#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s7u s PRO 2 N 0.00 3.28 0.16 1.61 0.04 -1.26 -3.87 135.00 134.96 1s7u s PRO 2 Ca 0.00 0.21 -0.00 0.00 0.04 0.00 0.00 61.00 61.25 1s7u s PRO 2 Cb 0.00 -2.28 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 1s7u s PRO 2 CO 0.00 -0.49 0.05 -1.01 0.04 0.00 0.00 177.00 175.59 1s7u s HIS 3 N -2.93 1.05 0.01 0.56 3.76 -0.81 -4.97 115.29 111.96 1s7u s HIS 3 Ca 0.51 -1.18 -0.27 0.00 -0.15 0.00 0.00 55.06 53.97 1s7u s HIS 3 Cb -0.11 -0.58 0.06 0.00 1.11 0.00 0.00 32.58 33.06 1s7u s HIS 3 CO 0.47 -0.43 0.62 -1.54 -0.85 0.00 0.00 174.74 173.00 1s7u s SER 4 N -3.12 -0.58 0.01 1.40 1.04 -1.26 0.18 113.70 111.37 1s7u s SER 4 Ca 0.27 0.45 0.02 0.00 0.48 0.00 0.00 55.95 57.16 1s7u s SER 4 Cb 0.07 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.71 1s7u s SER 4 CO 0.04 -0.69 -0.07 -0.32 0.98 0.00 0.00 173.24 173.18 1s7u s MET 5 N -1.93 0.52 0.02 4.02 1.75 -0.37 -0.34 119.30 122.97 1s7u s MET 5 Ca -0.08 -0.34 0.01 0.00 -1.25 0.00 0.00 55.69 54.04 1s7u s MET 5 Cb -0.01 -0.47 -0.02 0.00 2.84 0.00 0.00 34.83 37.18 1s7u s MET 5 CO 0.03 0.12 -0.04 1.03 -0.65 0.00 0.00 175.02 175.51 1s7u s ARG 6 N -0.44 0.32 -0.18 4.11 1.81 -0.40 -1.52 118.95 122.66 1s7u s ARG 6 Ca 0.00 -0.48 0.00 0.00 -1.72 0.00 0.00 55.73 53.54 1s7u s ARG 6 Cb -0.04 -0.08 0.01 0.00 -0.45 0.00 0.00 34.95 34.39 1s7u s ARG 6 CO -0.00 0.01 -0.17 0.71 -0.68 0.00 0.00 175.30 175.17 1s7u s TYR 7 N -0.98 2.80 -0.27 -0.53 1.51 0.21 -0.11 117.35 119.97 1s7u s TYR 7 Ca -0.09 -1.41 -0.08 0.00 -1.01 0.00 0.00 57.07 54.48 1s7u s TYR 7 Cb -0.07 -1.93 -0.02 0.00 -0.11 0.00 0.00 41.96 39.82 1s7u s TYR 7 CO -0.00 -0.69 0.11 -0.06 -1.11 0.00 0.00 175.55 173.79 1s7u s PHE 8 N 1.20 3.13 0.03 2.71 0.40 0.55 -2.00 117.98 124.00 1s7u s PHE 8 Ca 0.02 -0.42 0.08 0.00 -0.60 0.00 0.00 56.93 56.01 1s7u s PHE 8 Cb -0.14 -2.29 -0.03 0.00 0.51 0.00 0.00 43.02 41.08 1s7u s PHE 8 CO -0.08 -0.37 -0.24 -1.21 0.70 0.00 0.00 175.22 174.01 1s7u s GLU 9 N 1.63 1.73 -0.05 0.44 2.02 0.40 -0.74 118.70 124.14 1s7u s GLU 9 Ca 0.06 -1.01 -0.03 0.00 0.02 0.00 0.00 54.97 54.01 1s7u s GLU 9 Cb -0.16 -1.84 0.02 0.00 0.10 0.00 0.00 34.13 32.26 1s7u s GLU 9 CO 0.05 0.48 0.11 0.99 0.02 0.00 0.00 175.26 176.92 1s7u s THR 10 N -0.74 -0.02 -0.04 3.63 2.01 0.33 -0.64 115.64 120.17 1s7u s THR 10 Ca 0.10 0.09 0.03 0.00 0.31 0.00 0.00 61.69 62.22 1s7u s THR 10 Cb -0.09 -0.18 0.00 0.00 0.01 0.00 0.00 72.50 72.24 1s7u s THR 10 CO 0.01 0.04 -0.12 0.00 -0.69 0.00 0.00 174.62 173.85 1s7u s ALA 11 N 0.58 1.18 -0.12 7.40 0.00 -0.37 -0.55 121.76 129.89 1s7u s ALA 11 Ca -0.04 -0.47 0.00 0.00 0.00 0.00 0.00 51.96 51.45 1s7u s ALA 11 Cb -0.06 -0.44 0.02 0.00 0.00 0.00 0.00 23.12 22.64 1s7u s ALA 11 CO -0.03 0.18 -0.10 0.08 0.00 0.00 0.00 175.76 175.89 1s7u s VAL 12 N 0.26 1.22 -0.09 0.00 1.01 -0.60 -1.30 120.40 120.90 1s7u s VAL 12 Ca -0.06 -0.42 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 1s7u s VAL 12 Cb -0.11 -1.19 -0.05 0.00 0.00 0.00 0.00 36.38 35.04 1s7u s VAL 12 CO 0.02 0.40 0.23 -0.94 0.00 0.00 0.00 175.10 174.80 1s7u s SER 13 N 1.54 6.52 0.10 3.32 1.04 -0.42 -2.12 113.70 123.68 1s7u s SER 13 Ca 0.03 0.62 0.07 0.00 0.48 0.00 0.00 55.95 57.15 1s7u s SER 13 Cb -0.13 -2.13 -0.03 0.00 0.10 0.00 0.00 66.02 63.83 1s7u s SER 13 CO -0.08 0.37 -0.18 -0.13 0.98 0.00 0.00 173.24 174.20 1s7u s ARG 14 N -0.96 1.03 0.03 4.02 0.52 -1.26 -1.67 118.95 120.66 1s7u s ARG 14 Ca 0.18 -1.12 -0.06 0.00 -0.52 0.00 0.00 55.73 54.21 1s7u s ARG 14 Cb -0.13 -1.16 -0.01 0.00 0.52 0.00 0.00 34.95 34.16 1s7u s ARG 14 CO 0.07 0.26 1.04 -2.30 0.02 0.00 0.00 175.30 174.38 1s7u n PRO 15 N 1.03 -0.08 0.01 3.54 -0.02 -1.22 -2.34 135.00 135.93 1s7u n PRO 15 Ca -0.19 1.03 0.11 0.00 -2.02 0.00 0.00 63.50 62.43 1s7u n PRO 15 Cb 0.54 -1.54 0.03 0.00 -0.02 0.00 0.00 33.50 32.52 1s7u n PRO 15 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1s7u n GLY 16 N -1.05 -1.16 3.74 -1.23 0.00 -1.26 -4.58 105.19 99.65 1s7u n GLY 16 Ca 0.00 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 1s7u n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1s7u n LEU 17 N -1.75 4.21 0.07 0.99 7.99 -0.99 -4.91 117.00 122.61 1s7u n LEU 17 Ca 0.03 1.21 -0.12 0.00 -0.01 0.00 0.00 56.01 57.12 1s7u n LEU 17 Cb 0.39 -1.56 -0.05 0.00 -0.11 0.00 0.00 43.42 42.09 1s7u n LEU 17 CO 0.40 -0.10 0.68 -0.33 -1.51 0.00 0.00 177.39 176.53 1s7u h GLU 18 N 3.10 -0.41 -3.68 3.23 4.39 -1.93 -3.45 114.58 115.82 1s7u h GLU 18 Ca -0.48 0.03 -0.08 0.00 0.34 0.00 0.00 59.36 59.17 1s7u h GLU 18 Cb 1.26 0.09 -0.13 0.00 -0.10 0.00 0.00 28.75 29.87 1s7u h GLU 18 CO 0.66 -0.27 -0.24 -1.83 -1.16 0.00 0.00 179.01 176.17 1s7u s GLU 19 N -6.05 1.07 0.56 2.33 -1.05 -1.26 -5.11 118.70 109.19 1s7u s GLU 19 Ca -0.15 -0.97 -0.19 0.00 -0.15 0.00 0.00 54.97 53.51 1s7u s GLU 19 Cb 0.09 0.40 -0.05 0.00 -0.44 0.00 0.00 34.13 34.13 1s7u s GLU 19 CO 0.66 -0.39 1.13 -2.14 0.95 0.00 0.00 175.26 175.46 1s7u s PRO 20 N -3.89 3.29 -0.07 -4.83 0.02 -1.26 -4.92 135.00 123.34 1s7u s PRO 20 Ca 0.09 1.59 -0.27 0.00 0.02 0.00 0.00 61.00 62.44 1s7u s PRO 20 Cb 0.03 -2.00 -0.03 0.00 0.02 0.00 0.00 34.50 32.52 1s7u s PRO 20 CO -0.06 -0.90 0.85 0.50 -0.33 0.00 0.00 177.00 177.05 1s7u s ARG 21 N -3.37 4.45 -0.19 5.54 3.52 -0.90 -4.86 118.95 123.13 1s7u s ARG 21 Ca 0.72 1.14 -0.02 0.00 -0.13 0.00 0.00 55.73 57.44 1s7u s ARG 21 Cb -0.24 -3.48 -0.00 0.00 -1.56 0.00 0.00 34.95 29.67 1s7u s ARG 21 CO 0.29 -0.08 -0.10 -0.47 -0.81 0.00 0.00 175.30 174.13 1s7u s TYR 22 N 1.23 2.89 -0.06 5.12 5.04 -1.26 -1.56 117.35 128.74 1s7u s TYR 22 Ca 0.44 -1.06 0.04 0.00 -2.44 0.00 0.00 57.07 54.05 1s7u s TYR 22 Cb -0.19 -2.01 -0.00 0.00 0.35 0.00 0.00 41.96 40.11 1s7u s TYR 22 CO 0.20 -0.55 -0.20 0.42 -1.34 0.00 0.00 175.55 174.08 1s7u s ILE 23 N 1.23 1.69 -0.03 3.14 1.01 0.29 -1.75 121.20 126.78 1s7u s ILE 23 Ca 0.02 -0.84 0.06 0.00 0.00 0.00 0.00 60.65 59.89 1s7u s ILE 23 Cb -0.14 -1.46 -0.01 0.00 0.01 0.00 0.00 42.46 40.86 1s7u s ILE 23 CO -0.04 0.48 -0.21 -0.55 0.00 0.00 0.00 174.94 174.62 1s7u s SER 24 N 0.15 2.46 -0.06 3.58 0.15 -0.80 -0.51 113.70 118.67 1s7u s SER 24 Ca -0.09 -0.39 0.01 0.00 0.70 0.00 0.00 55.95 56.19 1s7u s SER 24 Cb -0.14 -0.41 0.02 0.00 -1.71 0.00 0.00 66.02 63.77 1s7u s SER 24 CO 0.04 0.23 -0.08 -0.69 1.20 0.00 0.00 173.24 173.95 1s7u s VAL 25 N -0.34 0.83 -0.03 4.45 1.01 0.08 -1.33 120.40 125.08 1s7u s VAL 25 Ca 0.04 -0.29 -0.02 0.00 0.00 0.00 0.00 61.98 61.71 1s7u s VAL 25 Cb -0.09 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 1s7u s VAL 25 CO 0.00 0.29 0.10 -0.83 0.00 0.00 0.00 175.10 174.67 1s7u s GLY 26 N 0.87 2.05 -0.03 4.51 0.00 -0.60 -0.33 107.32 113.78 1s7u s GLY 26 Ca -0.11 -0.81 0.02 0.00 0.00 0.00 0.00 44.72 43.81 1s7u s GLY 26 CO 0.01 -0.66 -0.08 -0.19 0.00 0.00 0.00 173.10 172.18 1s7u s TYR 27 N -1.16 0.85 -0.15 1.90 1.51 0.84 -1.40 117.35 119.75 1s7u s TYR 27 Ca 0.22 -0.21 0.01 0.00 -1.01 0.00 0.00 57.07 56.07 1s7u s TYR 27 Cb -0.12 -0.63 -0.00 0.00 -0.11 0.00 0.00 41.96 41.10 1s7u s TYR 27 CO 0.12 -0.11 -0.17 0.08 -1.11 0.00 0.00 175.55 174.37 1s7u s VAL 28 N 0.29 2.55 -1.52 0.71 1.01 -0.04 -1.27 120.40 122.12 1s7u s VAL 28 Ca -0.04 -0.81 -0.05 0.00 0.00 0.00 0.00 61.98 61.07 1s7u s VAL 28 Cb -0.09 -2.06 0.05 0.00 0.00 0.00 0.00 36.38 34.28 1s7u s VAL 28 CO 0.00 0.52 0.43 0.47 0.00 0.00 0.00 175.10 176.53 1s7u n ASP 29 N 4.02 -0.83 -1.51 3.32 8.00 0.54 -1.22 116.55 128.87 1s7u n ASP 29 Ca -0.19 -1.07 -0.20 0.00 0.71 0.00 0.00 54.79 54.04 1s7u n ASP 29 Cb 0.52 -2.65 -0.08 0.00 -0.02 0.00 0.00 41.12 38.89 1s7u n ASP 29 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1s7u n ASN 30 N -2.87 -5.36 -4.36 -2.24 4.13 -1.26 -4.99 115.26 98.30 1s7u n ASN 30 Ca -0.21 0.47 -0.32 0.00 1.68 0.00 0.00 54.58 56.20 1s7u n ASN 30 Cb 0.63 -4.57 -0.15 0.00 -1.54 0.00 0.00 39.78 34.15 1s7u n ASN 30 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1s7u s LYS 31 N -3.68 2.67 0.29 3.52 2.20 -0.35 -5.07 119.74 119.32 1s7u s LYS 31 Ca 0.00 -0.79 -0.29 0.00 -0.36 0.00 0.00 55.97 54.52 1s7u s LYS 31 Cb 0.00 -2.32 -0.10 0.00 -1.51 0.00 0.00 37.83 33.90 1s7u s LYS 31 CO 0.00 0.44 1.40 -2.00 -0.36 0.00 0.00 175.35 174.83 1s7u s GLU 32 N -0.29 4.28 0.00 4.03 2.12 -1.26 -0.86 118.70 126.72 1s7u s GLU 32 Ca 0.01 2.30 0.00 0.00 0.36 0.00 0.00 54.97 57.65 1s7u s GLU 32 Cb -0.13 -3.08 0.00 0.00 0.26 0.00 0.00 34.13 31.18 1s7u s GLU 32 CO 0.03 -0.35 0.00 1.97 -0.54 0.00 0.00 175.26 176.36 1s7u n PHE 33 N 1.60 0.00 -3.83 5.30 -1.74 -0.49 -4.39 117.46 113.90 1s7u n PHE 33 Ca 0.04 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.83 1s7u n PHE 33 Cb 0.41 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.33 1s7u n PHE 33 CO 0.00 0.00 0.00 0.14 -0.56 0.00 0.00 176.76 176.34 1s7u s VAL 34 N -0.09 0.12 -0.25 1.97 -7.23 -1.23 -1.73 120.40 111.97 1s7u s VAL 34 Ca 0.00 -0.96 -0.18 0.00 -1.81 0.00 0.00 61.98 59.03 1s7u s VAL 34 Cb 0.00 -1.07 0.07 0.00 0.56 0.00 0.00 36.38 35.94 1s7u s VAL 34 CO 0.00 -0.53 0.63 -0.60 -0.31 0.00 0.00 175.10 174.29 1s7u s ARG 35 N -3.04 0.68 0.07 4.82 3.52 -0.96 -1.56 118.95 122.48 1s7u s ARG 35 Ca -0.01 1.01 0.10 0.00 -0.13 0.00 0.00 55.73 56.69 1s7u s ARG 35 Cb 0.01 0.22 -0.03 0.00 -1.56 0.00 0.00 34.95 33.59 1s7u s ARG 35 CO -0.06 -0.12 -0.26 0.12 -0.81 0.00 0.00 175.30 174.16 1s7u s PHE 36 N 1.01 2.26 -0.21 5.12 2.19 -0.44 -0.92 117.98 127.00 1s7u s PHE 36 Ca -0.05 -0.40 -0.06 0.00 0.33 0.00 0.00 56.93 56.75 1s7u s PHE 36 Cb -0.05 -1.32 0.10 0.00 -1.31 0.00 0.00 43.02 40.43 1s7u s PHE 36 CO -0.09 0.17 0.40 0.34 1.83 0.00 0.00 175.22 177.87 1s7u s ASP 37 N -1.44 -0.13 0.37 6.13 -1.08 -1.26 -1.91 116.67 117.35 1s7u s ASP 37 Ca 0.12 0.81 0.27 0.00 -0.52 0.00 0.00 52.55 53.22 1s7u s ASP 37 Cb -0.10 1.28 1.22 0.00 -1.46 0.00 0.00 42.92 43.86 1s7u s ASP 37 CO 0.03 -0.25 1.81 0.77 0.52 0.00 0.00 175.17 178.06 1s7u h SER 38 N 8.18 0.00 1.62 -0.34 4.64 -1.74 -2.77 113.55 123.15 1s7u h SER 38 Ca -0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1s7u h SER 38 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1s7u h SER 38 CO 0.16 0.00 0.00 0.44 -0.87 0.00 0.00 176.83 176.56 1s7u h ASP 39 N 0.00 0.00 -4.10 4.97 5.19 -1.96 -3.46 116.42 117.06 1s7u h ASP 39 Ca 0.00 0.00 -0.55 0.00 -0.62 0.00 0.00 57.03 55.86 1s7u h ASP 39 Cb 0.30 0.00 0.18 0.00 0.18 0.00 0.00 39.33 39.99 1s7u h ASP 39 CO 0.00 0.00 0.34 0.00 -3.12 0.00 0.00 179.24 176.46 1s7u n ALA 40 N -2.09 0.24 -0.10 3.45 0.00 -1.04 -4.93 120.51 116.04 1s7u n ALA 40 Ca 0.03 -0.22 -0.06 0.00 0.00 0.00 0.00 53.44 53.18 1s7u n ALA 40 Cb 0.44 -2.25 0.01 0.00 0.00 0.00 0.00 19.45 17.66 1s7u n ALA 40 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1s7u h GLU 41 N -0.43 0.18 -2.20 0.00 4.81 -1.90 -3.30 114.58 111.73 1s7u h GLU 41 Ca -0.48 -0.01 -0.60 0.00 -0.13 0.00 0.00 59.36 58.15 1s7u h GLU 41 Cb 1.31 -0.04 -0.42 0.00 0.63 0.00 0.00 28.75 30.24 1s7u h GLU 41 CO 0.48 0.12 -0.63 -1.71 -0.73 0.00 0.00 179.01 176.54 1s7u n ASN 42 N -5.09 3.70 -4.71 1.04 5.15 -1.26 -5.07 115.26 109.02 1s7u n ASN 42 Ca 0.01 -3.45 -0.58 0.00 -0.60 0.00 0.00 54.58 49.96 1s7u n ASN 42 Cb 0.15 -0.65 -0.07 0.00 -0.53 0.00 0.00 39.78 38.68 1s7u n ASN 42 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1s7u n PRO 43 N 0.69 1.14 -3.71 1.20 -0.02 -1.25 -4.94 135.00 128.10 1s7u n PRO 43 Ca 0.30 0.42 -0.14 0.00 -2.02 0.00 0.00 63.50 62.05 1s7u n PRO 43 Cb 0.41 -2.11 -0.08 0.00 -0.02 0.00 0.00 33.50 31.71 1s7u n PRO 43 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1s7u s ARG 44 N 3.66 0.76 0.34 -0.52 0.52 -1.26 -5.02 118.95 117.42 1s7u s ARG 44 Ca 0.99 -0.13 -0.29 0.00 -0.52 0.00 0.00 55.73 55.78 1s7u s ARG 44 Cb -1.07 0.34 -0.10 0.00 0.52 0.00 0.00 34.95 34.63 1s7u s ARG 44 CO 0.66 -0.22 1.37 0.71 0.02 0.00 0.00 175.30 177.84 1s7u s TYR 45 N -1.41 2.92 0.06 -0.53 2.02 -1.26 -4.40 117.35 114.75 1s7u s TYR 45 Ca -0.12 1.31 0.05 0.00 -0.37 0.00 0.00 57.07 57.93 1s7u s TYR 45 Cb -0.04 -3.79 -0.03 0.00 -0.40 0.00 0.00 41.96 37.70 1s7u s TYR 45 CO 0.05 -2.26 -0.15 -1.21 -1.57 0.00 0.00 175.55 170.41 1s7u s GLU 46 N -1.73 0.87 0.46 -0.62 0.41 -0.09 -4.93 118.70 113.08 1s7u s GLU 46 Ca 0.51 -0.91 -0.24 0.00 -0.41 0.00 0.00 54.97 53.92 1s7u s GLU 46 Cb -0.42 -0.90 -0.07 0.00 -1.78 0.00 0.00 34.13 30.96 1s7u s GLU 46 CO 0.55 0.21 1.30 -1.25 -0.49 0.00 0.00 175.26 175.57 1s7u s PRO 47 N -1.58 3.67 0.00 0.39 0.04 -1.26 -2.27 135.00 133.99 1s7u s PRO 47 Ca -0.00 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.14 1s7u s PRO 47 Cb -0.09 -2.53 0.00 0.00 0.04 0.00 0.00 34.50 31.92 1s7u s PRO 47 CO 0.02 -0.72 0.53 0.54 0.04 0.00 0.00 177.00 177.41 1s7u n ARG 48 N -0.36 0.65 -3.93 4.56 1.74 -0.71 -4.85 116.66 113.77 1s7u n ARG 48 Ca 0.06 -0.67 -0.11 0.00 -0.77 0.00 0.00 57.85 56.37 1s7u n ARG 48 Cb 0.45 -0.72 -0.12 0.00 -1.02 0.00 0.00 32.46 31.04 1s7u n ARG 48 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1s7u s ALA 49 N -0.27 0.08 0.46 7.54 0.00 -1.25 -4.65 121.76 123.66 1s7u s ALA 49 Ca 0.00 -0.31 0.14 0.00 0.00 0.00 0.00 51.96 51.79 1s7u s ALA 49 Cb 0.00 0.07 1.09 0.00 0.00 0.00 0.00 23.12 24.28 1s7u s ALA 49 CO 0.00 -0.08 2.04 -1.35 0.00 0.00 0.00 175.76 176.37 1s7u h PRO 50 N 5.38 0.29 0.00 0.00 0.11 -1.96 -2.49 132.00 133.34 1s7u h PRO 50 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1s7u h PRO 50 Cb 1.21 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.25 1s7u h PRO 50 CO 0.46 0.20 0.00 0.11 -0.21 0.00 0.00 178.00 178.55 1s7u h TRP 51 N 0.30 0.00 0.00 0.65 5.08 -1.97 -2.97 115.95 117.04 1s7u h TRP 51 Ca 0.19 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.16 1s7u h TRP 51 Cb 0.35 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.51 1s7u h TRP 51 CO -0.00 0.00 -0.06 0.52 -1.28 0.00 0.00 178.44 177.62 1s7u h MET 52 N 0.00 0.00 0.00 0.12 2.86 -1.79 -3.25 114.93 112.87 1s7u h MET 52 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1s7u h MET 52 Cb 0.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.86 1s7u h MET 52 CO 0.00 0.00 0.00 0.39 1.06 0.00 0.00 176.91 178.36 1s7u n GLU 53 N -2.56 0.07 -0.03 1.72 1.02 -1.12 -1.91 120.64 117.83 1s7u n GLU 53 Ca 0.05 0.42 0.17 0.00 -0.02 0.00 0.00 57.16 57.78 1s7u n GLU 53 Cb 0.47 -1.68 0.63 0.00 -0.02 0.00 0.00 31.44 30.84 1s7u n GLU 53 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1s7u h GLN 54 N 0.00 0.13 -6.55 3.49 4.20 -1.80 -3.43 115.11 111.15 1s7u h GLN 54 Ca 0.00 -0.01 -0.53 0.00 0.06 0.00 0.00 58.65 58.17 1s7u h GLN 54 Cb 0.18 -0.03 0.02 0.00 0.30 0.00 0.00 27.48 27.95 1s7u h GLN 54 CO 0.00 0.09 0.65 -1.21 -0.67 0.00 0.00 178.83 177.69 1s7u s GLU 55 N -5.14 4.38 1.04 1.46 0.41 -0.80 -5.02 118.70 115.02 1s7u s GLU 55 Ca -0.06 1.96 -0.15 0.00 -0.41 0.00 0.00 54.97 56.31 1s7u s GLU 55 Cb 0.20 -3.27 0.21 0.00 -1.78 0.00 0.00 34.13 29.48 1s7u s GLU 55 CO 0.74 -0.33 1.14 0.20 -0.49 0.00 0.00 175.26 176.51 1s7u s GLY 56 N 0.92 1.60 0.62 -1.39 0.00 -1.26 -4.89 107.32 102.92 1s7u s GLY 56 Ca 0.61 -0.70 0.37 0.00 0.00 0.00 0.00 44.72 45.01 1s7u s GLY 56 CO 0.31 0.01 2.28 -0.56 0.00 0.00 0.00 173.10 175.14 1s7u h PRO 57 N -1.98 0.00 -0.07 2.90 0.13 -1.97 -2.35 132.00 128.65 1s7u h PRO 57 Ca -0.49 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.50 1s7u h PRO 57 Cb 1.31 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.43 1s7u h PRO 57 CO 0.49 0.01 -0.57 0.93 -0.23 0.00 0.00 178.00 178.64 1s7u h GLU 58 N 0.00 0.22 -0.03 0.86 5.08 -1.99 -1.10 114.58 117.63 1s7u h GLU 58 Ca -0.00 -0.15 -0.00 0.00 -1.00 0.00 0.00 59.36 58.21 1s7u h GLU 58 Cb 0.07 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 1s7u h GLU 58 CO 0.00 0.73 0.01 -0.92 -1.00 0.00 0.00 179.01 177.84 1s7u h TYR 59 N 0.17 0.04 -0.42 4.33 5.03 -1.77 -2.64 116.97 121.70 1s7u h TYR 59 Ca -0.00 -0.00 -0.15 0.00 2.58 0.00 0.00 58.73 61.16 1s7u h TYR 59 Cb 1.05 -0.01 -0.01 0.00 1.55 0.00 0.00 36.73 39.31 1s7u h TYR 59 CO 0.02 0.11 -0.32 -1.49 -1.32 0.00 0.00 178.16 175.16 1s7u h TRP 60 N -0.05 1.12 -0.93 -3.82 4.06 -1.51 -1.89 115.95 112.94 1s7u h TRP 60 Ca 0.01 -0.31 0.00 0.00 2.06 0.00 0.00 58.89 60.65 1s7u h TRP 60 Cb 0.08 -0.25 -0.05 0.00 -1.00 0.00 0.00 29.16 27.95 1s7u h TRP 60 CO -0.05 1.14 0.59 0.93 -3.56 0.00 0.00 178.44 177.49 1s7u h GLU 61 N 0.78 1.24 -0.00 0.49 5.08 -1.27 -1.29 114.58 119.61 1s7u h GLU 61 Ca 0.08 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1s7u h GLU 61 Cb 0.91 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1s7u h GLU 61 CO 0.08 0.84 -0.00 -0.09 -1.00 0.00 0.00 179.01 178.85 1s7u h ARG 62 N 1.27 0.00 -0.55 2.33 2.43 -1.32 -2.26 114.38 116.28 1s7u h ARG 62 Ca 0.34 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.51 1s7u h ARG 62 Cb -0.10 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 1s7u h ARG 62 CO -0.07 0.65 0.36 0.93 -1.51 0.00 0.00 179.97 180.34 1s7u h GLU 63 N -0.65 0.71 -0.31 0.20 4.39 -1.36 -1.24 114.58 116.32 1s7u h GLU 63 Ca -0.00 -0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.58 1s7u h GLU 63 Cb 0.65 -0.16 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 1s7u h GLU 63 CO 0.00 0.47 -0.11 1.15 -1.16 0.00 0.00 179.01 179.36 1s7u h THR 64 N 0.73 1.29 -0.67 1.13 2.02 -1.21 -0.98 112.91 115.21 1s7u h THR 64 Ca 0.20 -1.19 -0.02 0.00 0.77 0.00 0.00 66.41 66.18 1s7u h THR 64 Cb -0.07 1.41 -0.03 0.00 -1.74 0.00 0.00 68.15 67.72 1s7u h THR 64 CO -0.05 0.38 0.34 1.56 0.37 0.00 0.00 175.52 178.13 1s7u h GLN 65 N 0.39 0.94 -0.52 6.66 1.08 -1.04 -1.13 115.11 121.48 1s7u h GLN 65 Ca 0.07 -0.11 -0.01 0.00 -1.45 0.00 0.00 58.65 57.16 1s7u h GLN 65 Cb 0.62 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.84 1s7u h GLN 65 CO 0.04 0.71 0.30 0.87 -0.95 0.00 0.00 178.83 179.79 1s7u h LYS 66 N 0.94 0.72 -0.65 1.46 1.57 -0.92 -1.48 116.57 118.21 1s7u h LYS 66 Ca 0.23 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.93 1s7u h LYS 66 Cb 0.06 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 1s7u h LYS 66 CO -0.03 0.55 0.35 0.00 -0.57 0.00 0.00 179.45 179.74 1s7u h ALA 67 N 1.13 0.83 -0.37 3.86 0.00 -0.68 0.09 119.26 124.13 1s7u h ALA 67 Ca 0.19 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 1s7u h ALA 67 Cb 0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1s7u h ALA 67 CO -0.03 0.35 -0.03 0.87 0.00 0.00 0.00 179.25 180.40 1s7u h LYS 68 N 0.88 0.61 -0.35 0.00 1.57 -0.99 0.41 116.57 118.71 1s7u h LYS 68 Ca 0.23 -0.15 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 1s7u h LYS 68 Cb 0.04 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.26 1s7u h LYS 68 CO -0.04 0.66 0.12 0.78 -0.57 0.00 0.00 179.45 180.40 1s7u h GLY 69 N 0.91 0.58 1.01 3.86 0.00 -0.68 -2.52 103.07 106.23 1s7u h GLY 69 Ca 0.11 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1s7u h GLY 69 CO 0.02 0.31 0.59 1.46 0.00 0.00 0.00 176.54 178.92 1s7u h GLN 70 N 0.41 1.22 -0.46 4.80 1.08 -0.38 -0.72 115.11 121.07 1s7u h GLN 70 Ca 0.11 -0.09 0.04 0.00 -1.45 0.00 0.00 58.65 57.27 1s7u h GLN 70 Cb 0.24 -0.27 -0.04 0.00 -0.05 0.00 0.00 27.48 27.36 1s7u h GLN 70 CO -0.01 0.82 0.22 1.49 -0.95 0.00 0.00 178.83 180.41 1s7u h GLU 71 N 1.25 0.43 -0.38 1.46 4.81 -0.81 0.66 114.58 122.01 1s7u h GLU 71 Ca 0.33 -0.03 -0.12 0.00 -0.13 0.00 0.00 59.36 59.42 1s7u h GLU 71 Cb -0.11 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 1s7u h GLU 71 CO -0.07 0.28 -0.24 1.96 -0.73 0.00 0.00 179.01 180.22 1s7u h GLN 72 N 0.44 0.76 -0.79 1.92 1.08 -0.97 -1.55 115.11 115.99 1s7u h GLN 72 Ca 0.20 -0.31 -0.01 0.00 -1.45 0.00 0.00 58.65 57.08 1s7u h GLN 72 Cb 0.12 -0.03 -0.04 0.00 -0.05 0.00 0.00 27.48 27.48 1s7u h GLN 72 CO -0.15 0.92 0.47 2.35 -0.95 0.00 0.00 178.83 181.47 1s7u h TRP 73 N 0.66 1.05 -0.13 2.96 7.01 -0.52 -2.14 115.95 124.85 1s7u h TRP 73 Ca 0.09 -0.01 -0.14 0.00 2.11 0.00 0.00 58.89 60.94 1s7u h TRP 73 Cb 0.74 -0.34 -0.01 0.00 -2.10 0.00 0.00 29.16 27.45 1s7u h TRP 73 CO 0.04 0.71 -0.54 0.74 -2.79 0.00 0.00 178.44 176.60 1s7u h PHE 74 N 1.09 0.45 -0.14 2.65 -1.00 -0.76 -1.80 116.94 117.43 1s7u h PHE 74 Ca 0.28 -0.16 -0.01 0.00 2.81 0.00 0.00 57.97 60.89 1s7u h PHE 74 Cb -0.03 -0.09 -0.01 0.00 3.61 0.00 0.00 35.95 39.44 1s7u h PHE 74 CO -0.00 0.82 0.03 -0.09 -1.61 0.00 0.00 178.31 177.46 1s7u h ARG 75 N 0.28 0.23 -0.47 1.51 2.43 -1.02 -1.17 114.38 116.18 1s7u h ARG 75 Ca 0.01 -0.06 -0.12 0.00 -0.81 0.00 0.00 59.98 59.00 1s7u h ARG 75 Cb 1.03 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.54 1s7u h ARG 75 CO 0.09 0.39 -0.18 0.28 -1.51 0.00 0.00 179.97 179.04 1s7u h VAL 76 N 0.03 1.27 -0.60 0.20 2.07 -1.35 -2.51 116.25 115.36 1s7u h VAL 76 Ca 0.04 -1.33 -0.02 0.00 0.82 0.00 0.00 66.70 66.21 1s7u h VAL 76 Cb 0.26 1.14 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 1s7u h VAL 76 CO 0.00 0.46 0.30 0.28 0.02 0.00 0.00 177.57 178.62 1s7u h SER 77 N 0.79 0.78 -0.78 0.57 0.02 -1.28 0.03 113.55 113.68 1s7u h SER 77 Ca 0.11 -0.13 0.08 0.00 -0.84 0.00 0.00 61.79 61.01 1s7u h SER 77 Cb 0.75 -0.20 -0.07 0.00 0.14 0.00 0.00 62.40 63.02 1s7u h SER 77 CO 0.06 0.69 0.45 -0.07 -1.14 0.00 0.00 176.83 176.82 1s7u h LEU 78 N 0.82 0.66 -0.31 5.07 4.07 -1.10 0.41 115.31 124.93 1s7u h LEU 78 Ca 0.21 0.04 -0.03 0.00 0.08 0.00 0.00 57.88 58.18 1s7u h LEU 78 Cb 0.11 -0.09 -0.01 0.00 1.08 0.00 0.00 40.66 41.74 1s7u h LEU 78 CO -0.03 0.40 0.08 -0.09 -1.08 0.00 0.00 178.44 177.73 1s7u h ARG 79 N 0.79 0.50 -0.63 1.13 2.43 -0.93 -2.57 114.38 115.10 1s7u h ARG 79 Ca 0.36 -0.12 -0.03 0.00 -0.81 0.00 0.00 59.98 59.39 1s7u h ARG 79 Cb 0.28 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.73 1s7u h ARG 79 CO -0.22 0.56 0.28 -0.91 -1.51 0.00 0.00 179.97 178.17 1s7u h ASN 80 N 0.35 0.84 -0.24 -3.80 2.35 -0.43 -2.97 115.58 111.67 1s7u h ASN 80 Ca 0.10 -0.15 -0.05 0.00 -0.55 0.00 0.00 56.30 55.65 1s7u h ASN 80 Cb 0.28 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 1s7u h ASN 80 CO -0.00 0.75 -0.01 -0.07 -1.65 0.00 0.00 177.43 176.46 1s7u h LEU 81 N 0.87 0.52 -0.51 1.61 3.38 -0.84 -1.08 115.31 119.25 1s7u h LEU 81 Ca 0.21 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 58.10 1s7u h LEU 81 Cb 0.15 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1s7u h LEU 81 CO -0.02 0.59 0.31 0.25 0.09 0.00 0.00 178.44 179.66 1s7u h LEU 82 N 0.53 0.50 -0.58 1.67 5.85 -1.30 -1.28 115.31 120.69 1s7u h LEU 82 Ca 0.11 0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.72 1s7u h LEU 82 Cb 0.35 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1s7u h LEU 82 CO 0.01 0.35 -0.12 1.23 -0.34 0.00 0.00 178.44 179.58 1s7u h GLY 83 N 0.61 1.09 1.57 3.75 0.00 -1.31 -0.19 103.07 108.59 1s7u h GLY 83 Ca 0.21 -0.88 -0.05 0.00 0.00 0.00 0.00 47.33 46.61 1s7u h GLY 83 CO -0.09 0.81 0.02 -0.97 0.00 0.00 0.00 176.54 176.30 1s7u h TYR 84 N 0.89 0.56 -0.60 5.60 0.05 -0.85 -2.70 116.97 119.93 1s7u h TYR 84 Ca 0.14 -0.05 0.00 0.00 0.05 0.00 0.00 58.73 58.87 1s7u h TYR 84 Cb 0.68 -0.16 0.00 0.00 1.01 0.00 0.00 36.73 38.25 1s7u h TYR 84 CO 0.04 0.54 0.00 0.66 -1.05 0.00 0.00 178.16 178.35 1s7u n TYR 85 N -4.29 1.08 -4.08 4.88 4.01 -0.51 -4.83 117.16 113.42 1s7u n TYR 85 Ca 0.02 -0.57 -0.31 0.00 -0.16 0.00 0.00 57.90 56.88 1s7u n TYR 85 Cb 0.24 -0.12 -0.02 0.00 -0.31 0.00 0.00 39.34 39.13 1s7u n TYR 85 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1s7u n ASN 86 N 1.09 -2.42 -4.85 7.72 5.15 -0.77 -4.93 115.26 116.26 1s7u n ASN 86 Ca 0.22 -0.97 -0.34 0.00 -0.60 0.00 0.00 54.58 52.89 1s7u n ASN 86 Cb 0.71 -3.04 -0.06 0.00 -0.53 0.00 0.00 39.78 36.86 1s7u n ASN 86 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1s7u s GLN 87 N -6.74 3.99 0.63 1.20 -0.21 -0.15 -5.04 119.66 113.34 1s7u s GLN 87 Ca 0.45 0.56 0.08 0.00 0.02 0.00 0.00 55.36 56.48 1s7u s GLN 87 Cb -0.24 -2.70 0.11 0.00 1.00 0.00 0.00 33.01 31.18 1s7u s GLN 87 CO 0.90 0.33 0.87 -1.12 -2.12 0.00 0.00 175.29 174.14 1s7u s SER 88 N -2.03 4.85 0.70 5.90 0.01 -1.26 -4.67 113.70 117.20 1s7u s SER 88 Ca 0.46 -0.84 -0.13 0.00 1.31 0.00 0.00 55.95 56.75 1s7u s SER 88 Cb -0.13 0.42 0.02 0.00 0.21 0.00 0.00 66.02 66.54 1s7u s SER 88 CO 0.19 -1.55 1.09 0.00 0.41 0.00 0.00 173.24 173.39 1s7u s ALA 89 N -2.81 2.46 0.00 1.44 0.00 -1.26 -4.43 121.76 117.16 1s7u s ALA 89 Ca 0.64 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.94 1s7u s ALA 89 Cb -0.05 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1s7u s ALA 89 CO 0.41 -1.39 0.00 0.41 0.00 0.00 0.00 175.76 175.19 1s7u n GLY 90 N -1.09 0.98 3.70 0.00 0.00 -1.26 -5.09 105.19 102.43 1s7u n GLY 90 Ca 0.09 -0.03 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1s7u n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1s7u s GLY 91 N -2.02 2.89 -0.03 -0.02 0.00 -1.26 -4.78 107.32 102.10 1s7u s GLY 91 Ca 0.00 -0.74 -0.00 0.00 0.00 0.00 0.00 44.72 43.98 1s7u s GLY 91 CO 0.00 -2.13 0.02 -0.56 0.00 0.00 0.00 173.10 170.44 1s7u s SER 92 N -3.81 5.31 0.04 1.64 0.01 -1.26 -3.41 113.70 112.22 1s7u s SER 92 Ca 0.12 0.09 -0.01 0.00 1.31 0.00 0.00 55.95 57.45 1s7u s SER 92 Cb 0.03 -1.46 -0.03 0.00 0.21 0.00 0.00 66.02 64.77 1s7u s SER 92 CO 0.07 0.31 -0.01 -1.00 0.41 0.00 0.00 173.24 173.02 1s7u s HIS 93 N -1.04 0.36 -0.02 2.43 0.09 -0.67 -5.00 115.29 111.43 1s7u s HIS 93 Ca 0.18 -0.75 0.01 0.00 -0.00 0.00 0.00 55.06 54.50 1s7u s HIS 93 Cb -0.12 -0.26 0.01 0.00 -0.00 0.00 0.00 32.58 32.21 1s7u s HIS 93 CO 0.08 -0.30 -0.02 0.99 -0.00 0.00 0.00 174.74 175.49 1s7u s THR 94 N -2.68 0.29 -0.09 1.30 2.01 -1.26 -1.30 115.64 113.90 1s7u s THR 94 Ca -0.05 -0.05 0.03 0.00 0.31 0.00 0.00 61.69 61.93 1s7u s THR 94 Cb -0.01 -0.31 0.01 0.00 0.01 0.00 0.00 72.50 72.19 1s7u s THR 94 CO -0.05 0.13 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.62 1s7u s LEU 95 N 0.54 1.82 0.13 4.42 2.96 -0.42 -1.20 118.68 126.93 1s7u s LEU 95 Ca -0.06 -0.43 0.06 0.00 -0.22 0.00 0.00 54.13 53.48 1s7u s LEU 95 Cb -0.09 -1.10 -0.04 0.00 0.50 0.00 0.00 46.19 45.46 1s7u s LEU 95 CO -0.01 0.07 -0.14 -1.10 -1.32 0.00 0.00 176.35 173.85 1s7u s GLN 96 N 0.69 1.05 -0.04 1.98 -0.21 -0.05 -1.23 119.66 121.84 1s7u s GLN 96 Ca -0.13 -1.28 -0.02 0.00 0.02 0.00 0.00 55.36 53.95 1s7u s GLN 96 Cb -0.16 -0.91 0.02 0.00 1.00 0.00 0.00 33.01 32.96 1s7u s GLN 96 CO 0.03 0.17 0.10 -1.14 -2.12 0.00 0.00 175.29 172.33 1s7u s GLN 97 N -2.80 0.07 -0.02 2.91 0.74 0.19 -1.12 119.66 119.62 1s7u s GLN 97 Ca 0.10 0.23 0.07 0.00 0.05 0.00 0.00 55.36 55.81 1s7u s GLN 97 Cb -0.04 -0.10 -0.02 0.00 1.10 0.00 0.00 33.01 33.94 1s7u s GLN 97 CO 0.03 -0.10 -0.22 -1.64 -0.55 0.00 0.00 175.29 172.81 1s7u s MET 98 N 0.70 2.21 0.04 1.67 -1.94 -0.61 -0.45 119.30 120.91 1s7u s MET 98 Ca -0.05 -0.87 -0.18 0.00 -1.71 0.00 0.00 55.69 52.87 1s7u s MET 98 Cb -0.07 -2.15 0.04 0.00 2.01 0.00 0.00 34.83 34.66 1s7u s MET 98 CO -0.03 0.58 0.42 -1.54 -0.01 0.00 0.00 175.02 174.43 1s7u s SER 99 N -0.73 -0.29 0.00 3.03 1.04 -0.85 -1.53 113.70 114.36 1s7u s SER 99 Ca 0.11 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.55 1s7u s SER 99 Cb -0.10 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1s7u s SER 99 CO -0.00 -0.66 0.00 0.61 0.98 0.00 0.00 173.24 174.17 1s7u n GLY 100 N 0.52 -1.13 3.08 7.32 0.00 -0.80 -0.62 105.19 113.56 1s7u n GLY 100 Ca -0.19 -1.32 -0.13 0.00 0.00 0.00 0.00 46.02 44.39 1s7u n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s7u s ASP 102 N -1.73 4.41 0.02 0.00 1.01 -0.23 -1.24 116.67 118.92 1s7u s ASP 102 Ca -0.07 -0.17 0.05 0.00 0.71 0.00 0.00 52.55 53.07 1s7u s ASP 102 Cb -0.08 -1.42 -0.03 0.00 1.01 0.00 0.00 42.92 42.39 1s7u s ASP 102 CO -0.00 0.25 -0.10 -0.76 0.21 0.00 0.00 175.17 174.77 1s7u s LEU 103 N -0.14 3.01 1.31 1.23 1.43 0.13 0.38 118.68 126.03 1s7u s LEU 103 Ca 0.01 -0.24 -0.21 0.00 -1.03 0.00 0.00 54.13 52.66 1s7u s LEU 103 Cb -0.13 -1.74 0.33 0.00 0.03 0.00 0.00 46.19 44.67 1s7u s LEU 103 CO 0.03 0.26 1.02 -0.83 0.23 0.00 0.00 176.35 177.06 1s7u s GLY 104 N -1.50 1.50 0.16 -3.19 0.00 0.20 -1.93 107.32 102.56 1s7u s GLY 104 Ca 0.17 -0.84 0.24 0.00 0.00 0.00 0.00 44.72 44.28 1s7u s GLY 104 CO 0.08 0.10 1.73 -1.14 0.00 0.00 0.00 173.10 173.86 1s7u n SER 105 N -5.22 0.50 -0.27 1.64 3.41 -1.25 -1.54 113.62 110.89 1s7u n SER 105 Ca 0.12 0.58 0.05 0.00 -0.26 0.00 0.00 58.87 59.37 1s7u n SER 105 Cb 0.59 -0.70 0.22 0.00 -0.26 0.00 0.00 64.21 64.07 1s7u n SER 105 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1s7u n ASP 106 N -2.00 0.79 -0.48 4.04 5.75 -1.26 -4.92 116.55 118.47 1s7u n ASP 106 Ca 0.04 -1.82 -0.06 0.00 -0.01 0.00 0.00 54.79 52.93 1s7u n ASP 106 Cb 0.30 -0.08 -0.03 0.00 -1.03 0.00 0.00 41.12 40.29 1s7u n ASP 106 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1s7u n TRP 107 N -0.14 0.00 -3.09 2.11 7.02 -0.59 -5.00 117.44 117.75 1s7u n TRP 107 Ca 0.09 0.00 -0.32 0.00 -1.02 0.00 0.00 57.50 56.25 1s7u n TRP 107 Cb 0.15 -1.98 -0.05 0.00 -2.42 0.00 0.00 31.31 27.01 1s7u n TRP 107 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1s7u s ARG 108 N -2.23 3.90 0.04 -0.99 1.81 -1.26 -4.81 118.95 115.41 1s7u s ARG 108 Ca 0.00 0.54 -0.30 0.00 -1.72 0.00 0.00 55.73 54.25 1s7u s ARG 108 Cb 0.00 -2.45 -0.08 0.00 -0.45 0.00 0.00 34.95 31.97 1s7u s ARG 108 CO 0.00 0.12 1.70 -1.17 -0.68 0.00 0.00 175.30 175.27 1s7u s LEU 109 N -3.25 4.37 -0.19 2.53 2.96 -1.26 -0.63 118.68 123.21 1s7u s LEU 109 Ca 0.52 2.47 -0.21 0.00 -0.22 0.00 0.00 54.13 56.69 1s7u s LEU 109 Cb -0.10 -3.55 -0.21 0.00 0.50 0.00 0.00 46.19 42.83 1s7u s LEU 109 CO 0.22 -0.92 0.29 0.25 -1.32 0.00 0.00 176.35 174.87 1s7u h LEU 110 N 9.18 0.06 -7.10 -0.68 5.85 -0.39 -3.45 115.31 118.78 1s7u h LEU 110 Ca -0.43 -0.60 -0.07 0.00 0.84 0.00 0.00 57.88 57.62 1s7u h LEU 110 Cb 1.20 -0.02 -0.21 0.00 0.37 0.00 0.00 40.66 42.00 1s7u h LEU 110 CO 0.94 1.49 0.03 -0.60 -0.34 0.00 0.00 178.44 179.96 1s7u s ARG 111 N -2.37 0.77 0.05 1.25 3.52 -1.12 -5.00 118.95 116.05 1s7u s ARG 111 Ca -0.27 0.75 0.00 0.00 -0.13 0.00 0.00 55.73 56.09 1s7u s ARG 111 Cb 0.05 0.37 -0.04 0.00 -1.56 0.00 0.00 34.95 33.78 1s7u s ARG 111 CO 0.62 -0.12 0.15 0.20 -0.81 0.00 0.00 175.30 175.34 1s7u s GLY 112 N 0.07 2.12 -0.04 8.12 0.00 -1.26 -1.07 107.32 115.26 1s7u s GLY 112 Ca -0.02 -0.88 0.03 0.00 0.00 0.00 0.00 44.72 43.85 1s7u s GLY 112 CO 0.02 -0.83 -0.11 -0.19 0.00 0.00 0.00 173.10 171.98 1s7u s TYR 113 N -1.41 1.25 -0.29 1.90 1.51 -0.29 -4.78 117.35 115.24 1s7u s TYR 113 Ca 0.31 -0.37 0.01 0.00 -1.01 0.00 0.00 57.07 56.01 1s7u s TYR 113 Cb -0.13 -0.89 0.18 0.00 -0.11 0.00 0.00 41.96 41.01 1s7u s TYR 113 CO 0.23 -0.17 0.52 -1.17 -1.11 0.00 0.00 175.55 173.86 1s7u s LEU 114 N 0.33 -1.22 0.02 -1.29 0.20 -1.26 -1.90 118.68 113.57 1s7u s LEU 114 Ca -0.07 0.32 -0.02 0.00 0.69 0.00 0.00 54.13 55.06 1s7u s LEU 114 Cb -0.12 1.75 -0.02 0.00 -0.43 0.00 0.00 46.19 47.38 1s7u s LEU 114 CO 0.02 -0.30 0.01 0.00 -0.29 0.00 0.00 176.35 175.79 1s7u s GLN 115 N 2.74 0.39 0.09 1.98 -2.07 -0.59 -0.24 119.66 121.96 1s7u s GLN 115 Ca 0.14 -0.64 0.06 0.00 -1.82 0.00 0.00 55.36 53.10 1s7u s GLN 115 Cb -0.13 0.14 -0.03 0.00 -1.09 0.00 0.00 33.01 31.90 1s7u s GLN 115 CO -0.23 -0.07 -0.17 -0.06 -1.32 0.00 0.00 175.29 173.43 1s7u s PHE 116 N -1.76 1.47 0.04 9.60 0.40 0.17 -1.58 117.98 126.32 1s7u s PHE 116 Ca -0.13 -0.46 0.02 0.00 -0.60 0.00 0.00 56.93 55.77 1s7u s PHE 116 Cb -0.07 -0.81 -0.02 0.00 0.51 0.00 0.00 43.02 42.63 1s7u s PHE 116 CO -0.02 0.13 -0.08 0.00 0.70 0.00 0.00 175.22 175.95 1s7u s ALA 117 N -1.36 0.63 -0.05 5.36 0.00 -0.27 -1.53 121.76 124.53 1s7u s ALA 117 Ca 0.03 -0.69 0.03 0.00 0.00 0.00 0.00 51.96 51.33 1s7u s ALA 117 Cb -0.09 -0.01 0.01 0.00 0.00 0.00 0.00 23.12 23.03 1s7u s ALA 117 CO 0.03 0.03 -0.14 -0.47 0.00 0.00 0.00 175.76 175.22 1s7u s TYR 118 N -1.11 1.50 -1.41 0.00 5.04 -0.25 -0.87 117.35 120.24 1s7u s TYR 118 Ca -0.07 -0.50 -0.08 0.00 -2.44 0.00 0.00 57.07 53.99 1s7u s TYR 118 Cb -0.08 -1.06 0.04 0.00 0.35 0.00 0.00 41.96 41.21 1s7u s TYR 118 CO 0.00 -0.22 0.57 0.39 -1.34 0.00 0.00 175.55 174.96 1s7u n GLU 119 N 3.52 -4.21 -1.26 4.97 -0.58 -0.34 -1.95 120.64 120.80 1s7u n GLU 119 Ca -0.21 0.67 -0.09 0.00 -0.42 0.00 0.00 57.16 57.11 1s7u n GLU 119 Cb 0.52 -5.46 -0.04 0.00 -0.57 0.00 0.00 31.44 25.90 1s7u n GLU 119 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1s7u n GLY 120 N -1.36 1.05 3.18 0.62 0.00 -1.26 -5.02 105.19 102.40 1s7u n GLY 120 Ca -0.05 -0.51 -0.23 0.00 0.00 0.00 0.00 46.02 45.22 1s7u n GLY 120 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1s7u s ARG 121 N -2.63 1.23 -0.18 1.61 0.52 -0.82 -5.07 118.95 113.62 1s7u s ARG 121 Ca 0.00 -0.74 -0.41 0.00 -0.52 0.00 0.00 55.73 54.06 1s7u s ARG 121 Cb 0.00 -1.26 -0.18 0.00 0.52 0.00 0.00 34.95 34.03 1s7u s ARG 121 CO 0.00 0.33 1.45 -0.25 0.02 0.00 0.00 175.30 176.85 1s7u n ASP 122 N 2.20 1.35 -0.01 0.23 8.00 -1.26 -1.09 116.55 125.97 1s7u n ASP 122 Ca -0.16 1.13 -0.04 0.00 0.71 0.00 0.00 54.79 56.44 1s7u n ASP 122 Cb 0.54 -1.04 -0.01 0.00 -0.02 0.00 0.00 41.12 40.59 1s7u n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1s7u n TYR 123 N 3.43 0.00 -3.72 1.24 9.36 -0.58 -4.77 117.16 122.12 1s7u n TYR 123 Ca 0.24 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.32 1s7u n TYR 123 Cb 0.09 -0.20 -0.09 0.00 -0.63 0.00 0.00 39.34 38.51 1s7u n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 1s7u s ILE 124 N -2.23 0.03 -0.07 2.97 2.07 -1.22 -4.11 121.20 118.64 1s7u s ILE 124 Ca -0.12 -0.27 -0.10 0.00 -1.41 0.00 0.00 60.65 58.75 1s7u s ILE 124 Cb 0.02 -0.66 0.02 0.00 0.13 0.00 0.00 42.46 41.97 1s7u s ILE 124 CO 0.17 -0.15 0.26 0.00 -1.91 0.00 0.00 174.94 173.31 1s7u s ALA 125 N -0.85 -0.65 -0.05 1.50 0.00 -0.29 -0.66 121.76 120.76 1s7u s ALA 125 Ca -0.09 0.58 -0.30 0.00 0.00 0.00 0.00 51.96 52.15 1s7u s ALA 125 Cb -0.04 -0.29 -0.03 0.00 0.00 0.00 0.00 23.12 22.76 1s7u s ALA 125 CO 0.04 -0.16 1.11 -1.17 0.00 0.00 0.00 175.76 175.58 1s7u s LEU 126 N -0.29 4.29 0.84 0.00 2.96 0.66 -0.87 118.68 126.28 1s7u s LEU 126 Ca -0.04 1.73 -0.11 0.00 -0.22 0.00 0.00 54.13 55.49 1s7u s LEU 126 Cb -0.03 -3.56 0.10 0.00 0.50 0.00 0.00 46.19 43.19 1s7u s LEU 126 CO 0.01 -0.49 1.09 0.20 -1.32 0.00 0.00 176.35 175.85 1s7u s ASN 127 N 1.25 4.00 0.54 3.68 0.01 0.18 -4.53 114.94 120.06 1s7u s ASN 127 Ca 0.53 1.52 0.24 0.00 -0.71 0.00 0.00 52.86 54.45 1s7u s ASN 127 Cb -0.23 -2.23 1.43 0.00 0.41 0.00 0.00 41.25 40.63 1s7u s ASN 127 CO 0.22 -2.31 2.05 -0.08 -1.51 0.00 0.00 177.10 175.47 1s7u h GLU 128 N -1.32 0.00 0.00 -0.60 4.81 -1.88 0.33 114.58 115.91 1s7u h GLU 128 Ca -0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1s7u h GLU 128 Cb 1.27 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.65 1s7u h GLU 128 CO 0.55 0.00 0.00 -0.40 -0.73 0.00 0.00 179.01 178.43 1s7u n ASP 129 N -4.27 0.26 -2.46 1.04 5.68 -1.26 -4.74 116.55 110.79 1s7u n ASP 129 Ca 0.05 0.58 -0.21 0.00 -0.50 0.00 0.00 54.79 54.71 1s7u n ASP 129 Cb 0.44 -0.63 -0.01 0.00 -1.14 0.00 0.00 41.12 39.78 1s7u n ASP 129 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1s7u n LEU 130 N -1.80 -2.02 0.00 -2.12 4.77 0.11 -4.80 117.00 111.14 1s7u n LEU 130 Ca 0.02 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1s7u n LEU 130 Cb 0.13 -2.95 0.00 0.00 -2.33 0.00 0.00 43.42 38.27 1s7u n LEU 130 CO 0.12 -0.17 -0.11 0.29 -1.33 0.00 0.00 177.39 176.18 1s7u n LYS 131 N -3.12 0.84 -4.44 3.23 5.02 -1.26 -4.65 118.16 113.79 1s7u n LYS 131 Ca -0.23 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 55.84 1s7u n LYS 131 Cb 0.68 -0.61 -0.10 0.00 -0.02 0.00 0.00 35.03 34.98 1s7u n LYS 131 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1s7u s THR 132 N -1.22 1.87 0.01 -0.18 -4.23 -1.26 -4.87 115.64 105.76 1s7u s THR 132 Ca 0.00 -2.19 0.07 0.00 -1.18 0.00 0.00 61.69 58.39 1s7u s THR 132 Cb 0.00 -2.38 -0.03 0.00 1.34 0.00 0.00 72.50 71.43 1s7u s THR 132 CO 0.00 -0.35 -0.22 0.26 -0.54 0.00 0.00 174.62 173.77 1s7u s TRP 133 N -2.87 2.46 -0.18 3.99 0.52 -1.26 -0.65 118.94 120.94 1s7u s TRP 133 Ca 0.29 -0.33 -0.05 0.00 0.02 0.00 0.00 56.10 56.03 1s7u s TRP 133 Cb 0.02 -1.48 -0.03 0.00 -1.15 0.00 0.00 33.47 30.83 1s7u s TRP 133 CO 0.12 0.14 0.01 0.99 0.02 0.00 0.00 176.95 178.23 1s7u s THR 134 N -0.79 4.18 -0.16 2.01 2.01 -0.05 -4.91 115.64 117.93 1s7u s THR 134 Ca 0.12 -0.25 -0.05 0.00 0.31 0.00 0.00 61.69 61.83 1s7u s THR 134 Cb -0.10 -2.87 0.08 0.00 0.01 0.00 0.00 72.50 69.62 1s7u s THR 134 CO 0.02 0.46 0.30 0.00 -0.69 0.00 0.00 174.62 174.71 1s7u s ALA 135 N 0.59 -0.69 -0.08 7.40 0.00 -1.26 -1.13 121.76 126.58 1s7u s ALA 135 Ca -0.00 0.96 -0.15 0.00 0.00 0.00 0.00 51.96 52.77 1s7u s ALA 135 Cb -0.14 -1.19 -0.28 0.00 0.00 0.00 0.00 23.12 21.51 1s7u s ALA 135 CO 0.02 -0.80 0.60 0.00 0.00 0.00 0.00 175.76 175.58 1s7u h ALA 136 N 8.26 0.16 -2.76 0.00 0.00 -1.88 -3.46 119.26 119.57 1s7u h ALA 136 Ca -0.15 -1.08 -0.51 0.00 0.00 0.00 0.00 54.91 53.16 1s7u h ALA 136 Cb 1.12 0.46 0.07 0.00 0.00 0.00 0.00 17.79 19.44 1s7u h ALA 136 CO 0.16 0.86 0.52 -0.51 0.00 0.00 0.00 179.25 180.29 1s7u s ASP 137 N -7.11 6.20 0.21 0.00 1.11 -1.26 -4.93 116.67 110.89 1s7u s ASP 137 Ca -0.18 2.42 -0.11 0.00 0.18 0.00 0.00 52.55 54.86 1s7u s ASP 137 Cb 0.04 -2.61 0.15 0.00 1.07 0.00 0.00 42.92 41.57 1s7u s ASP 137 CO 0.79 -0.90 1.87 0.24 1.18 0.00 0.00 175.17 178.35 1s7u h MET 138 N 2.25 0.95 -0.18 8.23 2.86 -2.00 -2.02 114.93 125.02 1s7u h MET 138 Ca -0.49 -0.06 -0.04 0.00 -2.06 0.00 0.00 59.70 57.05 1s7u h MET 138 Cb 1.25 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.68 1s7u h MET 138 CO 0.61 0.63 -0.08 0.00 1.06 0.00 0.00 176.91 179.12 1s7u h ALA 139 N 1.27 1.53 0.00 6.32 0.00 -1.91 -2.01 119.26 124.45 1s7u h ALA 139 Ca 0.27 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1s7u h ALA 139 Cb -0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1s7u h ALA 139 CO -0.07 0.34 0.00 0.00 0.00 0.00 0.00 179.25 179.52 1s7u h ALA 140 N 1.65 1.00 -0.46 0.00 0.00 -1.70 -3.06 119.26 116.69 1s7u h ALA 140 Ca 0.06 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.01 1s7u h ALA 140 Cb 0.32 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1s7u h ALA 140 CO 0.02 0.00 0.31 1.96 0.00 0.00 0.00 179.25 181.53 1s7u h GLN 141 N 0.00 0.44 -0.69 0.00 1.08 -1.07 -0.88 115.11 113.98 1s7u h GLN 141 Ca 0.00 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.18 1s7u h GLN 141 Cb 0.52 -0.10 -0.03 0.00 -0.05 0.00 0.00 27.48 27.82 1s7u h GLN 141 CO 0.00 0.29 0.45 0.82 -0.95 0.00 0.00 178.83 179.44 1s7u h ILE 142 N 0.45 1.18 -0.35 2.54 2.04 -1.69 -0.02 117.51 121.67 1s7u h ILE 142 Ca 0.19 -0.35 -0.14 0.00 1.00 0.00 0.00 64.86 65.57 1s7u h ILE 142 Cb 0.20 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 1s7u h ILE 142 CO -0.05 0.18 -0.31 0.74 0.00 0.00 0.00 178.15 178.71 1s7u h THR 143 N 0.94 1.29 -0.21 -0.27 2.02 -1.48 -2.61 112.91 112.59 1s7u h THR 143 Ca 0.25 -1.48 0.02 0.00 0.77 0.00 0.00 66.41 65.97 1s7u h THR 143 Cb -0.09 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.75 1s7u h THR 143 CO -0.05 0.49 0.09 -0.09 0.37 0.00 0.00 175.52 176.32 1s7u h ARG 144 N 0.61 0.19 -0.50 6.66 2.43 -0.70 0.02 114.38 123.09 1s7u h ARG 144 Ca 0.06 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 1s7u h ARG 144 Cb 0.89 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.37 1s7u h ARG 144 CO 0.08 0.13 0.09 0.00 -1.51 0.00 0.00 179.97 178.76 1s7u h ARG 145 N 0.20 0.78 -0.47 0.20 3.08 -1.04 -0.03 114.38 117.09 1s7u h ARG 145 Ca 0.09 -0.17 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 1s7u h ARG 145 Cb 0.04 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 1s7u h ARG 145 CO -0.08 0.73 -0.01 -0.22 -1.07 0.00 0.00 179.97 179.32 1s7u h LYS 146 N 0.74 0.83 0.09 0.04 3.64 -1.05 -2.16 116.57 118.70 1s7u h LYS 146 Ca 0.16 -0.27 -0.26 0.00 -1.27 0.00 0.00 60.65 59.01 1s7u h LYS 146 Cb 0.32 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 32.08 1s7u h LYS 146 CO 0.00 0.88 -1.14 -1.49 -2.27 0.00 0.00 179.45 175.44 1s7u h TRP 147 N 0.68 0.56 -0.54 1.91 4.06 -0.70 -2.71 115.95 119.20 1s7u h TRP 147 Ca 0.13 -0.37 -0.02 0.00 2.06 0.00 0.00 58.89 60.69 1s7u h TRP 147 Cb 0.52 -0.04 -0.03 0.00 -1.00 0.00 0.00 29.16 28.61 1s7u h TRP 147 CO 0.04 1.24 0.24 0.93 -3.56 0.00 0.00 178.44 177.33 1s7u h GLU 148 N 0.14 0.77 0.00 0.49 5.08 -1.02 -2.46 114.58 117.58 1s7u h GLU 148 Ca -0.12 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.10 1s7u h GLU 148 Cb 1.83 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.93 1s7u h GLU 148 CO 0.19 0.61 -0.18 1.96 -1.00 0.00 0.00 179.01 180.60 1s7u h GLN 149 N 0.77 0.00 -0.01 2.33 7.50 -1.26 -3.28 115.11 121.16 1s7u h GLN 149 Ca 0.19 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.34 1s7u h GLN 149 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.64 1s7u h GLN 149 CO -0.02 0.18 -0.59 -1.13 -1.50 0.00 0.00 178.83 175.77 1s7u n SER 150 N -3.15 1.80 -2.13 1.46 3.41 -1.04 -4.99 113.62 108.98 1s7u n SER 150 Ca 0.03 -1.40 -0.14 0.00 -0.26 0.00 0.00 58.87 57.10 1s7u n SER 150 Cb 0.59 0.59 0.03 0.00 -0.26 0.00 0.00 64.21 65.16 1s7u n SER 150 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1s7u n GLY 151 N 1.43 -0.02 0.34 5.00 0.00 -1.06 -4.94 105.19 105.95 1s7u n GLY 151 Ca 0.08 -0.17 0.01 0.00 0.00 0.00 0.00 46.02 45.93 1s7u n GLY 151 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1s7u h ALA 152 N 0.62 1.23 -0.85 4.61 0.00 -1.76 -2.85 119.26 120.26 1s7u h ALA 152 Ca -0.34 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.64 1s7u h ALA 152 Cb 1.23 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 18.68 1s7u h ALA 152 CO 0.35 0.36 0.55 0.00 0.00 0.00 0.00 179.25 180.51 1s7u h ALA 153 N 1.41 1.65 -0.64 0.00 0.00 -1.90 -1.41 119.26 118.37 1s7u h ALA 153 Ca 0.38 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.24 1s7u h ALA 153 Cb 0.12 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1s7u h ALA 153 CO -0.16 0.19 0.23 0.93 0.00 0.00 0.00 179.25 180.44 1s7u h GLU 154 N 0.86 0.98 -0.26 0.00 5.08 -1.77 -1.55 114.58 117.93 1s7u h GLU 154 Ca 0.38 -0.20 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1s7u h GLU 154 Cb 0.36 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1s7u h GLU 154 CO -0.15 0.85 0.14 1.25 -1.00 0.00 0.00 179.01 180.10 1s7u h HIS 155 N 0.92 0.35 -0.21 4.33 2.76 -1.29 -2.15 115.15 119.85 1s7u h HIS 155 Ca 0.21 -0.01 -0.15 0.00 -2.20 0.00 0.00 60.37 58.23 1s7u h HIS 155 Cb 0.25 -0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.09 1s7u h HIS 155 CO 0.02 0.30 -0.47 1.88 -1.30 0.00 0.00 177.93 178.35 1s7u h TYR 156 N 0.30 0.69 -0.76 5.26 0.05 -1.28 -2.95 116.97 118.28 1s7u h TYR 156 Ca 0.09 -0.22 0.00 0.00 0.05 0.00 0.00 58.73 58.65 1s7u h TYR 156 Cb 0.06 -0.14 -0.04 0.00 1.01 0.00 0.00 36.73 37.63 1s7u h TYR 156 CO -0.03 0.93 0.49 -0.22 -1.05 0.00 0.00 178.16 178.28 1s7u h LYS 157 N 0.45 1.00 -0.82 4.88 3.64 -1.19 -1.22 116.57 123.31 1s7u h LYS 157 Ca 0.02 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.30 1s7u h LYS 157 Cb 1.00 -0.22 -0.04 0.00 -0.41 0.00 0.00 32.23 32.56 1s7u h LYS 157 CO 0.09 0.67 0.37 0.00 -2.27 0.00 0.00 179.45 178.32 1s7u h ALA 158 N 1.27 1.10 -0.39 5.00 0.00 -1.26 -0.59 119.26 124.39 1s7u h ALA 158 Ca 0.28 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 1s7u h ALA 158 Cb -0.10 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.35 1s7u h ALA 158 CO -0.06 0.66 0.17 -0.92 0.00 0.00 0.00 179.25 179.10 1s7u h TYR 159 N 1.18 0.57 -0.05 0.00 3.20 -1.28 -0.35 116.97 120.24 1s7u h TYR 159 Ca 0.28 -0.04 -0.19 0.00 3.14 0.00 0.00 58.73 61.92 1s7u h TYR 159 Cb 0.15 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.24 1s7u h TYR 159 CO 0.02 0.50 -0.78 -0.07 -1.64 0.00 0.00 178.16 176.19 1s7u h LEU 160 N 0.48 0.41 0.00 2.82 3.38 -0.80 0.49 115.31 122.10 1s7u h LEU 160 Ca 0.13 -0.29 -0.08 0.00 0.09 0.00 0.00 57.88 57.74 1s7u h LEU 160 Cb 0.16 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1s7u h LEU 160 CO -0.01 1.04 -0.77 -0.33 0.09 0.00 0.00 178.44 178.46 1s7u h GLU 161 N 0.22 0.00 0.00 1.13 5.08 -1.17 -3.35 114.58 116.48 1s7u h GLU 161 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1s7u h GLU 161 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1s7u h GLU 161 CO 0.13 0.23 0.00 0.41 -1.00 0.00 0.00 179.01 178.78 1s7u n GLY 162 N 1.24 0.16 0.27 -3.84 0.00 -0.14 -4.63 105.19 98.24 1s7u n GLY 162 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.05 1s7u n GLY 162 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1s7u h GLU 163 N 0.00 0.10 -0.54 1.61 5.08 -1.62 -0.54 114.58 118.68 1s7u h GLU 163 Ca 0.00 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1s7u h GLU 163 Cb 0.00 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1s7u h GLU 163 CO 0.00 0.07 0.34 0.00 -1.00 0.00 0.00 179.01 178.42 1s7u h VAL 165 N 0.68 1.33 -0.48 0.00 2.07 -1.59 -2.55 116.25 115.70 1s7u h VAL 165 Ca 0.21 -1.22 -0.03 0.00 0.82 0.00 0.00 66.70 66.47 1s7u h VAL 165 Cb -0.02 1.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 1s7u h VAL 165 CO -0.07 0.36 0.17 -0.33 0.02 0.00 0.00 177.57 177.72 1s7u h GLU 166 N 0.02 0.73 0.00 1.57 3.07 -0.50 -1.68 114.58 117.79 1s7u h GLU 166 Ca 0.03 -0.14 -0.15 0.00 -0.50 0.00 0.00 59.36 58.60 1s7u h GLU 166 Cb 0.62 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.40 1s7u h GLU 166 CO 0.03 0.67 -0.73 -1.49 -1.40 0.00 0.00 179.01 176.09 1s7u h TRP 167 N 0.63 0.00 -0.55 4.33 4.06 -0.88 -2.92 115.95 120.63 1s7u h TRP 167 Ca 0.16 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 61.06 1s7u h TRP 167 Cb 0.23 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.36 1s7u h TRP 167 CO 0.01 0.67 0.16 1.25 -3.56 0.00 0.00 178.44 176.97 1s7u h LEU 168 N 0.00 0.80 -0.50 -4.49 5.85 -1.23 -1.41 115.31 114.33 1s7u h LEU 168 Ca -0.02 -0.21 0.06 0.00 0.84 0.00 0.00 57.88 58.54 1s7u h LEU 168 Cb 1.53 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 42.30 1s7u h LEU 168 CO 0.08 0.80 0.22 0.45 -0.34 0.00 0.00 178.44 179.66 1s7u h HIS 169 N 0.76 0.39 -0.55 1.25 3.86 -1.24 -0.99 115.15 118.63 1s7u h HIS 169 Ca 0.17 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.37 1s7u h HIS 169 Cb 0.29 -0.10 -0.03 0.00 1.06 0.00 0.00 27.41 28.64 1s7u h HIS 169 CO 0.02 0.16 0.17 -0.09 0.86 0.00 0.00 177.93 179.05 1s7u h ARG 170 N 0.43 0.82 -0.10 2.45 2.43 -1.32 -2.64 114.38 116.45 1s7u h ARG 170 Ca 0.23 -0.15 -0.14 0.00 -0.81 0.00 0.00 59.98 59.12 1s7u h ARG 170 Cb 0.20 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1s7u h ARG 170 CO -0.20 0.71 -0.56 1.88 -1.51 0.00 0.00 179.97 180.29 1s7u h TYR 171 N 0.80 0.37 0.00 2.20 0.05 -0.67 -2.70 116.97 117.02 1s7u h TYR 171 Ca 0.18 -0.13 -0.13 0.00 0.05 0.00 0.00 58.73 58.70 1s7u h TYR 171 Cb 0.23 -0.07 -0.02 0.00 1.01 0.00 0.00 36.73 37.88 1s7u h TYR 171 CO 0.01 0.79 -0.61 -0.07 -1.05 0.00 0.00 178.16 177.23 1s7u h LEU 172 N 0.23 0.00 -0.10 3.88 3.38 -0.86 -2.01 115.31 119.83 1s7u h LEU 172 Ca 0.00 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.80 1s7u h LEU 172 Cb 1.05 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.81 1s7u h LEU 172 CO 0.09 0.61 -0.60 0.11 0.09 0.00 0.00 178.44 178.74 1s7u h LYS 173 N 0.00 0.59 0.00 1.13 1.57 -1.48 -3.12 116.57 115.26 1s7u h LYS 173 Ca -0.01 -0.50 -0.06 0.00 -1.87 0.00 0.00 60.65 58.22 1s7u h LYS 173 Cb 1.13 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.54 1s7u h LYS 173 CO 0.08 1.12 -0.30 -0.91 -0.57 0.00 0.00 179.45 178.87 1s7u h ASN 174 N 0.22 0.00 -0.39 0.86 2.35 -1.37 -3.19 115.58 114.06 1s7u h ASN 174 Ca -0.05 0.00 -0.28 0.00 -0.55 0.00 0.00 56.30 55.43 1s7u h ASN 174 Cb 1.25 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 39.42 1s7u h ASN 174 CO 0.12 0.30 -0.52 0.61 -1.65 0.00 0.00 177.43 176.29 1s7u n GLY 175 N -0.19 5.66 0.27 2.83 0.00 -0.77 -4.85 105.19 108.14 1s7u n GLY 175 Ca -0.01 -1.89 0.18 0.00 0.00 0.00 0.00 46.02 44.29 1s7u n GLY 175 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1s7u h ASN 176 N 1.52 0.00 0.27 1.61 -0.73 -1.53 -2.70 115.58 114.02 1s7u h ASN 176 Ca 0.21 0.00 -0.33 0.00 1.87 0.00 0.00 56.30 58.05 1s7u h ASN 176 Cb 1.30 0.00 -0.05 0.00 0.27 0.00 0.00 38.32 39.84 1s7u h ASN 176 CO 0.43 0.00 -1.99 0.00 -0.37 0.00 0.00 177.43 175.50 1s7u n ALA 177 N -2.04 1.41 -0.03 1.57 0.00 -1.26 -4.20 120.51 115.95 1s7u n ALA 177 Ca 0.00 -0.92 -0.14 0.00 0.00 0.00 0.00 53.44 52.38 1s7u n ALA 177 Cb 0.24 -0.60 -0.10 0.00 0.00 0.00 0.00 19.45 18.99 1s7u n ALA 177 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1s7u h THR 178 N 0.01 1.50 -0.10 0.00 2.02 -1.87 -3.38 112.91 111.09 1s7u h THR 178 Ca -0.40 -1.64 -0.01 0.00 0.77 0.00 0.00 66.41 65.14 1s7u h THR 178 Cb 2.07 2.52 -0.01 0.00 -1.74 0.00 0.00 68.15 71.00 1s7u h THR 178 CO 0.06 0.44 -0.03 0.00 0.37 0.00 0.00 175.52 176.36 1s7u n LEU 179 N -4.64 2.95 0.08 2.58 -0.00 -1.19 -4.40 117.00 112.38 1s7u n LEU 179 Ca -0.09 -3.15 -0.20 0.00 -0.00 0.00 0.00 56.01 52.58 1s7u n LEU 179 Cb 0.39 -0.48 -0.15 0.00 -0.00 0.00 0.00 43.42 43.18 1s7u n LEU 179 CO 0.37 0.76 -0.37 0.25 -0.00 0.00 0.00 177.39 178.40 1s7u h LEU 180 N 0.68 0.53-10.32 1.47 5.85 -1.74 -3.48 115.31 108.29 1s7u h LEU 180 Ca 0.01 -0.71 -0.51 0.00 0.84 0.00 0.00 57.88 57.52 1s7u h LEU 180 Cb 1.18 -0.17 0.07 0.00 0.37 0.00 0.00 40.66 42.11 1s7u h LEU 180 CO 0.09 1.58 0.39 0.00 -0.34 0.00 0.00 178.44 180.17 1s7u s ARG 181 N -2.61 3.31 0.14 1.25 1.70 -1.26 -5.10 118.95 116.38 1s7u s ARG 181 Ca -0.11 0.90 0.06 0.00 -0.47 0.00 0.00 55.73 56.11 1s7u s ARG 181 Cb 0.06 -2.04 -0.04 0.00 -0.57 0.00 0.00 34.95 32.36 1s7u s ARG 181 CO 0.87 -0.80 -0.14 0.95 -1.08 0.00 0.00 175.30 175.10 1s7u s THR 182 N -3.01 1.39 -0.21 4.99 -4.23 -1.26 -4.88 115.64 108.43 1s7u s THR 182 Ca 0.57 -1.85 -0.04 0.00 -1.18 0.00 0.00 61.69 59.19 1s7u s THR 182 Cb -0.13 -1.67 -0.02 0.00 1.34 0.00 0.00 72.50 72.02 1s7u s THR 182 CO 0.51 -0.49 -0.03 -1.81 -0.54 0.00 0.00 174.62 172.27 1s7u s ASP 183 N -2.70 4.50 0.48 3.99 1.01 -0.29 -4.94 116.67 118.73 1s7u s ASP 183 Ca 0.12 -0.32 -0.22 0.00 0.71 0.00 0.00 52.55 52.85 1s7u s ASP 183 Cb -0.03 -1.77 -0.07 0.00 1.01 0.00 0.00 42.92 42.06 1s7u s ASP 183 CO 0.03 0.01 1.13 -0.44 0.21 0.00 0.00 175.17 176.12 1s7u s SER 184 N 1.28 6.10 0.25 0.27 0.01 -1.26 -1.38 113.70 118.97 1s7u s SER 184 Ca 0.04 2.19 -0.30 0.00 1.31 0.00 0.00 55.95 59.19 1s7u s SER 184 Cb -0.14 -2.59 -0.09 0.00 0.21 0.00 0.00 66.02 63.41 1s7u s SER 184 CO -0.01 -0.96 1.17 -2.16 0.41 0.00 0.00 173.24 171.69 1s7u s PRO 185 N -2.93 4.54 -0.23 12.44 0.04 -1.26 -4.37 135.00 143.23 1s7u s PRO 185 Ca 0.67 1.90 -0.09 0.00 0.04 0.00 0.00 61.00 63.51 1s7u s PRO 185 Cb -0.25 -3.19 -0.04 0.00 0.04 0.00 0.00 34.50 31.06 1s7u s PRO 185 CO 0.30 0.04 0.11 0.15 0.04 0.00 0.00 177.00 177.63 1s7u s LYS 186 N -1.05 3.93 0.13 4.56 1.02 -0.70 -4.88 119.74 122.74 1s7u s LYS 186 Ca 0.48 -0.35 0.11 0.00 0.02 0.00 0.00 55.97 56.23 1s7u s LYS 186 Cb -0.33 -3.40 -0.04 0.00 -0.52 0.00 0.00 37.83 33.54 1s7u s LYS 186 CO 0.41 0.04 -0.26 0.00 -0.92 0.00 0.00 175.35 174.62 1s7u s ALA 187 N 1.06 2.40 0.13 5.17 0.00 -1.26 -1.60 121.76 127.66 1s7u s ALA 187 Ca 0.06 -1.45 -0.16 0.00 0.00 0.00 0.00 51.96 50.40 1s7u s ALA 187 Cb -0.14 -0.40 0.03 0.00 0.00 0.00 0.00 23.12 22.61 1s7u s ALA 187 CO 0.04 0.54 0.40 -3.38 0.00 0.00 0.00 175.76 173.36 1s7u s HIS 188 N -1.05 -0.18 -0.13 0.00 -3.43 -1.01 -5.00 115.29 104.50 1s7u s HIS 188 Ca 0.14 -0.14 -0.01 0.00 -0.80 0.00 0.00 55.06 54.24 1s7u s HIS 188 Cb -0.10 0.25 -0.02 0.00 -1.43 0.00 0.00 32.58 31.28 1s7u s HIS 188 CO 0.06 -0.71 -0.08 0.08 -2.00 0.00 0.00 174.74 172.09 1s7u s VAL 189 N -3.81 3.54 0.11 -5.38 1.01 -1.26 -0.67 120.40 113.94 1s7u s VAL 189 Ca 0.04 -0.50 0.04 0.00 0.00 0.00 0.00 61.98 61.56 1s7u s VAL 189 Cb 0.02 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 1s7u s VAL 189 CO -0.11 0.53 0.07 0.42 0.00 0.00 0.00 175.10 176.00 1s7u s THR 190 N 0.11 4.36 -0.06 3.92 -4.23 -0.60 -4.72 115.64 114.42 1s7u s THR 190 Ca -0.03 -0.93 -0.00 0.00 -1.18 0.00 0.00 61.69 59.55 1s7u s THR 190 Cb -0.14 -3.13 -0.03 0.00 1.34 0.00 0.00 72.50 70.54 1s7u s THR 190 CO 0.04 0.05 -0.03 -2.28 -0.54 0.00 0.00 174.62 171.86 1s7u s HIS 191 N -1.48 3.05 -0.29 3.99 2.46 -1.26 -1.90 115.29 119.87 1s7u s HIS 191 Ca 0.29 0.10 -0.01 0.00 0.47 0.00 0.00 55.06 55.91 1s7u s HIS 191 Cb -0.11 -1.73 0.13 0.00 -0.13 0.00 0.00 32.58 30.73 1s7u s HIS 191 CO 0.21 0.42 0.26 -1.01 -2.47 0.00 0.00 174.74 172.15 1s7u s HIS 192 N -0.90 -0.30 0.54 3.88 3.76 -0.89 -5.03 115.29 116.36 1s7u s HIS 192 Ca 0.14 -0.31 -0.21 0.00 -0.15 0.00 0.00 55.06 54.53 1s7u s HIS 192 Cb -0.11 -0.55 -0.06 0.00 1.11 0.00 0.00 32.58 32.97 1s7u s HIS 192 CO 0.04 -0.90 1.21 -2.30 -0.85 0.00 0.00 174.74 171.94 1s7u n PRO 193 N 5.30 1.43 -3.74 8.40 -0.02 -1.26 -1.52 135.00 143.59 1s7u n PRO 193 Ca -0.03 0.53 -0.10 0.00 -2.02 0.00 0.00 63.50 61.88 1s7u n PRO 193 Cb 0.45 -2.40 0.01 0.00 -0.02 0.00 0.00 33.50 31.55 1s7u n PRO 193 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1s7u n ARG 194 N -0.87 0.96 0.00 -0.52 1.85 -0.88 -4.85 116.66 112.36 1s7u n ARG 194 Ca 0.11 -2.34 0.00 0.00 -1.00 0.00 0.00 57.85 54.63 1s7u n ARG 194 Cb 0.44 2.65 0.00 0.00 -1.05 0.00 0.00 32.46 34.51 1s7u n ARG 194 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 1s7u n SER 195 N -1.55 0.00 0.00 2.89 3.41 -1.26 -3.91 113.62 113.20 1s7u n SER 195 Ca -0.05 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.56 1s7u n SER 195 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 1s7u n SER 195 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1s7u n LYS 196 N 0.00 0.00 -1.29 4.33 5.02 -1.26 -2.95 118.16 122.01 1s7u n LYS 196 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 1s7u n LYS 196 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.97 1s7u n LYS 196 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1s7u n GLY 197 N 0.21 1.13 3.08 0.72 0.00 -1.26 -5.00 105.19 104.07 1s7u n GLY 197 Ca 0.00 -0.51 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 1s7u n GLY 197 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s7u s GLU 198 N -2.76 0.45 0.06 1.61 2.02 -1.15 -3.02 118.70 115.90 1s7u s GLU 198 Ca 0.00 -0.42 -0.06 0.00 0.02 0.00 0.00 54.97 54.52 1s7u s GLU 198 Cb 0.00 0.18 -0.01 0.00 0.10 0.00 0.00 34.13 34.40 1s7u s GLU 198 CO 0.00 -0.10 0.10 0.14 0.02 0.00 0.00 175.26 175.42 1s7u s VAL 199 N -1.36 0.16 -0.17 2.63 -7.23 0.13 -2.07 120.40 112.49 1s7u s VAL 199 Ca -0.15 -1.31 -0.07 0.00 -1.81 0.00 0.00 61.98 58.65 1s7u s VAL 199 Cb -0.08 -1.22 -0.04 0.00 0.56 0.00 0.00 36.38 35.60 1s7u s VAL 199 CO 0.01 -0.72 0.05 -0.89 -0.31 0.00 0.00 175.10 173.24 1s7u s THR 200 N -3.40 4.69 -0.30 5.32 2.01 -0.58 -0.59 115.64 122.79 1s7u s THR 200 Ca 0.02 -0.07 -0.09 0.00 0.31 0.00 0.00 61.69 61.85 1s7u s THR 200 Cb 0.03 -3.10 -0.01 0.00 0.01 0.00 0.00 72.50 69.43 1s7u s THR 200 CO -0.08 0.48 0.14 -0.76 -0.69 0.00 0.00 174.62 173.71 1s7u s LEU 201 N 0.23 3.97 -0.30 4.42 1.43 -1.01 -2.09 118.68 125.34 1s7u s LEU 201 Ca 0.03 -0.42 -0.08 0.00 -1.03 0.00 0.00 54.13 52.63 1s7u s LEU 201 Cb -0.12 -2.00 0.00 0.00 0.03 0.00 0.00 46.19 44.10 1s7u s LEU 201 CO 0.01 -0.15 0.11 -0.60 0.23 0.00 0.00 176.35 175.94 1s7u s ARG 202 N 1.62 3.17 -0.31 1.70 3.52 -0.80 -2.39 118.95 125.46 1s7u s ARG 202 Ca 0.05 -0.82 -0.18 0.00 -0.13 0.00 0.00 55.73 54.66 1s7u s ARG 202 Cb -0.17 -3.44 -0.02 0.00 -1.56 0.00 0.00 34.95 29.77 1s7u s ARG 202 CO 0.06 -0.44 0.49 0.00 -0.81 0.00 0.00 175.30 174.60 1s7u s TRP 204 N 2.32 3.48 -0.03 0.00 0.52 0.15 -1.88 118.94 123.51 1s7u s TRP 204 Ca 0.19 0.25 0.01 0.00 0.02 0.00 0.00 56.10 56.57 1s7u s TRP 204 Cb -0.16 -1.76 0.01 0.00 -1.15 0.00 0.00 33.47 30.42 1s7u s TRP 204 CO 0.12 0.59 -0.04 0.00 0.02 0.00 0.00 176.95 177.64 1s7u s ALA 205 N -1.44 0.53 0.03 0.98 0.00 0.02 -2.39 121.76 119.49 1s7u s ALA 205 Ca 0.32 -0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.21 1s7u s ALA 205 Cb -0.13 -0.29 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 1s7u s ALA 205 CO 0.25 0.03 -0.04 -0.51 0.00 0.00 0.00 175.76 175.48 1s7u s LEU 206 N 0.55 2.24 -0.53 0.00 1.43 -0.63 -1.97 118.68 119.77 1s7u s LEU 206 Ca -0.07 -0.51 0.00 0.00 -1.03 0.00 0.00 54.13 52.52 1s7u s LEU 206 Cb -0.10 0.03 0.00 0.00 0.03 0.00 0.00 46.19 46.15 1s7u s LEU 206 CO -0.00 -0.27 0.00 0.61 0.23 0.00 0.00 176.35 176.91 1s7u n GLY 207 N 1.57 0.60 3.94 -3.19 0.00 -0.96 -1.73 105.19 105.43 1s7u n GLY 207 Ca -0.24 -0.78 -0.28 0.00 0.00 0.00 0.00 46.02 44.73 1s7u n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1s7u s PHE 208 N -2.22 3.49 -0.19 1.61 -0.12 -1.16 -4.60 117.98 114.80 1s7u s PHE 208 Ca 0.00 0.18 -0.15 0.00 -0.05 0.00 0.00 56.93 56.91 1s7u s PHE 208 Cb 0.00 -1.71 0.06 0.00 -0.63 0.00 0.00 43.02 40.74 1s7u s PHE 208 CO 0.00 0.53 0.50 -0.47 -0.05 0.00 0.00 175.22 175.73 1s7u s TYR 209 N -1.68 -0.64 1.06 3.49 5.04 -0.48 -0.74 117.35 123.40 1s7u s TYR 209 Ca 0.35 1.44 -0.18 0.00 -2.44 0.00 0.00 57.07 56.24 1s7u s TYR 209 Cb -0.12 0.27 0.26 0.00 0.35 0.00 0.00 41.96 42.72 1s7u s TYR 209 CO 0.28 -0.33 1.12 -0.35 -1.34 0.00 0.00 175.55 174.94 1s7u n PRO 210 N 3.47 -2.28 0.22 4.97 -0.04 -1.26 -1.13 135.00 138.95 1s7u n PRO 210 Ca -0.17 -1.76 0.07 0.00 -0.04 0.00 0.00 63.50 61.60 1s7u n PRO 210 Cb 0.56 -1.43 0.52 0.00 -0.04 0.00 0.00 33.50 33.11 1s7u n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1s7u h ALA 211 N -2.33 1.38 -2.30 0.55 0.00 -1.96 -3.44 119.26 111.16 1s7u h ALA 211 Ca -0.39 -0.22 -0.56 0.00 0.00 0.00 0.00 54.91 53.74 1s7u h ALA 211 Cb 1.15 -0.04 0.03 0.00 0.00 0.00 0.00 17.79 18.94 1s7u h ALA 211 CO 0.27 0.30 1.08 -0.25 0.00 0.00 0.00 179.25 180.65 1s7u n ASP 212 N -3.93 3.76 -3.49 0.00 9.92 -1.26 -4.95 116.55 116.60 1s7u n ASP 212 Ca -0.02 0.98 -0.14 0.00 -0.53 0.00 0.00 54.79 55.08 1s7u n ASP 212 Cb 0.32 -1.47 -0.04 0.00 -0.64 0.00 0.00 41.12 39.28 1s7u n ASP 212 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 1s7u s ILE 213 N 3.15 0.00 -0.04 0.53 2.07 -1.26 -4.61 121.20 121.04 1s7u s ILE 213 Ca 0.86 0.00 0.02 0.00 -1.41 0.00 0.00 60.65 60.12 1s7u s ILE 213 Cb -0.56 -1.00 0.01 0.00 0.13 0.00 0.00 42.46 41.04 1s7u s ILE 213 CO 0.42 0.00 -0.10 -0.89 -1.91 0.00 0.00 174.94 172.46 1s7u s THR 214 N -2.24 0.92 -0.16 4.00 2.01 -0.76 -4.99 115.64 114.43 1s7u s THR 214 Ca -0.05 -0.40 0.00 0.00 0.31 0.00 0.00 61.69 61.56 1s7u s THR 214 Cb -0.00 -0.84 0.00 0.00 0.01 0.00 0.00 72.50 71.67 1s7u s THR 214 CO -0.00 0.29 -0.16 -0.76 -0.69 0.00 0.00 174.62 173.30 1s7u s LEU 215 N 0.45 2.44 0.20 4.42 1.02 -1.26 -0.69 118.68 125.26 1s7u s LEU 215 Ca -0.08 -0.49 0.10 0.00 0.02 0.00 0.00 54.13 53.68 1s7u s LEU 215 Cb -0.12 -1.56 -0.04 0.00 0.02 0.00 0.00 46.19 44.49 1s7u s LEU 215 CO 0.02 0.07 -0.21 0.42 0.02 0.00 0.00 176.35 176.66 1s7u s THR 216 N 0.90 2.17 0.07 5.49 -4.23 -0.77 -4.97 115.64 114.31 1s7u s THR 216 Ca -0.04 -2.06 0.08 0.00 -1.18 0.00 0.00 61.69 58.49 1s7u s THR 216 Cb -0.15 -2.05 -0.04 0.00 1.34 0.00 0.00 72.50 71.60 1s7u s THR 216 CO -0.02 -0.24 -0.17 0.26 -0.54 0.00 0.00 174.62 173.91 1s7u s TRP 217 N -1.96 2.57 -0.04 3.99 0.52 -1.26 -1.67 118.94 121.09 1s7u s TRP 217 Ca 0.20 -0.24 0.01 0.00 0.02 0.00 0.00 56.10 56.09 1s7u s TRP 217 Cb -0.07 -1.43 0.02 0.00 -1.15 0.00 0.00 33.47 30.84 1s7u s TRP 217 CO 0.09 0.31 -0.06 -0.65 0.02 0.00 0.00 176.95 176.67 1s7u s GLN 218 N -1.71 0.89 -1.21 4.98 -0.21 -0.52 -2.43 119.66 119.44 1s7u s GLN 218 Ca 0.16 -0.16 -0.10 0.00 0.02 0.00 0.00 55.36 55.28 1s7u s GLN 218 Cb -0.11 -0.86 0.20 0.00 1.00 0.00 0.00 33.01 33.25 1s7u s GLN 218 CO 0.07 -0.04 1.57 -0.11 -2.12 0.00 0.00 175.29 174.67 1s7u n LEU 219 N 3.86 5.95 -2.79 2.90 7.94 -0.95 -2.24 117.00 131.67 1s7u n LEU 219 Ca -0.24 -4.70 -0.15 0.00 -1.11 0.00 0.00 56.01 49.81 1s7u n LEU 219 Cb 0.52 -1.50 -0.00 0.00 0.53 0.00 0.00 43.42 42.96 1s7u n LEU 219 CO 0.24 1.17 -0.10 -3.20 -1.11 0.00 0.00 177.39 174.40 1s7u n ASN 220 N 4.04 -3.50 0.00 1.96 2.85 -1.08 -4.01 115.26 115.51 1s7u n ASN 220 Ca 0.35 0.01 0.00 0.00 -0.11 0.00 0.00 54.58 54.83 1s7u n ASN 220 Cb 0.39 -2.96 0.00 0.00 1.24 0.00 0.00 39.78 38.44 1s7u n ASN 220 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1s7u n GLY 221 N -0.91 -1.39 3.94 8.20 0.00 -1.26 -5.16 105.19 108.62 1s7u n GLY 221 Ca -0.08 0.51 -0.24 0.00 0.00 0.00 0.00 46.02 46.21 1s7u n GLY 221 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1s7u s GLU 222 N 0.00 2.76 0.00 1.61 0.41 -1.26 -5.02 118.70 117.21 1s7u s GLU 222 Ca 0.00 -0.37 0.00 0.00 -0.41 0.00 0.00 54.97 54.19 1s7u s GLU 222 Cb 0.00 -2.39 0.00 0.00 -1.78 0.00 0.00 34.13 29.96 1s7u s GLU 222 CO 0.00 -0.66 0.00 0.39 -0.49 0.00 0.00 175.26 174.50 1s7u n GLU 223 N -2.43 1.00 -3.30 1.61 4.71 -1.26 -2.24 120.64 118.72 1s7u n GLU 223 Ca 0.05 0.00 -0.08 0.00 -0.01 0.00 0.00 57.16 57.12 1s7u n GLU 223 Cb 0.59 0.00 -0.06 0.00 -1.01 0.00 0.00 31.44 30.96 1s7u n GLU 223 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1s7u s LEU 224 N 0.00 -0.81 0.25 -4.62 2.01 -1.02 -4.45 118.68 110.04 1s7u s LEU 224 Ca 0.00 -0.17 0.22 0.00 0.01 0.00 0.00 54.13 54.19 1s7u s LEU 224 Cb 0.00 1.19 0.07 0.00 0.01 0.00 0.00 46.19 47.47 1s7u s LEU 224 CO 0.00 -0.34 1.18 0.74 1.01 0.00 0.00 176.35 178.95 1s7u h THR 225 N 6.15 0.09 -1.01 5.49 2.02 -1.96 -3.38 112.91 120.32 1s7u h THR 225 Ca -0.11 -1.16 -0.26 0.00 0.77 0.00 0.00 66.41 65.65 1s7u h THR 225 Cb 1.13 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 69.27 1s7u h THR 225 CO 0.26 0.05 0.93 1.67 0.37 0.00 0.00 175.52 178.81 1s7u n GLN 226 N -2.83 0.80 -3.63 6.66 0.00 -1.26 -3.26 117.38 113.86 1s7u n GLN 226 Ca 0.00 -0.38 -0.20 0.00 -0.00 0.00 0.00 57.00 56.42 1s7u n GLN 226 Cb 0.58 -3.50 0.01 0.00 0.00 0.00 0.00 30.24 27.33 1s7u n GLN 226 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1s7u n ASP 227 N 17.00 -2.22 -4.60 1.69 9.92 -1.26 -4.86 116.55 132.23 1s7u n ASP 227 Ca 0.42 -0.61 -0.43 0.00 -0.53 0.00 0.00 54.79 53.65 1s7u n ASP 227 Cb 0.48 -0.81 -0.04 0.00 -0.64 0.00 0.00 41.12 40.12 1s7u n ASP 227 CO 0.00 0.00 0.00 -0.32 0.13 0.00 0.00 177.20 177.01 1s7u s MET 228 N -5.21 3.84 0.41 -1.24 -2.45 -1.20 -4.27 119.30 109.18 1s7u s MET 228 Ca 0.16 0.59 -0.15 0.00 -1.25 0.00 0.00 55.69 55.03 1s7u s MET 228 Cb -0.09 -3.80 -0.08 0.00 1.25 0.00 0.00 34.83 32.11 1s7u s MET 228 CO 0.48 -0.95 0.84 -2.00 1.05 0.00 0.00 175.02 174.44 1s7u s GLU 229 N 3.49 3.96 0.31 4.11 2.12 -0.70 -4.89 118.70 127.11 1s7u s GLU 229 Ca 0.38 0.75 -0.16 0.00 0.36 0.00 0.00 54.97 56.31 1s7u s GLU 229 Cb -0.12 -2.31 0.02 0.00 0.26 0.00 0.00 34.13 31.99 1s7u s GLU 229 CO 0.19 -0.03 0.67 -0.48 -0.54 0.00 0.00 175.26 175.07 1s7u s LEU 230 N -3.52 0.05 0.23 2.70 0.05 -1.26 0.42 118.68 117.35 1s7u s LEU 230 Ca 0.56 -0.92 0.11 0.00 0.05 0.00 0.00 54.13 53.93 1s7u s LEU 230 Cb -0.10 2.47 -0.05 0.00 -2.05 0.00 0.00 46.19 46.46 1s7u s LEU 230 CO 0.24 -1.41 -0.20 0.68 -0.55 0.00 0.00 176.35 175.10 1s7u s VAL 231 N -3.35 2.29 0.50 1.48 -7.23 -0.98 -4.99 120.40 108.12 1s7u s VAL 231 Ca 0.16 -2.22 -0.22 0.00 -1.81 0.00 0.00 61.98 57.89 1s7u s VAL 231 Cb -0.04 -2.17 -0.06 0.00 0.56 0.00 0.00 36.38 34.67 1s7u s VAL 231 CO 0.10 -0.33 1.23 -1.61 -0.31 0.00 0.00 175.10 174.18 1s7u s GLU 232 N -3.19 3.47 0.30 4.82 0.41 -1.26 -4.62 118.70 118.62 1s7u s GLU 232 Ca 0.25 1.93 -0.30 0.00 -0.41 0.00 0.00 54.97 56.44 1s7u s GLU 232 Cb -0.05 -2.30 -0.12 0.00 -1.78 0.00 0.00 34.13 29.88 1s7u s GLU 232 CO 0.12 -0.83 1.52 2.41 -0.49 0.00 0.00 175.26 177.99 1s7u n THR 233 N -0.79 1.21 -4.25 3.63 -1.04 -1.26 -4.86 114.28 106.91 1s7u n THR 233 Ca 0.09 -0.30 -0.18 0.00 -2.04 0.00 0.00 64.05 61.62 1s7u n THR 233 Cb 0.47 -1.84 -0.13 0.00 -1.82 0.00 0.00 70.33 67.01 1s7u n THR 233 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1s7u s ARG 234 N -0.79 0.77 0.04 -2.82 1.70 -0.84 -4.98 118.95 112.02 1s7u s ARG 234 Ca 0.63 -0.70 -0.30 0.00 -0.47 0.00 0.00 55.73 54.89 1s7u s ARG 234 Cb -0.53 -0.72 -0.04 0.00 -0.57 0.00 0.00 34.95 33.09 1s7u s ARG 234 CO 0.52 0.17 1.03 -1.25 -1.08 0.00 0.00 175.30 174.69 1s7u s PRO 235 N -1.14 4.55 0.51 3.89 0.04 -1.26 -0.93 135.00 140.65 1s7u s PRO 235 Ca -0.01 1.52 0.28 0.00 0.04 0.00 0.00 61.00 62.83 1s7u s PRO 235 Cb -0.08 -3.41 1.34 0.00 0.04 0.00 0.00 34.50 32.39 1s7u s PRO 235 CO 0.01 -0.06 2.00 0.00 0.04 0.00 0.00 177.00 179.00 1s7u h ALA 236 N 6.56 1.14 0.00 8.56 0.00 -1.70 -3.47 119.26 130.35 1s7u h ALA 236 Ca -0.42 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1s7u h ALA 236 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1s7u h ALA 236 CO 0.76 0.16 0.00 0.41 0.00 0.00 0.00 179.25 180.58 1s7u n GLY 237 N -0.35 0.36 0.95 0.00 0.00 -1.26 -4.94 105.19 99.96 1s7u n GLY 237 Ca -0.01 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.07 1s7u n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1s7u n ASP 238 N 0.00 3.64 0.00 1.61 5.68 -1.26 -4.96 116.55 121.26 1s7u n ASP 238 Ca 0.00 -3.16 0.00 0.00 -0.50 0.00 0.00 54.79 51.13 1s7u n ASP 238 Cb 0.00 -0.57 0.00 0.00 -1.14 0.00 0.00 41.12 39.41 1s7u n ASP 238 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1s7u n GLY 239 N -0.64 2.88 4.01 6.12 0.00 -1.26 -5.05 105.19 111.25 1s7u n GLY 239 Ca 0.24 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 46.04 1s7u n GLY 239 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1s7u s THR 240 N -2.13 2.10 0.25 2.61 -4.23 -1.26 -4.84 115.64 108.14 1s7u s THR 240 Ca 0.00 -0.78 0.02 0.00 -1.18 0.00 0.00 61.69 59.75 1s7u s THR 240 Cb 0.00 -2.32 -0.05 0.00 1.34 0.00 0.00 72.50 71.47 1s7u s THR 240 CO 0.00 0.00 0.06 -0.36 -0.54 0.00 0.00 174.62 173.78 1s7u s PHE 241 N -2.94 1.55 0.04 3.99 0.40 0.08 -1.95 117.98 119.16 1s7u s PHE 241 Ca 0.65 -1.09 0.01 0.00 -0.60 0.00 0.00 56.93 55.90 1s7u s PHE 241 Cb -0.05 -0.92 -0.03 0.00 0.51 0.00 0.00 43.02 42.53 1s7u s PHE 241 CO 0.42 -0.23 -0.05 -0.65 0.70 0.00 0.00 175.22 175.41 1s7u s GLN 242 N -3.97 0.51 -0.09 0.44 -0.21 -0.11 -2.27 119.66 113.97 1s7u s GLN 242 Ca 0.34 -0.86 -0.30 0.00 0.02 0.00 0.00 55.36 54.56 1s7u s GLN 242 Cb 0.07 -0.07 0.08 0.00 1.00 0.00 0.00 33.01 34.09 1s7u s GLN 242 CO 0.12 -0.02 0.72 0.21 -2.12 0.00 0.00 175.29 174.20 1s7u s LYS 243 N -2.22 0.99 0.10 2.91 2.20 -0.83 -1.99 119.74 120.89 1s7u s LYS 243 Ca -0.06 0.33 0.01 0.00 -0.36 0.00 0.00 55.97 55.90 1s7u s LYS 243 Cb -0.05 0.47 -0.04 0.00 -1.51 0.00 0.00 37.83 36.69 1s7u s LYS 243 CO -0.02 -0.29 -0.06 1.67 -0.36 0.00 0.00 175.35 176.29 1s7u s TRP 244 N -1.00 0.86 -0.03 4.03 1.48 -1.26 -0.80 118.94 122.23 1s7u s TRP 244 Ca -0.09 -0.93 -0.03 0.00 -1.06 0.00 0.00 56.10 53.99 1s7u s TRP 244 Cb -0.01 -0.51 0.01 0.00 -1.16 0.00 0.00 33.47 31.80 1s7u s TRP 244 CO 0.08 -0.17 0.08 0.00 -4.06 0.00 0.00 176.95 172.88 1s7u s ALA 245 N -3.65 -0.20 0.25 2.67 0.00 -0.79 -2.31 121.76 117.73 1s7u s ALA 245 Ca 0.12 0.19 0.02 0.00 0.00 0.00 0.00 51.96 52.29 1s7u s ALA 245 Cb 0.06 -0.12 -0.05 0.00 0.00 0.00 0.00 23.12 23.01 1s7u s ALA 245 CO -0.05 -0.05 0.04 -1.54 0.00 0.00 0.00 175.76 174.16 1s7u s SER 246 N -0.06 1.58 -0.20 0.00 1.04 0.17 -0.65 113.70 115.57 1s7u s SER 246 Ca -0.01 -1.30 -0.15 0.00 0.48 0.00 0.00 55.95 54.97 1s7u s SER 246 Cb -0.01 0.07 0.06 0.00 0.10 0.00 0.00 66.02 66.23 1s7u s SER 246 CO 0.00 -0.62 0.52 0.54 0.98 0.00 0.00 173.24 174.66 1s7u s VAL 247 N -3.56 -0.01 0.11 5.02 0.11 -1.01 -1.72 120.40 119.35 1s7u s VAL 247 Ca 0.32 0.03 -0.30 0.00 -2.93 0.00 0.00 61.98 59.10 1s7u s VAL 247 Cb 0.07 -0.74 -0.07 0.00 -1.53 0.00 0.00 36.38 34.12 1s7u s VAL 247 CO 0.11 0.01 1.21 0.68 -3.33 0.00 0.00 175.10 173.78 1s7u s VAL 248 N 0.82 3.82 -0.01 2.04 -7.23 -1.26 -2.39 120.40 116.19 1s7u s VAL 248 Ca -0.04 1.39 -0.02 0.00 -1.81 0.00 0.00 61.98 61.50 1s7u s VAL 248 Cb -0.05 -3.89 -0.00 0.00 0.56 0.00 0.00 36.38 33.00 1s7u s VAL 248 CO -0.06 0.15 0.04 -0.69 -0.31 0.00 0.00 175.10 174.23 1s7u s VAL 249 N 0.62 0.03 0.35 1.32 1.01 0.24 -4.99 120.40 118.99 1s7u s VAL 249 Ca 0.57 -0.27 -0.28 0.00 0.00 0.00 0.00 61.98 62.00 1s7u s VAL 249 Cb -0.31 -0.15 -0.11 0.00 0.00 0.00 0.00 36.38 35.81 1s7u s VAL 249 CO 0.32 -0.15 1.44 -2.84 0.00 0.00 0.00 175.10 173.87 1s7u s PRO 250 N -0.43 4.18 -0.04 2.72 0.02 -1.26 -0.69 135.00 139.49 1s7u s PRO 250 Ca -0.05 2.46 -0.30 0.00 0.02 0.00 0.00 61.00 63.14 1s7u s PRO 250 Cb -0.03 -3.00 -0.04 0.00 0.02 0.00 0.00 34.50 31.44 1s7u s PRO 250 CO -0.00 -0.44 1.28 -1.17 -0.33 0.00 0.00 177.00 176.34 1s7u s LEU 251 N -1.86 4.29 0.00 -5.54 0.20 -1.17 -2.80 118.68 111.80 1s7u s LEU 251 Ca 0.52 1.92 0.00 0.00 0.69 0.00 0.00 54.13 57.27 1s7u s LEU 251 Cb -0.45 -3.56 0.00 0.00 -0.43 0.00 0.00 46.19 41.76 1s7u s LEU 251 CO 0.59 -0.64 0.00 0.61 -0.29 0.00 0.00 176.35 176.61 1s7u n GLY 252 N 3.49 2.67 2.32 7.98 0.00 -1.26 -4.91 105.19 115.48 1s7u n GLY 252 Ca 0.12 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 45.10 1s7u n GLY 252 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1s7u n LYS 253 N 0.00 2.87 0.12 1.61 4.76 -1.12 -4.63 118.16 121.77 1s7u n LYS 253 Ca 0.00 -3.48 0.12 0.00 -2.87 0.00 0.00 58.31 52.07 1s7u n LYS 253 Cb 0.00 -2.29 0.06 0.00 -1.84 0.00 0.00 35.03 30.97 1s7u n LYS 253 CO 0.00 0.00 0.00 1.05 -1.37 0.00 0.00 177.40 177.08 1s7u h GLU 254 N 2.11 0.00 -0.01 1.97 9.09 -1.91 -3.30 114.58 122.53 1s7u h GLU 254 Ca 0.56 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.97 1s7u h GLU 254 Cb 0.88 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.98 1s7u h GLU 254 CO 1.43 0.00 0.00 1.04 0.05 0.00 0.00 179.01 181.53 1s7u n GLN 255 N -2.70 1.34 0.00 1.06 1.13 -1.26 -2.73 117.38 114.23 1s7u n GLN 255 Ca 0.01 -0.50 0.16 0.00 -1.94 0.00 0.00 57.00 54.73 1s7u n GLN 255 Cb 0.53 -1.48 0.88 0.00 0.11 0.00 0.00 30.24 30.28 1s7u n GLN 255 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 1s7u n ASN 256 N -0.39 0.19 -4.43 1.08 5.03 -1.24 -4.85 115.26 110.64 1s7u n ASN 256 Ca 0.21 -1.02 -0.33 0.00 0.87 0.00 0.00 54.58 54.31 1s7u n ASN 256 Cb 0.23 -0.01 -0.13 0.00 -1.02 0.00 0.00 39.78 38.85 1s7u n ASN 256 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 1s7u s TYR 257 N -2.03 2.82 -0.04 3.10 2.02 -1.10 -2.64 117.35 119.48 1s7u s TYR 257 Ca 0.46 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.77 1s7u s TYR 257 Cb 0.22 -1.78 0.01 0.00 -0.40 0.00 0.00 41.96 40.00 1s7u s TYR 257 CO 0.37 -0.03 -0.09 0.95 -1.57 0.00 0.00 175.55 175.18 1s7u s THR 258 N -0.07 0.84 -0.13 -0.71 -4.23 -0.95 -4.67 115.64 105.71 1s7u s THR 258 Ca -0.02 -0.35 -0.06 0.00 -1.18 0.00 0.00 61.69 60.08 1s7u s THR 258 Cb -0.14 -0.77 -0.04 0.00 1.34 0.00 0.00 72.50 72.90 1s7u s THR 258 CO 0.04 0.27 0.09 0.00 -0.54 0.00 0.00 174.62 174.48 1s7u s ARG 260 N -0.54 2.29 -0.16 0.00 0.52 -0.67 -0.98 118.95 119.42 1s7u s ARG 260 Ca 0.11 -0.86 0.02 0.00 -0.52 0.00 0.00 55.73 54.48 1s7u s ARG 260 Cb -0.12 -2.16 0.01 0.00 0.52 0.00 0.00 34.95 33.20 1s7u s ARG 260 CO 0.02 0.55 -0.20 0.08 0.02 0.00 0.00 175.30 175.77 1s7u s VAL 261 N -0.58 2.18 -0.21 3.52 1.01 -0.70 -1.84 120.40 123.79 1s7u s VAL 261 Ca 0.08 -0.92 -0.03 0.00 0.00 0.00 0.00 61.98 61.11 1s7u s VAL 261 Cb -0.11 -1.90 -0.00 0.00 0.00 0.00 0.00 36.38 34.37 1s7u s VAL 261 CO 0.00 0.54 -0.07 -0.31 0.00 0.00 0.00 175.10 175.25 1s7u s TYR 262 N 0.99 2.92 -0.09 5.22 1.51 0.14 -1.75 117.35 126.29 1s7u s TYR 262 Ca -0.03 -1.07 -0.15 0.00 -1.01 0.00 0.00 57.07 54.82 1s7u s TYR 262 Cb -0.15 -2.07 0.03 0.00 -0.11 0.00 0.00 41.96 39.67 1s7u s TYR 262 CO -0.05 -0.59 0.38 -1.58 -1.11 0.00 0.00 175.55 172.59 1s7u s HIS 263 N 1.43 -0.35 -1.09 2.71 2.46 -1.26 -1.82 115.29 117.37 1s7u s HIS 263 Ca 0.05 0.76 0.11 0.00 0.47 0.00 0.00 55.06 56.46 1s7u s HIS 263 Cb -0.14 0.14 0.51 0.00 -0.13 0.00 0.00 32.58 32.96 1s7u s HIS 263 CO -0.05 -0.30 1.34 -0.85 -2.47 0.00 0.00 174.74 172.42 1s7u n GLU 264 N 2.16 0.04 0.04 2.88 0.28 -1.26 -1.33 120.64 123.45 1s7u n GLU 264 Ca -0.17 0.28 -0.03 0.00 -0.16 0.00 0.00 57.16 57.08 1s7u n GLU 264 Cb 0.57 -1.50 -0.08 0.00 1.43 0.00 0.00 31.44 31.86 1s7u n GLU 264 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 1s7u h GLY 265 N 1.95 0.00 -3.22 -1.84 0.00 -1.88 -3.47 103.07 94.61 1s7u h GLY 265 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.80 1s7u h GLY 265 CO 0.00 0.00 0.59 1.08 0.00 0.00 0.00 176.54 178.21 1s7u s LEU 266 N -6.15 4.13 0.20 3.11 1.02 -0.44 -4.82 118.68 115.72 1s7u s LEU 266 Ca -0.01 2.62 0.03 0.00 0.02 0.00 0.00 54.13 56.78 1s7u s LEU 266 Cb 0.09 -4.01 0.11 0.00 0.02 0.00 0.00 46.19 42.40 1s7u s LEU 266 CO 0.80 -0.97 1.46 1.55 0.02 0.00 0.00 176.35 179.22 1s7u h PRO 267 N 2.40 0.25 -3.73 1.29 0.13 -1.91 -3.46 132.00 126.97 1s7u h PRO 267 Ca -0.50 -0.22 -0.08 0.00 -0.87 0.00 0.00 66.00 64.34 1s7u h PRO 267 Cb 1.25 0.05 -0.13 0.00 0.13 0.00 0.00 31.00 32.30 1s7u h PRO 267 CO 0.61 0.88 -0.28 -1.83 -0.23 0.00 0.00 178.00 177.15 1s7u s GLU 268 N -3.51 1.01 0.28 0.86 -1.05 -1.26 -5.14 118.70 109.88 1s7u s GLU 268 Ca -0.04 -0.98 -0.29 0.00 -0.15 0.00 0.00 54.97 53.51 1s7u s GLU 268 Cb 0.11 0.38 -0.14 0.00 -0.44 0.00 0.00 34.13 34.05 1s7u s GLU 268 CO 0.82 -0.36 1.14 -2.30 0.95 0.00 0.00 175.26 175.51 1s7u n PRO 269 N -0.15 1.58 -2.64 -4.83 -0.02 -1.26 -4.95 135.00 122.73 1s7u n PRO 269 Ca -0.13 0.56 -0.39 0.00 -2.02 0.00 0.00 63.50 61.53 1s7u n PRO 269 Cb 0.63 -2.03 -0.05 0.00 -0.02 0.00 0.00 33.50 32.03 1s7u n PRO 269 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1s7u s LEU 270 N 0.13 4.44 0.04 2.45 1.43 -0.71 -4.90 118.68 121.55 1s7u s LEU 270 Ca 0.61 2.03 0.09 0.00 -1.03 0.00 0.00 54.13 55.82 1s7u s LEU 270 Cb -0.69 -3.84 -0.03 0.00 0.03 0.00 0.00 46.19 41.66 1s7u s LEU 270 CO 0.58 -0.12 -0.24 -0.89 0.23 0.00 0.00 176.35 175.91 1s7u s THR 271 N -1.39 2.34 0.08 5.49 2.01 -1.26 -1.72 115.64 121.19 1s7u s THR 271 Ca 0.48 -1.31 -0.22 0.00 0.31 0.00 0.00 61.69 60.95 1s7u s THR 271 Cb -0.25 -1.93 0.05 0.00 0.01 0.00 0.00 72.50 70.39 1s7u s THR 271 CO 0.31 0.37 0.52 -0.76 -0.69 0.00 0.00 174.62 174.38 1s7u s LEU 272 N -1.27 -0.13 0.27 4.42 1.43 -0.15 -4.98 118.68 118.27 1s7u s LEU 272 Ca 0.12 0.09 -0.16 0.00 -1.03 0.00 0.00 54.13 53.15 1s7u s LEU 272 Cb -0.10 2.20 0.01 0.00 0.03 0.00 0.00 46.19 48.32 1s7u s LEU 272 CO 0.03 -0.79 0.58 0.00 0.23 0.00 0.00 176.35 176.40 1s7u s ARG 273 N -2.87 1.68 0.29 1.70 3.03 -1.26 -0.55 118.95 120.96 1s7u s ARG 273 Ca -0.03 -1.18 -0.30 0.00 2.03 0.00 0.00 55.73 56.26 1s7u s ARG 273 Cb -0.00 0.53 -0.11 0.00 -1.03 0.00 0.00 34.95 34.33 1s7u s ARG 273 CO -0.05 -0.73 1.57 -0.46 -1.13 0.00 0.00 175.30 174.49 1s7u s TRP 274 N -3.89 2.80 -0.20 5.89 -0.00 -1.26 -4.68 118.94 117.60 1s7u s TRP 274 Ca 0.18 0.83 -0.03 0.00 -0.00 0.00 0.00 56.10 57.08 1s7u s TRP 274 Cb -0.03 -4.02 0.06 0.00 -0.00 0.00 0.00 33.47 29.48 1s7u s TRP 274 CO 0.09 -3.42 0.06 -1.83 -0.00 0.00 0.00 176.95 171.84 1s7u s GLU 275 N -0.50 0.49 0.00 5.86 -1.05 -1.26 -4.95 118.70 117.28 1s7u s GLU 275 Ca 0.62 -0.37 0.00 0.00 -0.15 0.00 0.00 54.97 55.08 1s7u s GLU 275 Cb -0.47 -2.00 0.00 0.00 -0.44 0.00 0.00 34.13 31.22 1s7u s GLU 275 CO 0.47 -0.68 0.43 -2.30 0.95 0.00 0.00 175.26 174.13