 0.32 0.29 -0.11 -0.47 -0.81 0.00 0.00 175.30 174.51 1s7x s TYR 22 N 0.08 2.85 -0.03 5.12 5.04 -1.26 -1.18 117.35 127.97 1s7x s TYR 22 Ca 0.32 -0.66 0.02 0.00 -2.44 0.00 0.00 57.07 54.32 1s7x s TYR 22 Cb -0.18 -1.88 0.00 0.00 0.35 0.00 0.00 41.96 40.25 1s7x s TYR 22 CO 0.17 -0.24 -0.08 0.42 -1.34 0.00 0.00 175.55 174.48 1s7x s ILE 23 N 0.47 0.74 -0.03 3.14 1.01 -0.21 -1.90 121.20 124.43 1s7x s ILE 23 Ca -0.08 -0.33 0.06 0.00 0.00 0.00 0.00 60.65 60.29 1s7x s ILE 23 Cb -0.16 -0.66 -0.01 0.00 0.01 0.00 0.00 42.46 41.64 1s7x s ILE 23 CO 0.04 0.23 -0.20 -0.55 0.00 0.00 0.00 174.94 174.46 1s7x s SER 24 N 0.22 2.43 -0.06 3.58 0.15 -0.75 -0.65 113.70 118.62 1s7x s SER 24 Ca -0.03 -0.38 -0.01 0.00 0.70 0.00 0.00 55.95 56.22 1s7x s SER 24 Cb -0.08 -0.41 0.03 0.00 -1.71 0.00 0.00 66.02 63.84 1s7x s SER 24 CO 0.00 0.23 0.01 -0.69 1.20 0.00 0.00 173.24 173.99 1s7x s VAL 25 N -0.33 0.31 0.05 4.45 1.01 -0.18 -1.66 120.40 124.06 1s7x s VAL 25 Ca 0.04 0.15 -0.12 0.00 0.00 0.00 0.00 61.98 62.05 1s7x s VAL 25 Cb -0.09 -0.47 -0.06 0.00 0.00 0.00 0.00 36.38 35.76 1s7x s VAL 25 CO 0.00 0.24 0.41 -0.83 0.00 0.00 0.00 175.10 174.92 1s7x s GLY 26 N 1.89 2.40 0.01 4.51 0.00 -0.80 -1.01 107.32 114.31 1s7x s GLY 26 Ca 0.03 -0.31 0.03 0.00 0.00 0.00 0.00 44.72 44.47 1s7x s GLY 26 CO -0.04 -0.03 -0.09 -0.19 0.00 0.00 0.00 173.10 172.74 1s7x s TYR 27 N -1.28 0.81 -0.12 1.90 1.51 0.65 -1.37 117.35 119.45 1s7x s TYR 27 Ca 0.30 -0.22 0.03 0.00 -1.01 0.00 0.00 57.07 56.17 1s7x s TYR 27 Cb -0.15 -0.51 0.00 0.00 -0.11 0.00 0.00 41.96 41.20 1s7x s TYR 27 CO 0.16 -0.01 -0.23 0.08 -1.11 0.00 0.00 175.55 174.44 1s7x s VAL 28 N -0.45 2.08 -1.48 0.71 1.01 -0.79 -1.74 120.40 119.75 1s7x s VAL 28 Ca 0.01 -0.99 -0.08 0.00 0.00 0.00 0.00 61.98 60.92 1s7x s VAL 28 Cb -0.05 -1.81 0.06 0.00 0.00 0.00 0.00 36.38 34.58 1s7x s VAL 28 CO 0.00 0.55 0.73 0.47 0.00 0.00 0.00 175.10 176.85 1s7x n ASP 29 N 3.79 -2.44 0.00 3.32 9.92 -0.36 -1.21 116.55 129.57 1s7x n ASP 29 Ca -0.19 -0.90 0.00 0.00 -0.53 0.00 0.00 54.79 53.17 1s7x n ASP 29 Cb 0.52 -3.48 0.00 0.00 -0.64 0.00 0.00 41.12 37.52 1s7x n ASP 29 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1s7x n ASN 30 N -2.89 -5.20 -4.74 -2.24 4.13 -1.26 -4.98 115.26 98.08 1s7x n ASN 30 Ca -0.13 0.00 -0.35 0.00 1.68 0.00 0.00 54.58 55.78 1s7x n ASN 30 Cb 0.60 -2.84 -0.08 0.00 -1.54 0.00 0.00 39.78 35.92 1s7x n ASN 30 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1s7x s LYS 31 N -1.55 3.86 0.07 3.52 1.02 -0.35 -5.05 119.74 121.27 1s7x s LYS 31 Ca 0.00 -0.25 -0.31 0.00 0.02 0.00 0.00 55.97 55.44 1s7x s LYS 31 Cb 0.00 -3.26 -0.08 0.00 -0.52 0.00 0.00 37.83 33.97 1s7x s LYS 31 CO 0.00 0.44 1.56 -2.00 -0.92 0.00 0.00 175.35 174.43 1s7x s GLU 32 N -0.06 4.23 0.00 1.68 2.12 -1.26 -1.89 118.70 123.52 1s7x s GLU 32 Ca 0.09 2.23 0.00 0.00 0.36 0.00 0.00 54.97 57.65 1s7x s GLU 32 Cb -0.12 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 30.78 1s7x s GLU 32 CO 0.00 -0.65 0.00 1.97 -0.54 0.00 0.00 175.26 176.04 1s7x n PHE 33 N 5.14 0.00 -4.05 5.30 -1.74 -0.47 -4.00 117.46 117.64 1s7x n PHE 33 Ca 0.15 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.94 1s7x n PHE 33 Cb 0.41 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.33 1s7x n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1s7x s VAL 34 N -1.71 0.06 -0.28 1.97 -7.23 -1.21 -1.52 120.40 110.48 1s7x s VAL 34 Ca 0.00 -1.61 -0.23 0.00 -1.81 0.00 0.00 61.98 58.33 1s7x s VAL 34 Cb 0.00 -2.02 0.11 0.00 0.56 0.00 0.00 36.38 35.02 1s7x s VAL 34 CO 0.00 -0.27 0.90 -0.60 -0.31 0.00 0.00 175.10 174.81 1s7x s ARG 35 N -4.02 0.61 -0.02 4.82 3.52 -0.91 -1.91 118.95 121.04 1s7x s ARG 35 Ca 0.23 0.80 0.04 0.00 -0.13 0.00 0.00 55.73 56.67 1s7x s ARG 35 Cb 0.05 0.25 -0.01 0.00 -1.56 0.00 0.00 34.95 33.68 1s7x s ARG 35 CO 0.03 -0.08 -0.15 0.12 -0.81 0.00 0.00 175.30 174.41 1s7x s PHE 36 N 0.60 1.35 -0.15 5.12 2.19 -0.67 -1.06 117.98 125.35 1s7x s PHE 36 Ca -0.01 -0.28 -0.04 0.00 0.33 0.00 0.00 56.93 56.93 1s7x s PHE 36 Cb -0.05 -0.88 0.07 0.00 -1.31 0.00 0.00 43.02 40.86 1s7x s PHE 36 CO -0.07 -0.05 0.22 0.34 1.83 0.00 0.00 175.22 177.49 1s7x s ASP 37 N -0.25 0.90 0.35 6.13 -1.08 -1.26 -1.81 116.67 119.64 1s7x s ASP 37 Ca 0.04 0.17 0.27 0.00 -0.52 0.00 0.00 52.55 52.50 1s7x s ASP 37 Cb -0.07 0.46 1.15 0.00 -1.46 0.00 0.00 42.92 43.01 1s7x s ASP 37 CO -0.00 -0.28 1.80 0.77 0.52 0.00 0.00 175.17 177.97 1s7x h SER 38 N 8.32 0.00 1.11 -0.34 4.64 -1.78 -2.74 113.55 122.76 1s7x h SER 38 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1s7x h SER 38 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1s7x h SER 38 CO 0.20 0.00 0.00 0.44 -0.87 0.00 0.00 176.83 176.60 1s7x h ASP 39 N 0.00 0.00 -4.31 4.97 5.19 -1.96 -3.46 116.42 116.85 1s7x h ASP 39 Ca 0.00 0.00 -0.51 0.00 -0.62 0.00 0.00 57.03 55.90 1s7x h ASP 39 Cb 0.34 0.00 0.12 0.00 0.18 0.00 0.00 39.33 39.98 1s7x h ASP 39 CO 0.00 0.00 0.33 0.00 -3.12 0.00 0.00 179.24 176.45 1s7x s ALA 40 N -3.23 2.35 0.12 3.45 0.00 -1.03 -4.98 121.76 118.43 1s7x s ALA 40 Ca 0.07 0.25 -0.16 0.00 0.00 0.00 0.00 51.96 52.13 1s7x s ALA 40 Cb 0.10 -3.26 -0.02 0.00 0.00 0.00 0.00 23.12 19.94 1s7x s ALA 40 CO 0.50 -1.63 1.61 1.49 0.00 0.00 0.00 175.76 177.72 1s7x h GLU 41 N -0.97 0.62 -3.34 0.00 4.81 -1.90 -3.33 114.58 110.48 1s7x h GLU 41 Ca -0.44 -0.16 -0.64 0.00 -0.13 0.00 0.00 59.36 57.98 1s7x h GLU 41 Cb 1.23 -0.07 -0.40 0.00 0.63 0.00 0.00 28.75 30.13 1s7x h GLU 41 CO 0.52 0.68 -0.57 1.21 -0.73 0.00 0.00 179.01 180.12 1s7x s ASN 42 N -6.03 4.56 0.02 1.04 2.47 -1.26 -5.09 114.94 110.65 1s7x s ASN 42 Ca -0.13 -3.20 -0.30 0.00 0.42 0.00 0.00 52.86 49.65 1s7x s ASN 42 Cb 0.10 -1.67 -0.07 0.00 -1.45 0.00 0.00 41.25 38.15 1s7x s ASN 42 CO 0.77 -0.21 1.72 -2.84 -3.72 0.00 0.00 177.10 172.81 1s7x s PRO 43 N -0.55 4.18 0.04 0.43 0.02 -1.25 -4.96 135.00 132.90 1s7x s PRO 43 Ca 0.19 2.33 -0.23 0.00 0.02 0.00 0.00 61.00 63.32 1s7x s PRO 43 Cb -0.20 -3.86 0.05 0.00 0.02 0.00 0.00 34.50 30.51 1s7x s PRO 43 CO -0.04 -0.82 0.52 1.03 -0.33 0.00 0.00 177.00 177.36 1s7x s ARG 44 N 3.54 1.02 0.18 5.54 0.52 -1.26 -5.02 118.95 123.47 1s7x s ARG 44 Ca 0.77 -0.20 -0.31 0.00 -0.52 0.00 0.00 55.73 55.47 1s7x s ARG 44 Cb -0.38 0.46 -0.09 0.00 0.52 0.00 0.00 34.95 35.46 1s7x s ARG 44 CO 0.33 -0.36 1.45 0.71 0.02 0.00 0.00 175.30 177.45 1s7x s TYR 45 N -2.29 3.12 0.13 -0.53 2.02 -1.26 -4.38 117.35 114.16 1s7x s TYR 45 Ca -0.06 0.92 0.07 0.00 -0.37 0.00 0.00 57.07 57.63 1s7x s TYR 45 Cb -0.01 -3.79 -0.04 0.00 -0.40 0.00 0.00 41.96 37.73 1s7x s TYR 45 CO -0.01 -2.71 -0.16 -1.21 -1.57 0.00 0.00 175.55 169.89 1s7x s GLU 46 N 0.47 1.12 0.57 -0.62 0.41 -0.23 -4.94 118.70 115.48 1s7x s GLU 46 Ca 0.63 -1.28 -0.17 0.00 -0.41 0.00 0.00 54.97 53.75 1s7x s GLU 46 Cb -0.40 -1.12 -0.05 0.00 -1.78 0.00 0.00 34.13 30.78 1s7x s GLU 46 CO 0.36 0.23 1.06 -1.25 -0.49 0.00 0.00 175.26 175.16 1s7x s PRO 47 N -2.58 3.42 0.00 0.39 0.04 -1.26 -2.15 135.00 132.86 1s7x s PRO 47 Ca 0.11 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.42 1s7x s PRO 47 Cb -0.06 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1s7x s PRO 47 CO 0.04 -0.74 0.00 0.54 0.04 0.00 0.00 177.00 176.89 1s7x n ARG 48 N -1.75 3.42 -4.31 4.56 5.12 -0.58 -4.90 116.66 118.24 1s7x n ARG 48 Ca 0.09 0.00 -0.21 0.00 -1.93 0.00 0.00 57.85 55.80 1s7x n ARG 48 Cb 0.53 -0.42 -0.11 0.00 -1.16 0.00 0.00 32.46 31.29 1s7x n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1s7x s ALA 49 N -0.70 1.86 0.44 7.54 0.00 -1.26 -4.80 121.76 124.86 1s7x s ALA 49 Ca 0.00 -1.42 0.11 0.00 0.00 0.00 0.00 51.96 50.66 1s7x s ALA 49 Cb 0.00 -0.17 0.99 0.00 0.00 0.00 0.00 23.12 23.95 1s7x s ALA 49 CO 0.00 0.22 2.05 -1.35 0.00 0.00 0.00 175.76 176.68 1s7x h PRO 50 N 3.41 0.25 -0.11 0.00 0.11 -1.96 -2.22 132.00 131.48 1s7x h PRO 50 Ca -0.42 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.62 1s7x h PRO 50 Cb 1.20 -0.05 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1s7x h PRO 50 CO 0.50 0.23 -0.13 0.11 -0.21 0.00 0.00 178.00 178.50 1s7x h TRP 51 N 0.26 0.18 0.00 0.65 5.08 -1.97 -2.19 115.95 117.96 1s7x h TRP 51 Ca 0.07 -0.02 0.00 0.00 1.08 0.00 0.00 58.89 60.02 1s7x h TRP 51 Cb 0.08 -0.05 0.00 0.00 -3.00 0.00 0.00 29.16 26.19 1s7x h TRP 51 CO 0.00 0.31 -0.12 1.98 -1.28 0.00 0.00 178.44 179.33 1s7x h MET 52 N 0.17 0.00 0.00 0.12 4.05 -1.75 -3.19 114.93 114.33 1s7x h MET 52 Ca 0.04 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.46 1s7x h MET 52 Cb 0.33 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.13 1s7x h MET 52 CO 0.02 0.00 0.00 0.39 0.23 0.00 0.00 176.91 177.55 1s7x n GLU 53 N -2.87 0.18 0.05 0.39 -0.58 -0.82 -2.36 120.64 114.64 1s7x n GLU 53 Ca 0.04 0.00 -0.20 0.00 -0.42 0.00 0.00 57.16 56.58 1s7x n GLU 53 Cb 0.51 -1.45 -0.14 0.00 -0.57 0.00 0.00 31.44 29.79 1s7x n GLU 53 CO 0.00 0.00 0.00 0.37 -0.48 0.00 0.00 177.13 177.02 1s7x h GLN 54 N 0.00 0.35 -6.66 3.49 4.15 -1.69 -3.49 115.11 111.27 1s7x h GLN 54 Ca 0.00 -0.55 -0.56 0.00 0.77 0.00 0.00 58.65 58.31 1s7x h GLN 54 Cb 0.00 0.20 0.18 0.00 0.21 0.00 0.00 27.48 28.07 1s7x h GLN 54 CO 0.00 1.24 -0.35 0.39 -1.93 0.00 0.00 178.83 178.18 1s7x n GLU 55 N -4.10 0.37 -2.10 1.69 -0.58 -0.99 -4.98 120.64 109.94 1s7x n GLU 55 Ca -0.13 0.16 -0.27 0.00 -0.42 0.00 0.00 57.16 56.50 1s7x n GLU 55 Cb 0.83 -1.84 0.10 0.00 -0.57 0.00 0.00 31.44 29.95 1s7x n GLU 55 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1s7x s GLY 56 N -1.43 1.69 0.26 0.62 0.00 -1.26 -4.98 107.32 102.22 1s7x s GLY 56 Ca 0.67 -0.98 -0.01 0.00 0.00 0.00 0.00 44.72 44.40 1s7x s GLY 56 CO 0.57 -0.47 1.79 -2.55 0.00 0.00 0.00 173.10 172.44 1s7x h PRO 57 N -0.92 0.71 0.00 2.90 0.11 -2.01 -3.14 132.00 129.65 1s7x h PRO 57 Ca -0.44 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.55 1s7x h PRO 57 Cb 1.30 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 1s7x h PRO 57 CO 0.56 0.47 -0.38 1.49 -0.21 0.00 0.00 178.00 179.92 1s7x h GLU 58 N 0.73 0.00 -0.65 1.05 4.81 -1.99 -1.37 114.58 117.16 1s7x h GLU 58 Ca 0.46 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.65 1s7x h GLU 58 Cb 0.57 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 1s7x h GLU 58 CO -0.32 0.38 0.24 -0.92 -0.73 0.00 0.00 179.01 177.66 1s7x h TYR 59 N 0.00 1.02 -0.06 0.92 5.03 -1.94 -2.50 116.97 119.44 1s7x h TYR 59 Ca -0.00 -0.09 -0.19 0.00 2.58 0.00 0.00 58.73 61.03 1s7x h TYR 59 Cb 1.06 -0.30 -0.00 0.00 1.55 0.00 0.00 36.73 39.03 1s7x h TYR 59 CO 0.00 0.81 -0.77 -1.49 -1.32 0.00 0.00 178.16 175.39 1s7x h TRP 60 N 0.93 0.52 -0.33 -3.82 4.06 -1.48 -2.85 115.95 112.98 1s7x h TRP 60 Ca 0.21 -0.24 -0.02 0.00 2.06 0.00 0.00 58.89 60.90 1s7x h TRP 60 Cb 0.24 -0.08 -0.01 0.00 -1.00 0.00 0.00 29.16 28.31 1s7x h TRP 60 CO 0.02 1.01 0.11 0.93 -3.56 0.00 0.00 178.44 176.94 1s7x h GLU 61 N 0.25 0.51 -0.24 0.49 5.08 -1.27 -2.49 114.58 116.92 1s7x h GLU 61 Ca -0.04 -0.11 -0.16 0.00 -1.00 0.00 0.00 59.36 58.05 1s7x h GLU 61 Cb 1.35 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1s7x h GLU 61 CO 0.13 0.54 -0.49 -0.09 -1.00 0.00 0.00 179.01 178.10 1s7x h ARG 62 N 0.38 0.75 0.00 2.33 1.12 -1.46 -2.46 114.38 115.04 1s7x h ARG 62 Ca 0.11 -0.49 -0.08 0.00 -1.11 0.00 0.00 59.98 58.41 1s7x h ARG 62 Cb 0.23 0.06 -0.01 0.00 -0.01 0.00 0.00 29.97 30.24 1s7x h ARG 62 CO -0.00 1.11 -0.37 0.93 -3.11 0.00 0.00 179.97 178.53 1s7x h GLU 63 N 0.49 0.00 -0.37 0.20 4.39 -1.57 -2.06 114.58 115.66 1s7x h GLU 63 Ca 0.01 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.54 1s7x h GLU 63 Cb 1.09 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.74 1s7x h GLU 63 CO 0.11 0.37 -0.41 1.15 -1.16 0.00 0.00 179.01 179.07 1s7x h THR 64 N 0.00 1.27 -0.11 1.13 2.02 -1.13 -1.41 112.91 114.69 1s7x h THR 64 Ca -0.00 -1.58 -0.09 0.00 0.77 0.00 0.00 66.41 65.51 1s7x h THR 64 Cb 0.66 1.42 -0.01 0.00 -1.74 0.00 0.00 68.15 68.48 1s7x h THR 64 CO 0.05 0.53 -0.33 1.56 0.37 0.00 0.00 175.52 177.69 1s7x h GLN 65 N 0.74 0.21 0.11 6.66 1.08 -1.27 -0.84 115.11 121.81 1s7x h GLN 65 Ca 0.05 -0.08 -0.00 0.00 -1.45 0.00 0.00 58.65 57.17 1s7x h GLN 65 Cb 1.01 -0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 28.42 1s7x h GLN 65 CO 0.10 0.53 -0.08 -0.22 -0.95 0.00 0.00 178.83 178.21 1s7x h LYS 66 N 0.18 -0.18 -0.33 1.46 3.64 -1.15 -2.51 116.57 117.69 1s7x h LYS 66 Ca 0.02 0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 1s7x h LYS 66 Cb 0.69 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.53 1s7x h LYS 66 CO 0.05 -0.12 -0.03 0.00 -2.27 0.00 0.00 179.45 177.08 1s7x h ALA 67 N 0.70 1.33 -0.23 5.00 0.00 -0.77 -1.13 119.26 124.17 1s7x h ALA 67 Ca -0.01 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 1s7x h ALA 67 Cb 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1s7x h ALA 67 CO 0.00 0.46 -0.20 0.87 0.00 0.00 0.00 179.25 180.38 1s7x h LYS 68 N 0.50 0.40 -0.33 0.00 1.57 -1.09 -0.20 116.57 117.42 1s7x h LYS 68 Ca 0.11 -0.13 -0.13 0.00 -1.87 0.00 0.00 60.65 58.62 1s7x h LYS 68 Cb 0.37 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 1s7x h LYS 68 CO 0.01 0.59 -0.32 0.78 -0.57 0.00 0.00 179.45 179.95 1s7x h GLY 69 N 0.96 0.88 1.15 3.86 0.00 -0.89 -2.91 103.07 106.11 1s7x h GLY 69 Ca 0.06 -0.89 0.00 0.00 0.00 0.00 0.00 47.33 46.50 1s7x h GLY 69 CO 0.04 0.80 0.53 1.46 0.00 0.00 0.00 176.54 179.37 1s7x h GLN 70 N 0.58 1.13 -0.64 4.80 1.08 -1.01 -1.17 115.11 119.88 1s7x h GLN 70 Ca 0.05 -0.09 -0.04 0.00 -1.45 0.00 0.00 58.65 57.13 1s7x h GLN 70 Cb 0.90 -0.24 -0.03 0.00 -0.05 0.00 0.00 27.48 28.06 1s7x h GLN 70 CO 0.08 0.77 0.26 1.49 -0.95 0.00 0.00 178.83 180.49 1s7x h GLU 71 N 1.15 0.96 -0.57 1.46 4.81 -0.98 -1.30 114.58 120.10 1s7x h GLU 71 Ca 0.31 -0.17 -0.10 0.00 -0.13 0.00 0.00 59.36 59.27 1s7x h GLU 71 Cb -0.08 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 29.12 1s7x h GLU 71 CO -0.06 0.80 -0.02 1.96 -0.73 0.00 0.00 179.01 180.95 1s7x h GLN 72 N 0.90 1.02 -0.79 1.92 1.08 -1.29 -1.70 115.11 116.26 1s7x h GLN 72 Ca 0.22 -0.33 0.06 0.00 -1.45 0.00 0.00 58.65 57.15 1s7x h GLN 72 Cb 0.19 -0.09 -0.06 0.00 -0.05 0.00 0.00 27.48 27.47 1s7x h GLN 72 CO -0.02 1.01 0.48 2.35 -0.95 0.00 0.00 178.83 181.70 1s7x h TRP 73 N 0.93 0.88 -0.10 2.96 7.01 -0.79 -1.14 115.95 125.69 1s7x h TRP 73 Ca 0.16 0.03 -0.23 0.00 2.11 0.00 0.00 58.89 60.96 1s7x h TRP 73 Cb 0.57 -0.28 0.01 0.00 -2.10 0.00 0.00 29.16 27.36 1s7x h TRP 73 CO 0.04 0.45 -0.84 0.74 -2.79 0.00 0.00 178.44 176.03 1s7x h PHE 74 N 0.87 0.97 -0.70 2.65 -1.00 -1.01 -1.62 116.94 117.11 1s7x h PHE 74 Ca 0.34 -0.46 0.02 0.00 2.81 0.00 0.00 57.97 60.68 1s7x h PHE 74 Cb 0.16 -0.14 -0.04 0.00 3.61 0.00 0.00 35.95 39.54 1s7x h PHE 74 CO -0.05 1.28 0.45 -0.09 -1.61 0.00 0.00 178.31 178.29 1s7x h ARG 75 N 0.45 0.88 -0.26 1.51 2.43 -1.01 0.45 114.38 118.84 1s7x h ARG 75 Ca -0.07 -0.05 -0.07 0.00 -0.81 0.00 0.00 59.98 58.98 1s7x h ARG 75 Cb 1.47 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1s7x h ARG 75 CO 0.17 0.58 -0.10 0.28 -1.51 0.00 0.00 179.97 179.40 1s7x h VAL 76 N 0.91 1.29 -0.21 0.20 2.07 -1.09 -2.81 116.25 116.61 1s7x h VAL 76 Ca 0.27 -1.15 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 1s7x h VAL 76 Cb -0.06 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.21 1s7x h VAL 76 CO -0.08 0.36 0.04 0.28 0.02 0.00 0.00 177.57 178.19 1s7x h SER 77 N 0.25 0.33 -0.70 0.57 0.02 -1.19 -2.18 113.55 110.66 1s7x h SER 77 Ca 0.06 -0.26 0.15 0.00 -0.84 0.00 0.00 61.79 60.90 1s7x h SER 77 Cb 0.59 -0.09 -0.11 0.00 0.14 0.00 0.00 62.40 62.93 1s7x h SER 77 CO 0.03 0.50 0.13 -0.07 -1.14 0.00 0.00 176.83 176.28 1s7x h LEU 78 N 0.15 -0.07 -0.31 5.07 4.07 -0.93 -0.52 115.31 122.78 1s7x h LEU 78 Ca 0.06 0.15 -0.00 0.00 0.08 0.00 0.00 57.88 58.17 1s7x h LEU 78 Cb 0.31 0.22 -0.01 0.00 1.08 0.00 0.00 40.66 42.25 1s7x h LEU 78 CO 0.00 -0.06 0.19 -0.09 -1.08 0.00 0.00 178.44 177.41 1s7x h ARG 79 N 0.23 0.42 -0.63 1.13 2.43 -1.26 -2.63 114.38 114.05 1s7x h ARG 79 Ca 0.39 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.48 1s7x h ARG 79 Cb 0.65 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 1s7x h ARG 79 CO -0.51 0.31 0.24 -0.91 -1.51 0.00 0.00 179.97 177.59 1s7x h ASN 80 N 0.40 0.88 -0.76 -3.80 2.35 -0.71 -2.99 115.58 110.95 1s7x h ASN 80 Ca 0.11 -0.18 0.04 0.00 -0.55 0.00 0.00 56.30 55.72 1s7x h ASN 80 Cb 0.00 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.10 1s7x h ASN 80 CO -0.02 0.83 0.50 -0.07 -1.65 0.00 0.00 177.43 177.01 1s7x h LEU 81 N 0.89 0.77 -0.36 1.61 3.38 -0.96 -0.24 115.31 120.41 1s7x h LEU 81 Ca 0.21 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.24 1s7x h LEU 81 Cb 0.23 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 1s7x h LEU 81 CO -0.01 0.52 -0.03 0.25 0.09 0.00 0.00 178.44 179.26 1s7x h LEU 82 N 0.89 -0.21 -0.08 1.67 5.85 -1.32 -0.76 115.31 121.35 1s7x h LEU 82 Ca 0.31 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 59.11 1s7x h LEU 82 Cb 0.10 0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 1s7x h LEU 82 CO -0.09 -0.07 0.00 1.23 -0.34 0.00 0.00 178.44 179.17 1s7x h GLY 83 N 0.06 0.15 -0.08 3.75 0.00 -1.41 -0.13 103.07 105.41 1s7x h GLY 83 Ca 0.17 -0.10 0.21 0.00 0.00 0.00 0.00 47.33 47.61 1s7x h GLY 83 CO -0.32 0.10 0.48 -0.97 0.00 0.00 0.00 176.54 175.83 1s7x h TYR 84 N -0.13 0.82 -0.54 5.60 0.05 -0.76 -2.18 116.97 119.82 1s7x h TYR 84 Ca 0.02 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.84 1s7x h TYR 84 Cb 0.32 -0.22 0.00 0.00 1.01 0.00 0.00 36.73 37.84 1s7x h TYR 84 CO 0.03 0.05 0.00 0.66 -1.05 0.00 0.00 178.16 177.85 1s7x n TYR 85 N -4.94 0.72 -3.73 4.88 4.01 -0.32 -4.82 117.16 112.96 1s7x n TYR 85 Ca 0.23 -0.40 -0.23 0.00 -0.16 0.00 0.00 57.90 57.34 1s7x n TYR 85 Cb 0.64 -0.00 0.03 0.00 -0.31 0.00 0.00 39.34 39.70 1s7x n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1s7x n ASN 86 N 1.42 -2.17 -4.81 7.72 5.15 -0.44 -4.95 115.26 117.18 1s7x n ASN 86 Ca 0.21 -0.79 -0.37 0.00 -0.60 0.00 0.00 54.58 53.02 1s7x n ASN 86 Cb 0.58 -4.10 -0.06 0.00 -0.53 0.00 0.00 39.78 35.67 1s7x n ASN 86 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1s7x s GLN 87 N -6.11 3.90 0.28 1.20 -0.21 -0.19 -5.05 119.66 113.49 1s7x s GLN 87 Ca 0.17 0.14 0.00 0.00 0.02 0.00 0.00 55.36 55.69 1s7x s GLN 87 Cb -0.08 -3.29 0.06 0.00 1.00 0.00 0.00 33.01 30.70 1s7x s GLN 87 CO 0.81 0.55 0.39 0.43 -2.12 0.00 0.00 175.29 175.35 1s7x n SER 88 N 2.51 0.55 -4.83 5.90 7.64 -1.26 -4.70 113.62 119.42 1s7x n SER 88 Ca -0.15 -1.46 -0.33 0.00 1.01 0.00 0.00 58.87 57.95 1s7x n SER 88 Cb 0.53 -0.25 -0.06 0.00 -1.01 0.00 0.00 64.21 63.42 1s7x n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1s7x s ALA 89 N -2.88 3.12 0.00 -0.43 0.00 -1.26 -4.34 121.76 115.97 1s7x s ALA 89 Ca 0.26 0.25 0.00 0.00 0.00 0.00 0.00 51.96 52.47 1s7x s ALA 89 Cb -0.02 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 20.07 1s7x s ALA 89 CO 0.17 0.10 0.00 0.41 0.00 0.00 0.00 175.76 176.45 1s7x n GLY 90 N -0.78 0.90 3.90 0.00 0.00 -1.26 -5.11 105.19 102.84 1s7x n GLY 90 Ca 0.06 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 1s7x n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1s7x s GLY 91 N -0.98 1.35 0.01 -0.02 0.00 -1.26 -4.75 107.32 101.67 1s7x s GLY 91 Ca 0.00 -1.35 -0.14 0.00 0.00 0.00 0.00 44.72 43.23 1s7x s GLY 91 CO 0.00 -1.36 0.41 -0.56 0.00 0.00 0.00 173.10 171.58 1s7x s SER 92 N -3.94 6.79 0.04 1.64 0.01 -1.26 -3.55 113.70 113.43 1s7x s SER 92 Ca 0.35 0.95 0.01 0.00 1.31 0.00 0.00 55.95 58.56 1s7x s SER 92 Cb -0.08 -2.24 -0.03 0.00 0.21 0.00 0.00 66.02 63.88 1s7x s SER 92 CO 0.27 0.31 -0.06 -1.00 0.41 0.00 0.00 173.24 173.17 1s7x s HIS 93 N -1.12 0.54 -0.02 2.43 0.09 -0.75 -5.00 115.29 111.46 1s7x s HIS 93 Ca 0.25 -0.58 0.01 0.00 -0.00 0.00 0.00 55.06 54.74 1s7x s HIS 93 Cb -0.16 -0.34 0.01 0.00 -0.00 0.00 0.00 32.58 32.09 1s7x s HIS 93 CO 0.14 -0.14 -0.04 0.99 -0.00 0.00 0.00 174.74 175.68 1s7x s THR 94 N -1.77 0.40 -0.07 1.30 2.01 -1.26 -0.95 115.64 115.30 1s7x s THR 94 Ca -0.09 -0.13 0.02 0.00 0.31 0.00 0.00 61.69 61.80 1s7x s THR 94 Cb -0.07 -0.40 0.01 0.00 0.01 0.00 0.00 72.50 72.05 1s7x s THR 94 CO -0.01 0.16 -0.13 -0.22 -0.69 0.00 0.00 174.62 173.72 1s7x s LEU 95 N 0.42 1.66 0.11 4.42 2.96 -0.45 -1.47 118.68 126.34 1s7x s LEU 95 Ca -0.05 -0.33 0.06 0.00 -0.22 0.00 0.00 54.13 53.59 1s7x s LEU 95 Cb -0.08 -0.90 -0.04 0.00 0.50 0.00 0.00 46.19 45.67 1s7x s LEU 95 CO -0.00 0.03 -0.15 -1.10 -1.32 0.00 0.00 176.35 173.81 1s7x s GLN 96 N 0.72 1.01 -0.02 1.98 -0.21 -0.13 -0.98 119.66 122.02 1s7x s GLN 96 Ca -0.13 -1.20 -0.02 0.00 0.02 0.00 0.00 55.36 54.03 1s7x s GLN 96 Cb -0.16 -0.93 0.01 0.00 1.00 0.00 0.00 33.01 32.93 1s7x s GLN 96 CO 0.03 0.18 0.06 -1.14 -2.12 0.00 0.00 175.29 172.31 1s7x s GLN 97 N -2.50 0.07 -0.09 2.91 0.74 -0.47 -1.39 119.66 118.93 1s7x s GLN 97 Ca 0.07 0.10 0.03 0.00 0.05 0.00 0.00 55.36 55.61 1s7x s GLN 97 Cb -0.06 0.01 0.01 0.00 1.10 0.00 0.00 33.01 34.07 1s7x s GLN 97 CO 0.03 -0.02 -0.18 -1.64 -0.55 0.00 0.00 175.29 172.93 1s7x s MET 98 N 0.13 2.35 0.03 1.67 -1.94 -0.19 -0.97 119.30 120.38 1s7x s MET 98 Ca -0.01 -0.63 -0.12 0.00 -1.71 0.00 0.00 55.69 53.22 1s7x s MET 98 Cb -0.01 -1.86 0.01 0.00 2.01 0.00 0.00 34.83 34.97 1s7x s MET 98 CO -0.00 0.07 0.25 -1.54 -0.01 0.00 0.00 175.02 173.79 1s7x s SER 99 N 0.59 -0.06 0.00 3.03 1.04 -0.66 -1.19 113.70 116.45 1s7x s SER 99 Ca -0.15 -0.23 0.00 0.00 0.48 0.00 0.00 55.95 56.05 1s7x s SER 99 Cb -0.17 0.31 0.00 0.00 0.10 0.00 0.00 66.02 66.27 1s7x s SER 99 CO 0.05 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.32 1s7x n GLY 100 N 0.75 0.01 3.06 7.32 0.00 -0.79 -0.00 105.19 115.54 1s7x n GLY 100 Ca -0.19 -1.45 -0.08 0.00 0.00 0.00 0.00 46.02 44.30 1s7x n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s7x s ASP 102 N -2.35 3.75 -0.06 0.00 1.01 -0.18 -1.11 116.67 117.73 1s7x s ASP 102 Ca -0.02 -0.46 -0.02 0.00 0.71 0.00 0.00 52.55 52.77 1s7x s ASP 102 Cb 0.01 -1.59 -0.04 0.00 1.01 0.00 0.00 42.92 42.32 1s7x s ASP 102 CO -0.06 0.07 0.04 -0.76 0.21 0.00 0.00 175.17 174.66 1s7x s LEU 103 N 0.92 3.74 1.23 1.23 1.43 -0.23 0.21 118.68 127.22 1s7x s LEU 103 Ca -0.03 0.16 -0.20 0.00 -1.03 0.00 0.00 54.13 53.02 1s7x s LEU 103 Cb -0.15 -1.99 0.30 0.00 0.03 0.00 0.00 46.19 44.38 1s7x s LEU 103 CO -0.01 0.34 1.12 -0.83 0.23 0.00 0.00 176.35 177.19 1s7x s GLY 104 N -1.23 1.59 0.58 -3.19 0.00 -0.74 -1.85 107.32 102.49 1s7x s GLY 104 Ca 0.17 -1.06 0.37 0.00 0.00 0.00 0.00 44.72 44.19 1s7x s GLY 104 CO 0.07 -0.13 2.10 1.48 0.00 0.00 0.00 173.10 176.62 1s7x h SER 105 N -2.68 0.00 0.26 1.64 4.64 -1.91 -0.29 113.55 115.20 1s7x h SER 105 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1s7x h SER 105 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.37 1s7x h SER 105 CO 0.30 0.01 0.00 -0.90 -0.87 0.00 0.00 176.83 175.37 1s7x n ASP 106 N -3.12 0.00 -0.10 4.97 5.68 -1.26 -4.88 116.55 117.84 1s7x n ASP 106 Ca -0.01 -0.56 -0.01 0.00 -0.50 0.00 0.00 54.79 53.72 1s7x n ASP 106 Cb 0.24 -0.14 -0.01 0.00 -1.14 0.00 0.00 41.12 40.08 1s7x n ASP 106 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1s7x n TRP 107 N -1.14 0.00 -3.62 2.11 7.02 -0.12 -5.03 117.44 116.67 1s7x n TRP 107 Ca 0.18 0.00 -0.31 0.00 -1.02 0.00 0.00 57.50 56.36 1s7x n TRP 107 Cb 0.16 -0.59 -0.04 0.00 -2.42 0.00 0.00 31.31 28.42 1s7x n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1s7x s ARG 108 N -1.01 3.63 -0.11 -0.99 1.81 -1.26 -4.82 118.95 116.20 1s7x s ARG 108 Ca 0.00 -0.07 -0.33 0.00 -1.72 0.00 0.00 55.73 53.61 1s7x s ARG 108 Cb 0.00 -2.80 -0.10 0.00 -0.45 0.00 0.00 34.95 31.59 1s7x s ARG 108 CO 0.00 0.42 1.97 -0.11 -0.68 0.00 0.00 175.30 176.89 1s7x n LEU 109 N -0.13 3.44 -0.02 2.53 7.94 -1.26 -1.80 117.00 127.70 1s7x n LEU 109 Ca -0.02 0.83 -0.22 0.00 -1.11 0.00 0.00 56.01 55.49 1s7x n LEU 109 Cb 0.52 -1.41 -0.13 0.00 0.53 0.00 0.00 43.42 42.93 1s7x n LEU 109 CO 0.48 -0.14 -0.78 -0.11 -1.11 0.00 0.00 177.39 175.74 1s7x n LEU 110 N 7.66 2.49 -3.64 -1.96 7.94 0.13 -4.86 117.00 124.77 1s7x n LEU 110 Ca 0.25 0.24 -0.10 0.00 -1.11 0.00 0.00 56.01 55.29 1s7x n LEU 110 Cb 0.32 -1.08 -0.07 0.00 0.53 0.00 0.00 43.42 43.12 1s7x n LEU 110 CO 0.72 0.74 0.45 -0.60 -1.11 0.00 0.00 177.39 177.59 1s7x s ARG 111 N -2.52 0.71 0.08 1.96 3.52 -1.03 -4.99 118.95 116.68 1s7x s ARG 111 Ca -0.24 1.02 -0.03 0.00 -0.13 0.00 0.00 55.73 56.35 1s7x s ARG 111 Cb 0.07 0.26 -0.05 0.00 -1.56 0.00 0.00 34.95 33.67 1s7x s ARG 111 CO 0.73 -0.11 0.27 0.20 -0.81 0.00 0.00 175.30 175.58 1s7x s GLY 112 N 0.94 2.21 -0.04 8.12 0.00 -1.26 -1.01 107.32 116.28 1s7x s GLY 112 Ca -0.04 -0.70 0.02 0.00 0.00 0.00 0.00 44.72 43.99 1s7x s GLY 112 CO -0.09 -0.63 -0.08 -0.19 0.00 0.00 0.00 173.10 172.10 1s7x s TYR 113 N -1.52 0.97 -0.23 1.90 1.51 0.02 -4.84 117.35 115.16 1s7x s TYR 113 Ca 0.36 -0.27 -0.03 0.00 -1.01 0.00 0.00 57.07 56.11 1s7x s TYR 113 Cb -0.13 -0.73 0.12 0.00 -0.11 0.00 0.00 41.96 41.11 1s7x s TYR 113 CO 0.25 -0.15 0.35 -1.17 -1.11 0.00 0.00 175.55 173.71 1s7x s LEU 114 N 0.46 -0.52 0.01 -1.29 0.20 -1.25 -1.88 118.68 114.41 1s7x s LEU 114 Ca -0.07 0.21 -0.00 0.00 0.69 0.00 0.00 54.13 54.95 1s7x s LEU 114 Cb -0.11 0.97 -0.01 0.00 -0.43 0.00 0.00 46.19 46.61 1s7x s LEU 114 CO 0.01 -0.30 -0.02 -1.10 -0.29 0.00 0.00 176.35 174.66 1s7x s GLN 115 N 2.50 0.23 0.04 1.98 -0.21 -0.33 -1.04 119.66 122.83 1s7x s GLN 115 Ca 0.10 -0.43 0.05 0.00 0.02 0.00 0.00 55.36 55.10 1s7x s GLN 115 Cb -0.15 0.08 -0.02 0.00 1.00 0.00 0.00 33.01 33.92 1s7x s GLN 115 CO -0.15 -0.04 -0.13 -0.06 -2.12 0.00 0.00 175.29 172.80 1s7x s PHE 116 N -1.03 1.15 0.01 0.91 0.40 -0.29 -1.03 117.98 118.10 1s7x s PHE 116 Ca -0.11 -0.35 0.02 0.00 -0.60 0.00 0.00 56.93 55.88 1s7x s PHE 116 Cb -0.07 -0.69 -0.01 0.00 0.51 0.00 0.00 43.02 42.76 1s7x s PHE 116 CO -0.01 0.02 -0.07 0.00 0.70 0.00 0.00 175.22 175.87 1s7x s ALA 117 N -0.86 0.57 -0.05 5.36 0.00 -0.49 -1.13 121.76 125.17 1s7x s ALA 117 Ca 0.01 -0.41 0.06 0.00 0.00 0.00 0.00 51.96 51.62 1s7x s ALA 117 Cb -0.08 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 22.93 1s7x s ALA 117 CO 0.01 0.10 -0.24 -0.47 0.00 0.00 0.00 175.76 175.16 1s7x s TYR 118 N -0.46 2.32 -1.27 0.00 5.04 0.25 -0.96 117.35 122.27 1s7x s TYR 118 Ca -0.00 -0.66 -0.11 0.00 -2.44 0.00 0.00 57.07 53.86 1s7x s TYR 118 Cb -0.04 -1.52 0.09 0.00 0.35 0.00 0.00 41.96 40.84 1s7x s TYR 118 CO 0.00 -0.19 0.48 0.39 -1.34 0.00 0.00 175.55 174.89 1s7x n GLU 119 N 2.91 -3.04 -0.94 4.97 -0.58 -0.54 -1.80 120.64 121.62 1s7x n GLU 119 Ca -0.17 0.39 0.00 0.00 -0.42 0.00 0.00 57.16 56.95 1s7x n GLU 119 Cb 0.52 -5.06 0.00 0.00 -0.57 0.00 0.00 31.44 26.33 1s7x n GLU 119 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1s7x n GLY 120 N -1.12 0.46 3.04 0.62 0.00 -1.26 -5.02 105.19 101.91 1s7x n GLY 120 Ca 0.01 -0.64 -0.19 0.00 0.00 0.00 0.00 46.02 45.19 1s7x n GLY 120 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s7x s ARG 121 N -1.19 0.82 0.08 1.61 0.52 -0.75 -5.08 118.95 114.96 1s7x s ARG 121 Ca 0.00 -0.36 -0.35 0.00 -0.52 0.00 0.00 55.73 54.50 1s7x s ARG 121 Cb 0.00 -0.79 -0.14 0.00 0.52 0.00 0.00 34.95 34.54 1s7x s ARG 121 CO 0.00 0.21 1.56 -0.25 0.02 0.00 0.00 175.30 176.84 1s7x n ASP 122 N 2.85 2.69 -0.03 0.23 8.00 -1.26 -0.58 116.55 128.44 1s7x n ASP 122 Ca -0.14 1.08 -0.06 0.00 0.71 0.00 0.00 54.79 56.38 1s7x n ASP 122 Cb 0.56 -1.33 -0.02 0.00 -0.02 0.00 0.00 41.12 40.31 1s7x n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1s7x n TYR 123 N 3.73 0.00 -3.68 1.24 9.36 -0.28 -4.78 117.16 122.75 1s7x n TYR 123 Ca 0.19 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.26 1s7x n TYR 123 Cb 0.25 -0.30 -0.08 0.00 -0.63 0.00 0.00 39.34 38.58 1s7x n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1s7x s ILE 124 N -2.45 0.01 -0.07 2.97 2.07 -1.19 -4.16 121.20 118.38 1s7x s ILE 124 Ca -0.16 -0.12 -0.07 0.00 -1.41 0.00 0.00 60.65 58.90 1s7x s ILE 124 Cb 0.03 -0.74 0.02 0.00 0.13 0.00 0.00 42.46 41.90 1s7x s ILE 124 CO 0.23 -0.06 0.20 0.00 -1.91 0.00 0.00 174.94 173.39 1s7x s ALA 125 N -0.41 -0.48 0.00 1.50 0.00 -0.33 -1.14 121.76 120.91 1s7x s ALA 125 Ca -0.05 0.57 -0.30 0.00 0.00 0.00 0.00 51.96 52.17 1s7x s ALA 125 Cb -0.03 -0.34 -0.05 0.00 0.00 0.00 0.00 23.12 22.70 1s7x s ALA 125 CO 0.03 -0.10 1.29 -1.17 0.00 0.00 0.00 175.76 175.82 1s7x s LEU 126 N 0.18 4.32 1.01 0.00 2.96 -0.20 -1.02 118.68 125.93 1s7x s LEU 126 Ca -0.01 2.01 -0.12 0.00 -0.22 0.00 0.00 54.13 55.79 1s7x s LEU 126 Cb -0.02 -3.57 0.20 0.00 0.50 0.00 0.00 46.19 43.30 1s7x s LEU 126 CO -0.00 -0.62 1.08 0.20 -1.32 0.00 0.00 176.35 175.69 1s7x s ASN 127 N 1.53 2.43 0.48 3.68 0.01 0.59 -4.58 114.94 119.07 1s7x s ASN 127 Ca 0.60 1.33 0.20 0.00 -0.71 0.00 0.00 52.86 54.28 1s7x s ASN 127 Cb -0.29 -2.01 1.19 0.00 0.41 0.00 0.00 41.25 40.55 1s7x s ASN 127 CO 0.26 -3.27 2.03 -0.08 -1.51 0.00 0.00 177.10 174.52 1s7x h GLU 128 N -1.99 0.00 0.00 -0.60 4.81 -1.88 -0.35 114.58 114.58 1s7x h GLU 128 Ca -0.55 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 1s7x h GLU 128 Cb 1.32 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.70 1s7x h GLU 128 CO 0.55 0.16 0.00 -0.40 -0.73 0.00 0.00 179.01 178.59 1s7x n ASP 129 N -4.05 0.00 -2.71 1.04 5.68 -1.26 -4.77 116.55 110.48 1s7x n ASP 129 Ca -0.02 0.46 -0.18 0.00 -0.50 0.00 0.00 54.79 54.55 1s7x n ASP 129 Cb 0.24 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 39.75 1s7x n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1s7x n LEU 130 N -1.47 -1.66 0.00 -2.12 4.77 -0.14 -4.80 117.00 111.58 1s7x n LEU 130 Ca 0.01 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1s7x n LEU 130 Cb 0.05 -2.45 0.00 0.00 -2.33 0.00 0.00 43.42 38.69 1s7x n LEU 130 CO 0.04 -0.03 -0.23 0.29 -1.33 0.00 0.00 177.39 176.13 1s7x n LYS 131 N -3.24 0.63 -4.50 3.23 5.02 -1.26 -4.64 118.16 113.39 1s7x n LYS 131 Ca -0.14 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 55.91 1s7x n LYS 131 Cb 0.61 -0.73 -0.10 0.00 -0.02 0.00 0.00 35.03 34.79 1s7x n LYS 131 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1s7x s THR 132 N -1.47 1.92 -0.04 -0.18 -4.23 -1.26 -4.86 115.64 105.52 1s7x s THR 132 Ca 0.00 -2.14 0.06 0.00 -1.18 0.00 0.00 61.69 58.43 1s7x s THR 132 Cb 0.00 -2.62 -0.02 0.00 1.34 0.00 0.00 72.50 71.21 1s7x s THR 132 CO 0.00 -0.21 -0.24 0.26 -0.54 0.00 0.00 174.62 173.90 1s7x s TRP 133 N -2.82 2.44 -0.19 3.99 0.52 -1.26 -0.30 118.94 121.32 1s7x s TRP 133 Ca 0.32 -0.54 -0.10 0.00 0.02 0.00 0.00 56.10 55.80 1s7x s TRP 133 Cb 0.04 -1.57 -0.05 0.00 -1.15 0.00 0.00 33.47 30.74 1s7x s TRP 133 CO 0.15 -0.10 0.14 0.99 0.02 0.00 0.00 176.95 178.15 1s7x s THR 134 N -0.39 5.41 -0.27 2.01 2.01 -0.19 -4.92 115.64 119.29 1s7x s THR 134 Ca 0.03 0.22 -0.03 0.00 0.31 0.00 0.00 61.69 62.22 1s7x s THR 134 Cb -0.12 -3.48 0.15 0.00 0.01 0.00 0.00 72.50 69.07 1s7x s THR 134 CO 0.01 0.45 0.51 0.00 -0.69 0.00 0.00 174.62 174.90 1s7x s ALA 135 N 0.29 -1.72 -0.06 7.40 0.00 -1.26 -1.18 121.76 125.23 1s7x s ALA 135 Ca 0.09 1.53 -0.22 0.00 0.00 0.00 0.00 51.96 53.35 1s7x s ALA 135 Cb -0.11 -1.88 -0.31 0.00 0.00 0.00 0.00 23.12 20.83 1s7x s ALA 135 CO -0.01 -1.21 0.86 0.00 0.00 0.00 0.00 175.76 175.39 1s7x h ALA 136 N 8.08 -0.06 -2.62 0.00 0.00 -1.89 -3.45 119.26 119.33 1s7x h ALA 136 Ca -0.21 -0.71 -0.51 0.00 0.00 0.00 0.00 54.91 53.48 1s7x h ALA 136 Cb 1.15 0.12 0.09 0.00 0.00 0.00 0.00 17.79 19.15 1s7x h ALA 136 CO 0.24 0.38 0.42 -0.51 0.00 0.00 0.00 179.25 179.78 1s7x s ASP 137 N -6.92 5.39 0.26 0.00 1.11 -1.26 -4.93 116.67 110.32 1s7x s ASP 137 Ca -0.15 2.19 -0.02 0.00 0.18 0.00 0.00 52.55 54.75 1s7x s ASP 137 Cb 0.01 -2.58 0.34 0.00 1.07 0.00 0.00 42.92 41.76 1s7x s ASP 137 CO 0.81 -1.45 1.77 0.24 1.18 0.00 0.00 175.17 177.73 1s7x h MET 138 N 0.78 0.82 0.00 8.23 2.86 -2.00 -2.46 114.93 123.16 1s7x h MET 138 Ca -0.49 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 56.93 1s7x h MET 138 Cb 1.27 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 32.82 1s7x h MET 138 CO 0.55 0.80 -0.04 0.00 1.06 0.00 0.00 176.91 179.29 1s7x h ALA 139 N 1.27 1.03 0.00 6.32 0.00 -1.91 -2.93 119.26 123.03 1s7x h ALA 139 Ca 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1s7x h ALA 139 Cb 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1s7x h ALA 139 CO 0.01 0.05 -0.42 0.00 0.00 0.00 0.00 179.25 178.89 1s7x n ALA 140 N -2.12 2.89 0.24 0.00 0.00 -0.94 -3.84 120.51 116.74 1s7x n ALA 140 Ca -0.00 -0.22 0.07 0.00 0.00 0.00 0.00 53.44 53.29 1s7x n ALA 140 Cb 0.28 -1.24 0.58 0.00 0.00 0.00 0.00 19.45 19.07 1s7x n ALA 140 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1s7x h GLN 141 N 0.00 0.00 0.13 0.00 1.08 -1.44 -2.32 115.11 112.56 1s7x h GLN 141 Ca 0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1s7x h GLN 141 Cb 0.66 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.09 1s7x h GLN 141 CO 0.00 0.08 -0.06 0.82 -0.95 0.00 0.00 178.83 178.72 1s7x h ILE 142 N 0.00 0.94 -0.66 2.54 2.04 -1.78 -1.84 117.51 118.75 1s7x h ILE 142 Ca -0.00 -0.30 0.04 0.00 1.00 0.00 0.00 64.86 65.60 1s7x h ILE 142 Cb 0.15 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.31 1s7x h ILE 142 CO 0.01 0.07 0.40 0.74 0.00 0.00 0.00 178.15 179.37 1s7x h THR 143 N -0.32 1.04 -0.07 -0.27 2.02 -1.71 -1.75 112.91 111.84 1s7x h THR 143 Ca -0.02 -0.26 0.02 0.00 0.77 0.00 0.00 66.41 66.92 1s7x h THR 143 Cb 0.25 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 66.86 1s7x h THR 143 CO 0.03 0.14 -0.07 -0.09 0.37 0.00 0.00 175.52 175.90 1s7x h ARG 144 N 0.76 -0.08 0.27 6.66 2.43 -1.16 -0.14 114.38 123.11 1s7x h ARG 144 Ca 0.28 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.46 1s7x h ARG 144 Cb 0.09 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1s7x h ARG 144 CO -0.14 -0.06 -0.28 0.00 -1.51 0.00 0.00 179.97 177.99 1s7x h ARG 145 N -0.09 -0.56 -0.74 0.20 3.08 -1.22 0.41 114.38 115.46 1s7x h ARG 145 Ca 0.05 0.04 0.14 0.00 0.07 0.00 0.00 59.98 60.28 1s7x h ARG 145 Cb 0.16 0.13 -0.10 0.00 0.08 0.00 0.00 29.97 30.24 1s7x h ARG 145 CO -0.12 -0.37 0.28 0.87 -1.07 0.00 0.00 179.97 179.55 1s7x h LYS 146 N -0.58 0.40 -0.04 0.04 1.57 -1.16 -0.15 116.57 116.65 1s7x h LYS 146 Ca -0.01 -0.02 -0.18 0.00 -1.87 0.00 0.00 60.65 58.57 1s7x h LYS 146 Cb 0.54 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1s7x h LYS 146 CO -0.07 0.27 -0.76 -1.49 -0.57 0.00 0.00 179.45 176.83 1s7x h TRP 147 N 0.41 0.38 -0.51 -1.35 4.06 -0.73 -2.09 115.95 116.13 1s7x h TRP 147 Ca 0.41 -0.18 -0.11 0.00 2.06 0.00 0.00 58.89 61.07 1s7x h TRP 147 Cb 0.62 -0.05 -0.02 0.00 -1.00 0.00 0.00 29.16 28.71 1s7x h TRP 147 CO -0.18 0.93 -0.11 0.93 -3.56 0.00 0.00 178.44 176.45 1s7x h GLU 148 N 0.17 0.95 0.00 0.49 5.08 -0.39 -1.65 114.58 119.24 1s7x h GLU 148 Ca -0.03 -0.34 -0.05 0.00 -1.00 0.00 0.00 59.36 57.94 1s7x h GLU 148 Cb 1.34 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 1s7x h GLU 148 CO 0.12 1.01 -0.22 1.96 -1.00 0.00 0.00 179.01 180.88 1s7x h GLN 149 N 0.85 0.00 -0.24 2.33 4.20 -0.89 -3.16 115.11 118.19 1s7x h GLN 149 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 1s7x h GLN 149 Cb 0.66 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.44 1s7x h GLN 149 CO 0.05 0.22 0.00 -1.13 -0.67 0.00 0.00 178.83 177.30 1s7x n SER 150 N -3.27 3.24 -2.78 1.46 3.41 -0.80 -4.96 113.62 109.92 1s7x n SER 150 Ca 0.01 -1.98 -0.22 0.00 -0.26 0.00 0.00 58.87 56.43 1s7x n SER 150 Cb 0.49 -0.15 0.02 0.00 -0.26 0.00 0.00 64.21 64.31 1s7x n SER 150 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1s7x n GLY 151 N 1.40 -0.51 0.17 5.00 0.00 -1.16 -4.93 105.19 105.16 1s7x n GLY 151 Ca 0.17 0.08 -0.04 0.00 0.00 0.00 0.00 46.02 46.22 1s7x n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s7x h ALA 152 N 1.00 0.30 -0.87 4.61 0.00 -1.59 -2.61 119.26 120.10 1s7x h ALA 152 Ca -0.51 0.16 0.18 0.00 0.00 0.00 0.00 54.91 54.74 1s7x h ALA 152 Cb 1.36 0.31 -0.11 0.00 0.00 0.00 0.00 17.79 19.35 1s7x h ALA 152 CO 0.57 -0.44 0.42 0.00 0.00 0.00 0.00 179.25 179.80 1s7x h ALA 153 N 1.42 1.36 -0.41 0.00 0.00 -1.89 -1.02 119.26 118.71 1s7x h ALA 153 Ca 0.20 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 1s7x h ALA 153 Cb 0.31 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1s7x h ALA 153 CO -0.42 -0.20 0.23 0.93 0.00 0.00 0.00 179.25 179.78 1s7x h GLU 154 N 0.53 0.58 0.21 0.00 3.07 -1.73 0.16 114.58 117.39 1s7x h GLU 154 Ca 0.51 -0.07 0.01 0.00 -0.50 0.00 0.00 59.36 59.31 1s7x h GLU 154 Cb 0.84 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.62 1s7x h GLU 154 CO -0.44 0.46 -0.25 1.25 -1.40 0.00 0.00 179.01 178.64 1s7x h HIS 155 N 0.54 -0.65 -0.58 4.33 -0.00 -1.15 -2.02 115.15 115.61 1s7x h HIS 155 Ca 0.15 0.01 -0.03 0.00 -0.00 0.00 0.00 60.37 60.49 1s7x h HIS 155 Cb 0.06 0.26 -0.03 0.00 -0.00 0.00 0.00 27.41 27.70 1s7x h HIS 155 CO -0.02 -0.36 0.22 1.88 -0.00 0.00 0.00 177.93 179.65 1s7x h TYR 156 N -0.50 0.84 -0.81 5.26 0.05 -1.16 -2.36 116.97 118.29 1s7x h TYR 156 Ca 0.01 -0.05 0.02 0.00 0.05 0.00 0.00 58.73 58.76 1s7x h TYR 156 Cb 0.48 -0.26 -0.05 0.00 1.01 0.00 0.00 36.73 37.92 1s7x h TYR 156 CO -0.18 0.66 0.53 -0.22 -1.05 0.00 0.00 178.16 177.89 1s7x h LYS 157 N 0.83 1.01 -0.72 4.88 3.64 -0.54 -0.19 116.57 125.48 1s7x h LYS 157 Ca 0.20 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.45 1s7x h LYS 157 Cb 0.17 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1s7x h LYS 157 CO -0.02 0.67 0.19 0.00 -2.27 0.00 0.00 179.45 178.03 1s7x h ALA 158 N 1.32 0.95 0.19 5.00 0.00 -0.86 -1.37 119.26 124.50 1s7x h ALA 158 Ca 0.32 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1s7x h ALA 158 Cb -0.04 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.48 1s7x h ALA 158 CO -0.10 0.66 -0.09 -0.92 0.00 0.00 0.00 179.25 178.81 1s7x h TYR 159 N 1.09 -0.24 -0.26 0.00 3.20 -1.19 -2.27 116.97 117.30 1s7x h TYR 159 Ca 0.23 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.03 1s7x h TYR 159 Cb 0.35 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 1s7x h TYR 159 CO 0.03 -0.05 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.32 1s7x h LEU 160 N -0.37 0.40 0.00 2.82 3.38 -0.81 -1.13 115.31 119.60 1s7x h LEU 160 Ca -0.03 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1s7x h LEU 160 Cb 0.29 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1s7x h LEU 160 CO 0.04 0.55 -1.03 -0.62 0.09 0.00 0.00 178.44 177.47 1s7x n GLU 161 N -4.24 0.41 0.00 1.13 1.02 -0.54 -4.11 120.64 114.31 1s7x n GLU 161 Ca 0.00 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1s7x n GLU 161 Cb 0.29 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.05 1s7x n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s7x n GLY 162 N 1.30 0.52 0.41 0.62 0.00 -0.86 -4.66 105.19 102.53 1s7x n GLY 162 Ca 0.01 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.95 1s7x n GLY 162 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1s7x h GLU 163 N 0.00 -0.05 -0.88 1.61 5.08 -1.62 0.33 114.58 119.06 1s7x h GLU 163 Ca 0.00 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.47 1s7x h GLU 163 Cb 0.00 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.18 1s7x h GLU 163 CO 0.00 -0.03 0.51 0.00 -1.00 0.00 0.00 179.01 178.49 1s7x h VAL 165 N 0.84 1.38 -0.91 0.00 2.07 -1.37 -2.30 116.25 115.97 1s7x h VAL 165 Ca 0.43 -1.32 0.03 0.00 0.82 0.00 0.00 66.70 66.66 1s7x h VAL 165 Cb 0.41 2.08 -0.05 0.00 -1.52 0.00 0.00 31.29 32.21 1s7x h VAL 165 CO -0.26 0.37 0.59 -0.33 0.02 0.00 0.00 177.57 177.96 1s7x h GLU 166 N -0.23 1.12 0.14 1.57 5.08 0.42 -1.43 114.58 121.25 1s7x h GLU 166 Ca 0.01 -0.07 -0.29 0.00 -1.00 0.00 0.00 59.36 58.01 1s7x h GLU 166 Cb 0.65 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1s7x h GLU 166 CO 0.03 0.74 -1.35 -1.49 -1.00 0.00 0.00 179.01 175.94 1s7x h TRP 167 N 1.16 0.53 -0.41 4.33 4.06 -0.96 -2.82 115.95 121.85 1s7x h TRP 167 Ca 0.36 -0.39 0.03 0.00 2.06 0.00 0.00 58.89 60.95 1s7x h TRP 167 Cb -0.01 -0.02 -0.03 0.00 -1.00 0.00 0.00 29.16 28.09 1s7x h TRP 167 CO -0.01 1.34 0.20 1.25 -3.56 0.00 0.00 178.44 177.66 1s7x h LEU 168 N 0.08 0.30 -0.39 -4.49 5.85 -1.13 0.72 115.31 116.24 1s7x h LEU 168 Ca -0.18 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.65 1s7x h LEU 168 Cb 2.01 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 42.92 1s7x h LEU 168 CO 0.20 0.21 -0.19 0.45 -0.34 0.00 0.00 178.44 178.78 1s7x h HIS 169 N 0.41 -0.46 -0.50 1.25 3.86 -1.28 -0.68 115.15 117.75 1s7x h HIS 169 Ca 0.17 0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.42 1s7x h HIS 169 Cb 0.08 0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.79 1s7x h HIS 169 CO -0.10 -0.27 0.30 -0.09 0.86 0.00 0.00 177.93 178.63 1s7x h ARG 170 N -0.11 0.68 -0.41 2.45 2.43 -1.18 -2.45 114.38 115.78 1s7x h ARG 170 Ca 0.19 -0.06 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1s7x h ARG 170 Cb 0.41 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 1s7x h ARG 170 CO -0.47 0.50 0.04 1.88 -1.51 0.00 0.00 179.97 180.41 1s7x h TYR 171 N 0.67 0.66 -0.06 2.20 0.05 -0.47 -0.70 116.97 119.33 1s7x h TYR 171 Ca 0.18 -0.07 -0.08 0.00 0.05 0.00 0.00 58.73 58.81 1s7x h TYR 171 Cb -0.01 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.53 1s7x h TYR 171 CO -0.03 0.61 -0.32 -0.07 -1.05 0.00 0.00 178.16 177.30 1s7x h LEU 172 N 0.61 0.12 0.00 3.88 3.38 -0.69 -2.80 115.31 119.82 1s7x h LEU 172 Ca 0.13 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1s7x h LEU 172 Cb 0.33 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1s7x h LEU 172 CO 0.01 0.44 -0.00 0.11 0.09 0.00 0.00 178.44 179.09 1s7x h LYS 173 N 0.10 -0.00 -0.92 1.13 1.57 -1.18 -3.02 116.57 114.24 1s7x h LYS 173 Ca 0.01 0.00 0.27 0.00 -1.87 0.00 0.00 60.65 59.06 1s7x h LYS 173 Cb 0.63 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.90 1s7x h LYS 173 CO 0.05 0.94 0.88 -0.91 -0.57 0.00 0.00 179.45 179.84 1s7x h ASN 174 N -0.96 0.00 -1.25 0.86 4.21 -1.08 -2.94 115.58 114.42 1s7x h ASN 174 Ca -0.00 0.00 -0.42 0.00 1.21 0.00 0.00 56.30 57.09 1s7x h ASN 174 Cb 0.95 0.00 -0.30 0.00 -1.12 0.00 0.00 38.32 37.85 1s7x h ASN 174 CO 0.00 0.00 -0.89 0.61 -1.29 0.00 0.00 177.43 175.86 1s7x n GLY 175 N -1.66 2.01 0.23 2.83 0.00 -1.06 -4.95 105.19 102.58 1s7x n GLY 175 Ca 0.20 -0.96 0.12 0.00 0.00 0.00 0.00 46.02 45.38 1s7x n GLY 175 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1s7x h ASN 176 N 3.68 0.00 0.16 1.61 -0.73 -1.38 -3.28 115.58 115.65 1s7x h ASN 176 Ca -0.00 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.16 1s7x h ASN 176 Cb 0.96 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.55 1s7x h ASN 176 CO 0.40 0.08 -0.08 0.00 -0.37 0.00 0.00 177.43 177.46 1s7x h ALA 177 N 1.92 -0.22 0.00 1.57 0.00 -1.89 -3.26 119.26 117.38 1s7x h ALA 177 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1s7x h ALA 177 Cb 0.87 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1s7x h ALA 177 CO 0.01 -0.21 0.00 2.41 0.00 0.00 0.00 179.25 181.46 1s7x n THR 178 N -4.91 0.00 -1.15 0.00 -1.04 -1.25 -3.59 114.28 102.34 1s7x n THR 178 Ca -0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.97 1s7x n THR 178 Cb 0.13 -0.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.30 1s7x n THR 178 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1s7x n LEU 179 N -0.70 0.00 -0.00 -4.42 7.99 -1.23 -4.79 117.00 113.84 1s7x n LEU 179 Ca 0.07 -0.04 0.09 0.00 -0.01 0.00 0.00 56.01 56.12 1s7x n LEU 179 Cb 0.03 0.00 -0.12 0.00 -0.11 0.00 0.00 43.42 43.22 1s7x n LEU 179 CO 0.05 0.06 -0.21 -0.11 -1.51 0.00 0.00 177.39 175.67 1s7x n LEU 180 N 0.00 0.70 -4.80 2.23 7.94 -1.23 -5.01 117.00 116.84 1s7x n LEU 180 Ca 0.00 -0.38 -0.34 0.00 -1.11 0.00 0.00 56.01 54.18 1s7x n LEU 180 Cb 0.39 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.30 1s7x n LEU 180 CO 0.00 0.17 0.71 0.00 -1.11 0.00 0.00 177.39 177.17 1s7x s ARG 181 N -2.96 3.88 0.11 1.96 3.03 -1.26 -5.03 118.95 118.67 1s7x s ARG 181 Ca 0.04 1.36 0.09 0.00 2.03 0.00 0.00 55.73 59.24 1s7x s ARG 181 Cb 0.14 -2.15 -0.04 0.00 -1.03 0.00 0.00 34.95 31.87 1s7x s ARG 181 CO 0.81 -0.36 -0.21 0.95 -1.13 0.00 0.00 175.30 175.35 1s7x s THR 182 N -1.96 1.78 -0.19 4.99 -4.23 -1.26 -4.85 115.64 109.92 1s7x s THR 182 Ca 0.66 -1.59 -0.06 0.00 -1.18 0.00 0.00 61.69 59.52 1s7x s THR 182 Cb -0.16 -1.62 -0.03 0.00 1.34 0.00 0.00 72.50 72.03 1s7x s THR 182 CO 0.20 -0.06 0.01 -1.81 -0.54 0.00 0.00 174.62 172.42 1s7x s ASP 183 N -1.98 5.04 0.55 3.99 1.01 -0.53 -4.93 116.67 119.82 1s7x s ASP 183 Ca 0.08 -0.12 -0.18 0.00 0.71 0.00 0.00 52.55 53.03 1s7x s ASP 183 Cb -0.10 -1.86 -0.06 0.00 1.01 0.00 0.00 42.92 41.92 1s7x s ASP 183 CO 0.05 0.10 1.07 -0.44 0.21 0.00 0.00 175.17 176.16 1s7x s SER 184 N 0.79 5.90 0.33 0.27 0.01 -1.26 -1.32 113.70 118.42 1s7x s SER 184 Ca 0.01 1.97 -0.27 0.00 1.31 0.00 0.00 55.95 58.97 1s7x s SER 184 Cb -0.14 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.44 1s7x s SER 184 CO 0.02 -1.09 1.07 -2.16 0.41 0.00 0.00 173.24 171.49 1s7x s PRO 185 N -3.57 4.43 -0.24 12.44 0.04 -1.26 -4.25 135.00 142.59 1s7x s PRO 185 Ca 0.68 1.65 -0.07 0.00 0.04 0.00 0.00 61.00 63.29 1s7x s PRO 185 Cb -0.19 -2.89 -0.03 0.00 0.04 0.00 0.00 34.50 31.43 1s7x s PRO 185 CO 0.29 0.07 0.08 0.15 0.04 0.00 0.00 177.00 177.62 1s7x s LYS 186 N -1.92 3.73 0.02 4.56 1.02 -0.42 -4.91 119.74 121.83 1s7x s LYS 186 Ca 0.50 -0.44 0.06 0.00 0.02 0.00 0.00 55.97 56.11 1s7x s LYS 186 Cb -0.27 -3.32 -0.03 0.00 -0.52 0.00 0.00 37.83 33.69 1s7x s LYS 186 CO 0.34 -0.09 -0.16 0.00 -0.92 0.00 0.00 175.35 174.51 1s7x s ALA 187 N 1.37 2.64 0.16 5.17 0.00 -1.26 -1.94 121.76 127.90 1s7x s ALA 187 Ca 0.05 -1.14 -0.18 0.00 0.00 0.00 0.00 51.96 50.70 1s7x s ALA 187 Cb -0.15 -0.81 0.04 0.00 0.00 0.00 0.00 23.12 22.20 1s7x s ALA 187 CO 0.04 0.57 0.47 -3.38 0.00 0.00 0.00 175.76 173.47 1s7x s HIS 188 N -0.90 -0.21 -0.02 0.00 -3.43 -1.13 -4.98 115.29 104.62 1s7x s HIS 188 Ca 0.14 -0.10 0.05 0.00 -0.80 0.00 0.00 55.06 54.35 1s7x s HIS 188 Cb -0.11 0.35 -0.03 0.00 -1.43 0.00 0.00 32.58 31.37 1s7x s HIS 188 CO 0.05 -0.81 -0.16 0.08 -2.00 0.00 0.00 174.74 171.90 1s7x s VAL 189 N -3.83 2.90 0.07 -5.38 1.01 -1.26 -0.87 120.40 113.05 1s7x s VAL 189 Ca 0.05 -0.87 0.09 0.00 0.00 0.00 0.00 61.98 61.25 1s7x s VAL 189 Cb 0.00 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 1s7x s VAL 189 CO -0.08 0.53 -0.24 0.42 0.00 0.00 0.00 175.10 175.72 1s7x s THR 190 N -0.77 1.99 -0.12 3.92 -4.23 -0.91 -4.78 115.64 110.74 1s7x s THR 190 Ca 0.12 -1.45 -0.06 0.00 -1.18 0.00 0.00 61.69 59.12 1s7x s THR 190 Cb -0.11 -1.74 -0.04 0.00 1.34 0.00 0.00 72.50 71.96 1s7x s THR 190 CO 0.02 0.20 0.09 -2.28 -0.54 0.00 0.00 174.62 172.11 1s7x s HIS 191 N -0.91 3.41 -0.34 3.99 2.46 -1.26 -2.13 115.29 120.50 1s7x s HIS 191 Ca 0.10 0.36 0.02 0.00 0.47 0.00 0.00 55.06 56.02 1s7x s HIS 191 Cb -0.10 -1.93 0.15 0.00 -0.13 0.00 0.00 32.58 30.58 1s7x s HIS 191 CO 0.03 0.56 0.37 -1.01 -2.47 0.00 0.00 174.74 172.22 1s7x s HIS 192 N -0.71 -0.46 0.05 3.88 3.76 -0.92 -5.00 115.29 115.88 1s7x s HIS 192 Ca 0.12 -0.50 -0.31 0.00 -0.15 0.00 0.00 55.06 54.23 1s7x s HIS 192 Cb -0.12 -0.37 -0.05 0.00 1.11 0.00 0.00 32.58 33.15 1s7x s HIS 192 CO 0.03 -0.97 1.21 -1.25 -0.85 0.00 0.00 174.74 172.91 1s7x s PRO 193 N 1.80 4.42 0.00 8.40 0.04 -1.26 -1.10 135.00 147.29 1s7x s PRO 193 Ca 0.14 1.77 0.00 0.00 0.04 0.00 0.00 61.00 62.95 1s7x s PRO 193 Cb -0.14 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 31.02 1s7x s PRO 193 CO -0.14 -0.29 0.00 0.54 0.04 0.00 0.00 177.00 177.15 1s7x n ARG 194 N 4.10 0.29 -1.29 4.56 1.74 -0.60 -4.93 116.66 120.52 1s7x n ARG 194 Ca 0.09 0.00 -0.35 0.00 -0.77 0.00 0.00 57.85 56.82 1s7x n ARG 194 Cb 0.46 0.00 0.10 0.00 -1.02 0.00 0.00 32.46 32.00 1s7x n ARG 194 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1s7x n SER 195 N 0.00 0.69 -4.61 0.55 7.64 -1.25 -4.77 113.62 111.87 1s7x n SER 195 Ca 0.00 0.65 -0.62 0.00 1.01 0.00 0.00 58.87 59.91 1s7x n SER 195 Cb 0.00 -1.44 -0.08 0.00 -1.01 0.00 0.00 64.21 61.67 1s7x n SER 195 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1s7x n LYS 196 N -2.27 0.17 -3.02 1.43 5.02 -1.26 -1.90 118.16 116.32 1s7x n LYS 196 Ca 0.13 0.06 -0.16 0.00 -2.02 0.00 0.00 58.31 56.32 1s7x n LYS 196 Cb 0.50 -1.58 0.04 0.00 -0.02 0.00 0.00 35.03 33.96 1s7x n LYS 196 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s7x n GLY 197 N 2.65 -0.13 3.56 0.72 0.00 -1.26 -5.00 105.19 105.72 1s7x n GLY 197 Ca 0.24 -0.08 -0.01 0.00 0.00 0.00 0.00 46.02 46.17 1s7x n GLY 197 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s7x s GLU 198 N -5.63 0.46 0.25 1.61 2.02 -0.80 -3.88 118.70 112.74 1s7x s GLU 198 Ca 0.31 1.03 0.06 0.00 0.02 0.00 0.00 54.97 56.39 1s7x s GLU 198 Cb -0.14 0.47 -0.05 0.00 0.10 0.00 0.00 34.13 34.51 1s7x s GLU 198 CO 0.38 -0.14 -0.07 0.14 0.02 0.00 0.00 175.26 175.60 1s7x s VAL 199 N 2.27 1.55 -0.12 2.63 -7.23 -0.84 -1.55 120.40 117.11 1s7x s VAL 199 Ca -0.06 -2.13 -0.04 0.00 -1.81 0.00 0.00 61.98 57.94 1s7x s VAL 199 Cb -0.07 -2.33 -0.03 0.00 0.56 0.00 0.00 36.38 34.50 1s7x s VAL 199 CO -0.18 -0.38 0.02 -0.89 -0.31 0.00 0.00 175.10 173.36 1s7x s THR 200 N -3.08 4.46 -0.23 5.32 2.01 -0.26 -2.51 115.64 121.36 1s7x s THR 200 Ca 0.27 -0.17 -0.05 0.00 0.31 0.00 0.00 61.69 62.05 1s7x s THR 200 Cb 0.03 -2.93 -0.02 0.00 0.01 0.00 0.00 72.50 69.59 1s7x s THR 200 CO 0.10 0.56 0.01 -0.76 -0.69 0.00 0.00 174.62 173.83 1s7x s LEU 201 N -0.41 3.13 -0.36 4.42 1.43 -1.04 -2.16 118.68 123.69 1s7x s LEU 201 Ca 0.08 -0.31 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 1s7x s LEU 201 Cb -0.12 -1.82 0.09 0.00 0.03 0.00 0.00 46.19 44.37 1s7x s LEU 201 CO 0.02 -0.03 0.10 -0.60 0.23 0.00 0.00 176.35 176.08 1s7x s ARG 202 N 1.54 1.90 -0.24 1.70 6.06 -0.91 -1.95 118.95 127.05 1s7x s ARG 202 Ca 0.06 -1.73 -0.26 0.00 -2.50 0.00 0.00 55.73 51.30 1s7x s ARG 202 Cb -0.15 -3.35 -0.00 0.00 0.06 0.00 0.00 34.95 31.51 1s7x s ARG 202 CO -0.00 -0.93 0.88 0.00 -2.50 0.00 0.00 175.30 172.74 1s7x s TRP 204 N 2.89 3.31 -0.08 0.00 0.52 -0.05 -1.55 118.94 123.98 1s7x s TRP 204 Ca 0.37 0.13 0.01 0.00 0.02 0.00 0.00 56.10 56.63 1s7x s TRP 204 Cb -0.15 -1.66 0.02 0.00 -1.15 0.00 0.00 33.47 30.53 1s7x s TRP 204 CO 0.07 0.54 -0.08 0.00 0.02 0.00 0.00 176.95 177.51 1s7x s ALA 205 N -1.46 1.08 0.05 0.98 0.00 0.92 -2.83 121.76 120.50 1s7x s ALA 205 Ca 0.31 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.96 1s7x s ALA 205 Cb -0.12 -0.66 -0.03 0.00 0.00 0.00 0.00 23.12 22.31 1s7x s ALA 205 CO 0.24 -0.14 -0.09 -0.51 0.00 0.00 0.00 175.76 175.26 1s7x s LEU 206 N 1.19 2.26 -1.09 0.00 1.43 -0.82 -1.47 118.68 120.19 1s7x s LEU 206 Ca -0.06 -0.57 0.00 0.00 -1.03 0.00 0.00 54.13 52.48 1s7x s LEU 206 Cb -0.14 -0.23 0.00 0.00 0.03 0.00 0.00 46.19 45.85 1s7x s LEU 206 CO -0.02 -0.18 0.00 0.61 0.23 0.00 0.00 176.35 176.99 1s7x n GLY 207 N 1.42 0.59 3.91 -3.19 0.00 -1.07 -1.30 105.19 105.54 1s7x n GLY 207 Ca -0.22 -0.46 -0.31 0.00 0.00 0.00 0.00 46.02 45.03 1s7x n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1s7x s PHE 208 N -2.49 3.48 -0.15 1.61 -0.12 -1.20 -4.51 117.98 114.60 1s7x s PHE 208 Ca 0.00 0.23 -0.11 0.00 -0.05 0.00 0.00 56.93 56.99 1s7x s PHE 208 Cb 0.00 -1.74 0.05 0.00 -0.63 0.00 0.00 43.02 40.69 1s7x s PHE 208 CO 0.00 0.58 0.39 -0.47 -0.05 0.00 0.00 175.22 175.67 1s7x s TYR 209 N -1.50 -0.48 1.08 3.49 5.04 -0.44 -1.51 117.35 123.03 1s7x s TYR 209 Ca 0.34 1.11 -0.18 0.00 -2.44 0.00 0.00 57.07 55.90 1s7x s TYR 209 Cb -0.13 0.18 0.26 0.00 0.35 0.00 0.00 41.96 42.62 1s7x s TYR 209 CO 0.27 -0.25 1.11 -2.30 -1.34 0.00 0.00 175.55 173.04 1s7x n PRO 210 N 3.45 -2.41 0.25 4.97 -0.02 -1.26 -1.45 135.00 138.53 1s7x n PRO 210 Ca -0.18 -1.75 0.11 0.00 -2.02 0.00 0.00 63.50 59.66 1s7x n PRO 210 Cb 0.56 -1.46 0.66 0.00 -0.02 0.00 0.00 33.50 33.25 1s7x n PRO 210 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1s7x h ALA 211 N -2.39 1.36 -2.55 3.55 0.00 -1.96 -3.44 119.26 113.82 1s7x h ALA 211 Ca -0.39 -0.13 -0.53 0.00 0.00 0.00 0.00 54.91 53.85 1s7x h ALA 211 Cb 1.16 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.95 1s7x h ALA 211 CO 0.26 0.18 0.68 -0.51 0.00 0.00 0.00 179.25 179.87 1s7x s ASP 212 N -6.35 6.88 0.02 0.00 1.11 -1.26 -4.97 116.67 112.10 1s7x s ASP 212 Ca -0.03 2.28 -0.28 0.00 0.18 0.00 0.00 52.55 54.70 1s7x s ASP 212 Cb 0.14 -2.59 0.09 0.00 1.07 0.00 0.00 42.92 41.63 1s7x s ASP 212 CO 0.61 -0.60 0.81 -0.51 1.18 0.00 0.00 175.17 176.66 1s7x s ILE 213 N 0.95 0.00 -0.02 0.77 2.07 -1.26 -4.65 121.20 119.06 1s7x s ILE 213 Ca 0.62 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.87 1s7x s ILE 213 Cb -0.35 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.26 1s7x s ILE 213 CO 0.31 0.00 0.01 -0.89 -1.91 0.00 0.00 174.94 172.46 1s7x s THR 214 N -2.91 0.10 0.01 4.00 2.01 -0.76 -4.98 115.64 113.11 1s7x s THR 214 Ca 0.02 0.10 0.03 0.00 0.31 0.00 0.00 61.69 62.15 1s7x s THR 214 Cb -0.01 -0.19 -0.03 0.00 0.01 0.00 0.00 72.50 72.28 1s7x s THR 214 CO -0.07 0.11 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.14 1s7x s LEU 215 N 0.85 3.17 0.05 4.42 1.02 -1.26 -0.84 118.68 126.09 1s7x s LEU 215 Ca -0.08 -0.15 -0.00 0.00 0.02 0.00 0.00 54.13 53.91 1s7x s LEU 215 Cb -0.11 -1.82 -0.03 0.00 0.02 0.00 0.00 46.19 44.25 1s7x s LEU 215 CO -0.02 0.28 -0.04 0.42 0.02 0.00 0.00 176.35 177.01 1s7x s THR 216 N -1.01 0.26 0.07 5.49 -4.23 -0.43 -4.98 115.64 110.81 1s7x s THR 216 Ca 0.17 -1.49 0.09 0.00 -1.18 0.00 0.00 61.69 59.28 1s7x s THR 216 Cb -0.11 -1.08 -0.03 0.00 1.34 0.00 0.00 72.50 72.61 1s7x s THR 216 CO 0.08 -0.79 -0.23 0.26 -0.54 0.00 0.00 174.62 173.40 1s7x s TRP 217 N -2.94 2.42 -0.01 3.99 0.52 -1.26 -1.43 118.94 120.24 1s7x s TRP 217 Ca -0.01 -0.34 0.02 0.00 0.02 0.00 0.00 56.10 55.79 1s7x s TRP 217 Cb 0.01 -1.38 -0.00 0.00 -1.15 0.00 0.00 33.47 30.95 1s7x s TRP 217 CO -0.06 0.25 -0.05 -0.65 0.02 0.00 0.00 176.95 176.45 1s7x s GLN 218 N -1.60 0.47 -0.23 4.98 -0.21 -0.47 -2.54 119.66 120.06 1s7x s GLN 218 Ca 0.14 -0.19 -0.02 0.00 0.02 0.00 0.00 55.36 55.31 1s7x s GLN 218 Cb -0.10 -0.46 0.01 0.00 1.00 0.00 0.00 33.01 33.46 1s7x s GLN 218 CO 0.05 0.11 -0.07 -1.17 -2.12 0.00 0.00 175.29 172.09 1s7x s LEU 219 N -0.06 3.00 0.00 2.90 2.96 -1.22 -1.96 118.68 124.29 1s7x s LEU 219 Ca 0.01 -0.69 0.00 0.00 -0.22 0.00 0.00 54.13 53.23 1s7x s LEU 219 Cb -0.03 -1.67 0.00 0.00 0.50 0.00 0.00 46.19 44.99 1s7x s LEU 219 CO -0.00 -0.08 0.00 0.59 -1.32 0.00 0.00 176.35 175.54 1s7x n ASN 220 N 4.71 0.00 0.00 3.68 3.02 -1.26 -4.35 115.26 121.06 1s7x n ASN 220 Ca -0.17 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.38 1s7x n ASN 220 Cb 0.49 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 1s7x n ASN 220 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1s7x n GLY 221 N 0.00 0.00 0.06 7.41 0.00 -1.26 -4.76 105.19 106.64 1s7x n GLY 221 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1s7x n GLY 221 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1s7x n GLU 222 N 0.00 0.00 -3.87 1.61 4.07 -1.26 -5.06 120.64 116.13 1s7x n GLU 222 Ca 0.00 -0.41 -0.12 0.00 -0.06 0.00 0.00 57.16 56.57 1s7x n GLU 222 Cb 0.00 -0.36 -0.12 0.00 -0.06 0.00 0.00 31.44 30.89 1s7x n GLU 222 CO 0.00 0.00 0.00 -2.00 -0.06 0.00 0.00 177.13 175.07 1s7x s GLU 223 N 0.00 0.20 -0.45 5.31 2.56 -1.26 -5.01 118.70 120.04 1s7x s GLU 223 Ca 0.00 -0.08 0.05 0.00 0.00 0.00 0.00 54.97 54.94 1s7x s GLU 223 Cb 0.00 0.09 0.19 0.00 2.00 0.00 0.00 34.13 36.40 1s7x s GLU 223 CO 0.00 -0.04 0.74 -1.17 -0.56 0.00 0.00 175.26 174.23 1s7x s LEU 224 N -0.43 -1.34 -0.16 2.70 2.96 -1.05 -3.46 118.68 117.90 1s7x s LEU 224 Ca -0.05 -1.17 0.17 0.00 -0.22 0.00 0.00 54.13 52.85 1s7x s LEU 224 Cb -0.03 1.73 0.46 0.00 0.50 0.00 0.00 46.19 48.85 1s7x s LEU 224 CO 0.00 -0.09 1.35 0.35 -1.32 0.00 0.00 176.35 176.64 1s7x n THR 225 N 3.54 2.12 -1.93 3.68 -2.24 -1.26 -4.44 114.28 113.75 1s7x n THR 225 Ca 0.14 -1.90 -0.35 0.00 -2.27 0.00 0.00 64.05 59.67 1s7x n THR 225 Cb 0.57 -0.20 -0.04 0.00 -2.10 0.00 0.00 70.33 68.57 1s7x n THR 225 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1s7x s GLN 226 N -2.71 2.46 -1.65 -0.78 -0.44 -1.26 -3.93 119.66 111.35 1s7x s GLN 226 Ca 0.38 0.61 -0.10 0.00 -2.50 0.00 0.00 55.36 53.75 1s7x s GLN 226 Cb 0.31 -4.55 0.10 0.00 -1.64 0.00 0.00 33.01 27.23 1s7x s GLN 226 CO 0.08 -3.03 0.26 -3.47 0.50 0.00 0.00 175.29 169.63 1s7x n ASP 227 N 13.85 -0.29 -4.69 6.67 -0.08 -1.26 -4.83 116.55 125.91 1s7x n ASP 227 Ca 0.28 -1.22 -0.42 0.00 -1.51 0.00 0.00 54.79 51.91 1s7x n ASP 227 Cb 0.51 -1.54 -0.03 0.00 2.34 0.00 0.00 41.12 42.40 1s7x n ASP 227 CO 0.00 0.00 0.00 -0.32 0.12 0.00 0.00 177.20 177.00 1s7x s MET 228 N -7.15 4.14 -0.13 -0.67 -2.45 -1.25 -4.84 119.30 106.94 1s7x s MET 228 Ca 0.37 2.59 -0.14 0.00 -1.25 0.00 0.00 55.69 57.25 1s7x s MET 228 Cb -0.21 -3.56 -0.05 0.00 1.25 0.00 0.00 34.83 32.26 1s7x s MET 228 CO 0.98 -0.83 0.33 -2.00 1.05 0.00 0.00 175.02 174.55 1s7x s GLU 229 N 2.63 4.20 0.32 4.11 2.12 -0.68 -4.96 118.70 126.43 1s7x s GLU 229 Ca 0.80 0.19 0.05 0.00 0.36 0.00 0.00 54.97 56.37 1s7x s GLU 229 Cb -0.46 -3.39 -0.02 0.00 0.26 0.00 0.00 34.13 30.52 1s7x s GLU 229 CO 0.36 0.30 0.18 1.47 -0.54 0.00 0.00 175.26 177.03 1s7x n LEU 230 N 3.33 0.00 -4.27 2.70 -0.00 -1.26 0.77 117.00 118.27 1s7x n LEU 230 Ca -0.12 -2.68 -0.20 0.00 -0.00 0.00 0.00 56.01 53.02 1s7x n LEU 230 Cb 0.52 1.14 -0.11 0.00 -0.00 0.00 0.00 43.42 44.97 1s7x n LEU 230 CO 0.40 -0.43 -0.47 0.68 -0.00 0.00 0.00 177.39 177.57 1s7x s VAL 231 N -3.00 1.53 0.58 1.47 -7.23 -1.00 -4.99 120.40 107.75 1s7x s VAL 231 Ca 0.25 -1.76 -0.20 0.00 -1.81 0.00 0.00 61.98 58.46 1s7x s VAL 231 Cb 0.01 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.29 1s7x s VAL 231 CO 0.18 -0.34 1.32 -1.61 -0.31 0.00 0.00 175.10 174.34 1s7x s GLU 232 N -2.61 2.96 0.17 4.82 0.41 -1.26 -4.61 118.70 118.57 1s7x s GLU 232 Ca 0.11 2.14 -0.31 0.00 -0.41 0.00 0.00 54.97 56.50 1s7x s GLU 232 Cb -0.06 -2.11 -0.09 0.00 -1.78 0.00 0.00 34.13 30.10 1s7x s GLU 232 CO 0.04 -1.30 1.44 0.99 -0.49 0.00 0.00 175.26 175.94 1s7x s THR 233 N -1.36 2.97 0.02 3.63 2.01 -1.26 -4.85 115.64 116.80 1s7x s THR 233 Ca 0.75 0.73 0.06 0.00 0.31 0.00 0.00 61.69 63.55 1s7x s THR 233 Cb -0.38 -3.47 -0.02 0.00 0.01 0.00 0.00 72.50 68.64 1s7x s THR 233 CO 0.44 0.08 -0.19 0.00 -0.69 0.00 0.00 174.62 174.25 1s7x s ARG 234 N 0.65 1.41 0.13 4.92 1.70 -0.65 -4.94 118.95 122.16 1s7x s ARG 234 Ca 0.64 -0.82 -0.30 0.00 -0.47 0.00 0.00 55.73 54.78 1s7x s ARG 234 Cb -0.40 -1.44 -0.07 0.00 -0.57 0.00 0.00 34.95 32.47 1s7x s ARG 234 CO 0.34 0.38 1.20 -1.25 -1.08 0.00 0.00 175.30 174.89 1s7x s PRO 235 N -0.88 4.46 0.34 3.89 0.04 -1.26 -0.42 135.00 141.17 1s7x s PRO 235 Ca 0.07 1.83 0.07 0.00 0.04 0.00 0.00 61.00 63.01 1s7x s PRO 235 Cb -0.08 -3.29 0.62 0.00 0.04 0.00 0.00 34.50 31.79 1s7x s PRO 235 CO 0.01 -0.17 1.83 0.00 0.04 0.00 0.00 177.00 178.70 1s7x h ALA 236 N 6.01 1.33 0.00 8.56 0.00 -1.49 -3.47 119.26 130.20 1s7x h ALA 236 Ca -0.43 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.20 1s7x h ALA 236 Cb 1.21 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1s7x h ALA 236 CO 0.78 0.46 0.00 0.41 0.00 0.00 0.00 179.25 180.90 1s7x n GLY 237 N -0.62 1.74 1.47 0.00 0.00 -1.26 -4.96 105.19 101.57 1s7x n GLY 237 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1s7x n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1s7x n ASP 238 N 0.00 4.73 0.00 1.61 5.75 -1.26 -4.92 116.55 122.46 1s7x n ASP 238 Ca 0.00 -2.64 0.00 0.00 -0.01 0.00 0.00 54.79 52.14 1s7x n ASP 238 Cb 0.00 -0.57 0.00 0.00 -1.03 0.00 0.00 41.12 39.52 1s7x n ASP 238 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1s7x n GLY 239 N 0.66 3.37 4.01 6.12 0.00 -1.26 -5.07 105.19 113.02 1s7x n GLY 239 Ca 0.24 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.06 1s7x n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s7x s THR 240 N -2.88 2.25 0.30 2.61 -4.23 -1.26 -4.88 115.64 107.54 1s7x s THR 240 Ca 0.00 -1.08 0.04 0.00 -1.18 0.00 0.00 61.69 59.47 1s7x s THR 240 Cb 0.00 -2.32 -0.06 0.00 1.34 0.00 0.00 72.50 71.46 1s7x s THR 240 CO 0.00 0.00 0.05 -0.36 -0.54 0.00 0.00 174.62 173.77 1s7x s PHE 241 N -2.62 1.84 0.07 3.99 0.40 -0.57 -1.27 117.98 119.81 1s7x s PHE 241 Ca 0.57 -0.97 0.01 0.00 -0.60 0.00 0.00 56.93 55.94 1s7x s PHE 241 Cb -0.06 -1.16 -0.04 0.00 0.51 0.00 0.00 43.02 42.28 1s7x s PHE 241 CO 0.35 -0.03 -0.05 -0.65 0.70 0.00 0.00 175.22 175.53 1s7x s GLN 242 N -3.90 0.65 -0.19 0.44 -0.21 0.43 -2.59 119.66 114.30 1s7x s GLN 242 Ca 0.35 -1.10 -0.28 0.00 0.02 0.00 0.00 55.36 54.34 1s7x s GLN 242 Cb 0.08 -0.08 0.11 0.00 1.00 0.00 0.00 33.01 34.12 1s7x s GLN 242 CO 0.14 -0.03 0.95 0.21 -2.12 0.00 0.00 175.29 174.44 1s7x s LYS 243 N -3.12 0.64 0.10 2.91 2.20 -0.54 -1.64 119.74 120.29 1s7x s LYS 243 Ca 0.03 0.34 0.01 0.00 -0.36 0.00 0.00 55.97 56.00 1s7x s LYS 243 Cb 0.01 0.31 -0.04 0.00 -1.51 0.00 0.00 37.83 36.60 1s7x s LYS 243 CO -0.05 -0.16 -0.06 1.67 -0.36 0.00 0.00 175.35 176.39 1s7x s TRP 244 N -0.64 0.87 -0.01 4.03 1.48 -1.26 -0.05 118.94 123.36 1s7x s TRP 244 Ca -0.01 -0.94 0.00 0.00 -1.06 0.00 0.00 56.10 54.09 1s7x s TRP 244 Cb -0.02 -0.51 0.01 0.00 -1.16 0.00 0.00 33.47 31.79 1s7x s TRP 244 CO 0.00 -0.18 0.00 0.00 -4.06 0.00 0.00 176.95 172.72 1s7x s ALA 245 N -3.66 0.10 0.26 2.67 0.00 -0.60 -2.39 121.76 118.14 1s7x s ALA 245 Ca 0.12 0.09 0.07 0.00 0.00 0.00 0.00 51.96 52.24 1s7x s ALA 245 Cb 0.06 -0.12 -0.05 0.00 0.00 0.00 0.00 23.12 23.00 1s7x s ALA 245 CO -0.05 -0.03 -0.08 -1.54 0.00 0.00 0.00 175.76 174.06 1s7x s SER 246 N 0.43 2.75 -0.05 0.00 1.04 0.23 -0.62 113.70 117.49 1s7x s SER 246 Ca -0.04 -1.15 -0.18 0.00 0.48 0.00 0.00 55.95 55.07 1s7x s SER 246 Cb -0.06 -0.16 0.04 0.00 0.10 0.00 0.00 66.02 65.93 1s7x s SER 246 CO -0.01 -0.29 0.40 0.54 0.98 0.00 0.00 173.24 174.86 1s7x s VAL 247 N -2.99 0.04 0.11 5.02 0.11 -0.82 -1.68 120.40 120.18 1s7x s VAL 247 Ca 0.28 -0.30 -0.26 0.00 -2.93 0.00 0.00 61.98 58.78 1s7x s VAL 247 Cb 0.02 -0.69 -0.07 0.00 -1.53 0.00 0.00 36.38 34.12 1s7x s VAL 247 CO 0.11 -0.16 0.79 0.68 -3.33 0.00 0.00 175.10 173.18 1s7x s VAL 248 N -1.02 4.54 -0.12 2.04 -7.23 -1.26 -2.49 120.40 114.86 1s7x s VAL 248 Ca -0.11 1.70 -0.09 0.00 -1.81 0.00 0.00 61.98 61.67 1s7x s VAL 248 Cb -0.04 -4.14 0.04 0.00 0.56 0.00 0.00 36.38 32.80 1s7x s VAL 248 CO 0.05 0.43 0.31 -0.69 -0.31 0.00 0.00 175.10 174.89 1s7x s VAL 249 N -0.55 -0.01 0.44 1.32 1.01 -1.04 -5.02 120.40 116.53 1s7x s VAL 249 Ca 0.38 0.05 -0.26 0.00 0.00 0.00 0.00 61.98 62.15 1s7x s VAL 249 Cb -0.22 -0.45 -0.09 0.00 0.00 0.00 0.00 36.38 35.62 1s7x s VAL 249 CO 0.25 0.02 1.45 -2.65 0.00 0.00 0.00 175.10 174.17 1s7x n PRO 250 N 3.44 2.35 -2.58 2.72 -0.02 -1.26 -1.98 135.00 137.66 1s7x n PRO 250 Ca -0.17 0.83 -0.40 0.00 -2.02 0.00 0.00 63.50 61.74 1s7x n PRO 250 Cb 0.56 -2.64 -0.05 0.00 -0.02 0.00 0.00 33.50 31.35 1s7x n PRO 250 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1s7x s LEU 251 N -2.54 4.55 0.00 2.45 0.20 -1.25 -4.28 118.68 117.82 1s7x s LEU 251 Ca 0.59 2.14 0.00 0.00 0.69 0.00 0.00 54.13 57.55 1s7x s LEU 251 Cb -0.46 -3.67 0.00 0.00 -0.43 0.00 0.00 46.19 41.64 1s7x s LEU 251 CO 0.59 -0.07 0.00 0.61 -0.29 0.00 0.00 176.35 177.19 1s7x n GLY 252 N 1.21 0.92 3.55 7.98 0.00 -1.26 -4.91 105.19 112.68 1s7x n GLY 252 Ca -0.01 -0.76 -0.34 0.00 0.00 0.00 0.00 46.02 44.92 1s7x n GLY 252 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1s7x s LYS 253 N 0.00 2.44 0.00 1.61 -0.14 -1.26 -4.58 119.74 117.80 1s7x s LYS 253 Ca 0.00 0.56 0.00 0.00 -1.36 0.00 0.00 55.97 55.17 1s7x s LYS 253 Cb 0.00 -4.60 0.00 0.00 -1.68 0.00 0.00 37.83 31.55 1s7x s LYS 253 CO 0.00 -3.10 0.79 -0.85 -0.76 0.00 0.00 175.35 171.42 1s7x n GLU 254 N 9.06 0.00 0.00 1.68 0.28 -1.26 -4.56 120.64 125.84 1s7x n GLU 254 Ca 0.30 -0.58 0.11 0.00 -0.16 0.00 0.00 57.16 56.83 1s7x n GLU 254 Cb 0.51 -0.29 0.04 0.00 1.43 0.00 0.00 31.44 33.13 1s7x n GLU 254 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1s7x n GLN 255 N 0.00 0.61 -1.55 3.44 1.13 -1.26 -4.23 117.38 115.52 1s7x n GLN 255 Ca 0.00 -0.47 -0.30 0.00 -1.94 0.00 0.00 57.00 54.29 1s7x n GLN 255 Cb 0.61 -1.49 -0.03 0.00 0.11 0.00 0.00 30.24 29.45 1s7x n GLN 255 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 1s7x n ASN 256 N -0.78 6.75 -3.70 1.08 6.94 -1.26 -4.85 115.26 119.44 1s7x n ASN 256 Ca 0.07 -3.36 -0.14 0.00 -0.02 0.00 0.00 54.58 51.14 1s7x n ASN 256 Cb 0.39 -1.18 -0.14 0.00 -2.36 0.00 0.00 39.78 36.50 1s7x n ASN 256 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1s7x s TYR 257 N -2.33 -0.32 -0.12 -2.53 2.02 -1.26 -4.26 117.35 108.55 1s7x s TYR 257 Ca 0.56 0.79 -0.01 0.00 -0.37 0.00 0.00 57.07 58.03 1s7x s TYR 257 Cb 0.39 -0.04 0.04 0.00 -0.40 0.00 0.00 41.96 41.95 1s7x s TYR 257 CO -0.25 -0.27 -0.01 0.99 -1.57 0.00 0.00 175.55 174.44 1s7x s THR 258 N 1.79 0.64 0.21 -0.71 2.01 -0.83 -4.60 115.64 114.14 1s7x s THR 258 Ca -0.04 -0.20 -0.20 0.00 0.31 0.00 0.00 61.69 61.56 1s7x s THR 258 Cb -0.11 -0.84 -0.08 0.00 0.01 0.00 0.00 72.50 71.48 1s7x s THR 258 CO -0.08 0.17 0.71 0.00 -0.69 0.00 0.00 174.62 174.74 1s7x s ARG 260 N -1.85 1.03 -0.10 0.00 0.52 -0.51 -1.54 118.95 116.50 1s7x s ARG 260 Ca 0.41 -0.29 0.04 0.00 -0.52 0.00 0.00 55.73 55.37 1s7x s ARG 260 Cb -0.17 -0.95 -0.00 0.00 0.52 0.00 0.00 34.95 34.34 1s7x s ARG 260 CO 0.21 0.08 -0.22 0.08 0.02 0.00 0.00 175.30 175.47 1s7x s VAL 261 N 0.35 2.26 -0.14 3.52 1.01 -1.05 -1.32 120.40 125.03 1s7x s VAL 261 Ca -0.06 -0.96 0.02 0.00 0.00 0.00 0.00 61.98 60.98 1s7x s VAL 261 Cb -0.10 -1.87 0.01 0.00 0.00 0.00 0.00 36.38 34.42 1s7x s VAL 261 CO 0.01 0.56 -0.19 -0.31 0.00 0.00 0.00 175.10 175.17 1s7x s TYR 262 N 0.26 2.44 -0.17 5.22 1.51 -0.02 -1.75 117.35 124.84 1s7x s TYR 262 Ca -0.15 -1.27 -0.24 0.00 -1.01 0.00 0.00 57.07 54.40 1s7x s TYR 262 Cb -0.17 -1.70 0.06 0.00 -0.11 0.00 0.00 41.96 40.04 1s7x s TYR 262 CO 0.08 -0.62 0.62 -1.58 -1.11 0.00 0.00 175.55 172.94 1s7x s HIS 263 N 1.03 -0.64 -0.42 2.71 2.46 -1.26 -1.82 115.29 117.33 1s7x s HIS 263 Ca -0.03 1.43 0.23 0.00 0.47 0.00 0.00 55.06 57.15 1s7x s HIS 263 Cb -0.15 0.27 1.01 0.00 -0.13 0.00 0.00 32.58 33.59 1s7x s HIS 263 CO -0.05 -0.41 1.69 -0.85 -2.47 0.00 0.00 174.74 172.65 1s7x n GLU 264 N 2.12 0.18 0.06 2.88 0.28 -1.26 -1.41 120.64 123.49 1s7x n GLU 264 Ca -0.16 0.47 0.12 0.00 -0.16 0.00 0.00 57.16 57.44 1s7x n GLU 264 Cb 0.56 -1.89 0.24 0.00 1.43 0.00 0.00 31.44 31.79 1s7x n GLU 264 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1s7x n GLY 265 N -0.31 -1.47 3.79 -1.84 0.00 -1.26 -4.90 105.19 99.20 1s7x n GLY 265 Ca 0.01 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 1s7x n GLY 265 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1s7x s LEU 266 N -4.15 4.22 0.33 0.99 2.01 -0.50 -4.73 118.68 116.85 1s7x s LEU 266 Ca 0.08 1.89 0.14 0.00 0.01 0.00 0.00 54.13 56.25 1s7x s LEU 266 Cb 0.14 -4.14 0.57 0.00 0.01 0.00 0.00 46.19 42.76 1s7x s LEU 266 CO 0.69 -0.25 1.70 1.55 1.01 0.00 0.00 176.35 181.05 1s7x h PRO 267 N 2.78 0.00 -3.14 1.29 0.13 -1.90 -3.46 132.00 127.69 1s7x h PRO 267 Ca -0.48 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.64 1s7x h PRO 267 Cb 1.20 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.22 1s7x h PRO 267 CO 0.64 0.47 0.12 -1.83 -0.23 0.00 0.00 178.00 177.17 1s7x s GLU 268 N -3.71 1.30 0.45 0.86 -1.05 -1.26 -5.16 118.70 110.13 1s7x s GLU 268 Ca -0.01 -0.64 -0.24 0.00 -0.15 0.00 0.00 54.97 53.93 1s7x s GLU 268 Cb 0.12 0.55 -0.09 0.00 -0.44 0.00 0.00 34.13 34.27 1s7x s GLU 268 CO 0.72 -0.56 1.14 -2.30 0.95 0.00 0.00 175.26 175.22 1s7x n PRO 269 N -0.35 1.58 -2.54 -4.83 -0.02 -1.26 -4.98 135.00 122.60 1s7x n PRO 269 Ca -0.14 0.57 -0.37 0.00 -2.02 0.00 0.00 63.50 61.53 1s7x n PRO 269 Cb 0.64 -2.24 -0.04 0.00 -0.02 0.00 0.00 33.50 31.84 1s7x n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1s7x s LEU 270 N -1.39 4.20 -0.03 2.45 1.43 -0.72 -4.91 118.68 119.72 1s7x s LEU 270 Ca 0.64 2.07 0.06 0.00 -1.03 0.00 0.00 54.13 55.87 1s7x s LEU 270 Cb -0.51 -4.10 -0.01 0.00 0.03 0.00 0.00 46.19 41.59 1s7x s LEU 270 CO 0.56 -0.44 -0.22 -0.89 0.23 0.00 0.00 176.35 175.59 1s7x s THR 271 N -1.58 1.74 -0.05 5.49 2.01 -1.26 -2.52 115.64 119.47 1s7x s THR 271 Ca 0.56 -0.92 -0.23 0.00 0.31 0.00 0.00 61.69 61.40 1s7x s THR 271 Cb -0.23 -1.45 0.05 0.00 0.01 0.00 0.00 72.50 70.87 1s7x s THR 271 CO 0.29 0.49 0.51 -0.22 -0.69 0.00 0.00 174.62 175.00 1s7x s LEU 272 N -0.38 0.05 0.31 4.42 0.20 -0.59 -5.02 118.68 117.68 1s7x s LEU 272 Ca 0.05 0.47 -0.08 0.00 0.69 0.00 0.00 54.13 55.26 1s7x s LEU 272 Cb -0.10 1.92 0.00 0.00 -0.43 0.00 0.00 46.19 47.59 1s7x s LEU 272 CO 0.00 -0.50 0.50 0.00 -0.29 0.00 0.00 176.35 176.06 1s7x s ARG 273 N -1.13 1.79 -0.14 1.98 3.03 -1.26 -0.85 118.95 122.38 1s7x s ARG 273 Ca -0.11 -1.53 -0.29 0.00 2.03 0.00 0.00 55.73 55.83 1s7x s ARG 273 Cb -0.03 0.47 -0.04 0.00 -1.03 0.00 0.00 34.95 34.32 1s7x s ARG 273 CO 0.07 -0.75 1.67 -0.46 -1.13 0.00 0.00 175.30 174.69 1s7x s TRP 274 N -3.36 1.98 -0.39 5.89 -0.00 -1.26 -4.59 118.94 117.22 1s7x s TRP 274 Ca 0.26 0.37 -0.01 0.00 -0.00 0.00 0.00 56.10 56.72 1s7x s TRP 274 Cb -0.01 -3.95 0.11 0.00 -0.00 0.00 0.00 33.47 29.62 1s7x s TRP 274 CO 0.15 -3.46 0.16 -1.83 -0.00 0.00 0.00 176.95 171.97 1s7x s GLU 275 N 4.46 1.89 0.00 5.86 -1.05 -1.26 -4.96 118.70 123.64 1s7x s GLU 275 Ca 0.74 -1.81 0.32 0.00 -0.15 0.00 0.00 54.97 54.07 1s7x s GLU 275 Cb -0.29 -3.47 1.90 0.00 -0.44 0.00 0.00 34.13 31.82 1s7x s GLU 275 CO 0.30 -1.02 2.22 -0.35 0.95 0.00 0.00 175.26 177.36