#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 3.05 0.20 1.61 0.04 -1.26 -4.12 135.00 134.52 1s7u s PRO 2 Ca 0.00 1.11 -0.03 0.00 0.04 0.00 0.00 61.00 62.13 1s7u s PRO 2 Cb 0.00 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.51 1s7u s PRO 2 CO 0.00 -1.02 0.18 -1.01 0.04 0.00 0.00 177.00 175.19 1s7u s HIS 3 N -2.72 1.02 0.13 0.56 3.76 -0.88 -4.96 115.29 112.20 1s7u s HIS 3 Ca 0.61 -1.27 -0.24 0.00 -0.15 0.00 0.00 55.06 54.02 1s7u s HIS 3 Cb -0.16 -0.44 0.07 0.00 1.11 0.00 0.00 32.58 33.16 1s7u s HIS 3 CO 0.46 -0.68 0.60 -1.54 -0.85 0.00 0.00 174.74 172.73 1s7u s SER 4 N -3.13 -0.57 -0.00 1.40 1.04 -1.26 -0.77 113.70 110.41 1s7u s SER 4 Ca 0.35 0.09 0.01 0.00 0.48 0.00 0.00 55.95 56.88 1s7u s SER 4 Cb 0.06 0.59 -0.00 0.00 0.10 0.00 0.00 66.02 66.76 1s7u s SER 4 CO 0.11 -0.91 -0.03 -0.32 0.98 0.00 0.00 173.24 173.07 1s7u s MET 5 N -3.39 0.21 -0.02 4.02 1.75 -0.43 -1.01 119.30 120.45 1s7u s MET 5 Ca -0.01 -0.09 -0.04 0.00 -1.25 0.00 0.00 55.69 54.30 1s7u s MET 5 Cb -0.01 -0.21 0.00 0.00 2.84 0.00 0.00 34.83 37.45 1s7u s MET 5 CO -0.10 0.05 0.09 1.03 -0.65 0.00 0.00 175.02 175.45 1s7u s ARG 6 N -0.02 0.28 -0.15 4.11 1.81 -0.57 -1.70 118.95 122.71 1s7u s ARG 6 Ca 0.01 -0.17 -0.00 0.00 -1.72 0.00 0.00 55.73 53.84 1s7u s ARG 6 Cb -0.01 0.12 -0.00 0.00 -0.45 0.00 0.00 34.95 34.60 1s7u s ARG 6 CO -0.00 -0.05 -0.14 0.71 -0.68 0.00 0.00 175.30 175.13 1s7u s TYR 7 N -0.70 2.80 -0.31 -0.53 1.51 -0.42 0.30 117.35 119.99 1s7u s TYR 7 Ca -0.08 -0.95 -0.06 0.00 -1.01 0.00 0.00 57.07 54.97 1s7u s TYR 7 Cb -0.05 -1.89 0.02 0.00 -0.11 0.00 0.00 41.96 39.93 1s7u s TYR 7 CO 0.00 -0.42 0.08 -0.06 -1.11 0.00 0.00 175.55 174.04 1s7u s PHE 8 N 0.75 3.18 0.05 2.71 0.40 0.10 -1.87 117.98 123.30 1s7u s PHE 8 Ca -0.06 -1.17 0.08 0.00 -0.60 0.00 0.00 56.93 55.19 1s7u s PHE 8 Cb -0.15 -2.25 -0.03 0.00 0.51 0.00 0.00 43.02 41.10 1s7u s PHE 8 CO 0.01 -0.64 -0.23 -1.21 0.70 0.00 0.00 175.22 173.86 1s7u s GLU 9 N 1.45 1.88 -0.05 0.44 2.02 0.03 -0.98 118.70 123.49 1s7u s GLU 9 Ca 0.01 -1.08 -0.03 0.00 0.02 0.00 0.00 54.97 53.89 1s7u s GLU 9 Cb -0.18 -2.07 0.03 0.00 0.10 0.00 0.00 34.13 32.01 1s7u s GLU 9 CO 0.02 0.52 0.11 0.99 0.02 0.00 0.00 175.26 176.92 1s7u s THR 10 N -0.89 -0.03 -0.07 3.63 2.01 0.03 -0.84 115.64 119.47 1s7u s THR 10 Ca 0.13 0.12 0.04 0.00 0.31 0.00 0.00 61.69 62.29 1s7u s THR 10 Cb -0.10 -0.19 0.00 0.00 0.01 0.00 0.00 72.50 72.23 1s7u s THR 10 CO 0.04 0.05 -0.18 0.00 -0.69 0.00 0.00 174.62 173.84 1s7u s ALA 11 N 0.77 1.71 -0.12 7.40 0.00 -0.18 -1.01 121.76 130.33 1s7u s ALA 11 Ca -0.06 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.20 1s7u s ALA 11 Cb -0.08 -0.65 0.02 0.00 0.00 0.00 0.00 23.12 22.41 1s7u s ALA 11 CO -0.03 0.23 -0.15 0.08 0.00 0.00 0.00 175.76 175.88 1s7u s VAL 12 N 0.36 1.55 -0.07 0.00 1.01 -0.64 -1.28 120.40 121.32 1s7u s VAL 12 Ca -0.13 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.15 1s7u s VAL 12 Cb -0.16 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.77 1s7u s VAL 12 CO 0.05 0.45 0.10 -0.94 0.00 0.00 0.00 175.10 174.77 1s7u s SER 13 N 1.07 5.99 0.13 3.32 1.04 -0.45 -1.78 113.70 123.02 1s7u s SER 13 Ca -0.04 0.32 0.05 0.00 0.48 0.00 0.00 55.95 56.76 1s7u s SER 13 Cb -0.15 -1.84 -0.04 0.00 0.10 0.00 0.00 66.02 64.09 1s7u s SER 13 CO -0.03 0.35 -0.13 -0.13 0.98 0.00 0.00 173.24 174.28 1s7u s ARG 14 N -1.27 1.02 0.25 4.02 0.52 -1.26 -1.76 118.95 120.46 1s7u s ARG 14 Ca 0.18 -1.27 -0.31 0.00 -0.52 0.00 0.00 55.73 53.81 1s7u s ARG 14 Cb -0.12 -0.83 -0.12 0.00 0.52 0.00 0.00 34.95 34.40 1s7u s ARG 14 CO 0.08 0.15 1.66 -2.30 0.02 0.00 0.00 175.30 174.90 1s7u n PRO 15 N 0.40 2.71 0.00 3.54 -0.02 -1.24 -3.79 135.00 136.61 1s7u n PRO 15 Ca -0.15 0.97 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 1s7u n PRO 15 Cb 0.58 -2.78 0.00 0.00 -0.02 0.00 0.00 33.50 31.27 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 3.08 1.34 0.00 -1.23 0.00 -1.26 -4.89 105.19 102.22 1s7u n GLY 16 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1s7u n GLY 16 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1s7u n LEU 17 N 0.00 0.00 0.00 0.99 -0.00 -1.25 -5.05 117.00 111.70 1s7u n LEU 17 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1s7u n LEU 17 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1s7u n LEU 17 CO 0.00 0.00 0.00 -1.84 -0.00 0.00 0.00 177.39 175.55 1s7u n GLU 18 N 0.00 0.81 -1.78 1.96 0.00 -1.26 -5.14 120.64 115.24 1s7u n GLU 18 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 57.16 56.85 1s7u n GLU 18 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 31.44 31.46 1s7u n GLU 18 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 1s7u s GLU 19 N 4.29 3.39 0.72 3.44 0.41 -1.26 -4.85 118.70 124.82 1s7u s GLU 19 Ca 0.00 0.81 -0.15 0.00 -0.41 0.00 0.00 54.97 55.22 1s7u s GLU 19 Cb 0.00 -2.05 0.03 0.00 -1.78 0.00 0.00 34.13 30.33 1s7u s GLU 19 CO 0.00 -0.74 1.17 -2.14 -0.49 0.00 0.00 175.26 173.06 1s7u s PRO 20 N -5.14 2.31 -0.14 0.39 0.02 -1.26 -4.92 135.00 126.26 1s7u s PRO 20 Ca 0.56 1.61 -0.18 0.00 0.02 0.00 0.00 61.00 63.01 1s7u s PRO 20 Cb -0.12 -1.87 -0.04 0.00 0.02 0.00 0.00 34.50 32.49 1s7u s PRO 20 CO 0.54 -1.67 0.47 0.50 -0.33 0.00 0.00 177.00 176.51 1s7u s ARG 21 N -4.02 4.31 -0.14 5.54 3.52 -0.74 -4.89 118.95 122.53 1s7u s ARG 21 Ca 0.71 0.42 0.00 0.00 -0.13 0.00 0.00 55.73 56.73 1s7u s ARG 21 Cb -0.26 -3.46 -0.01 0.00 -1.56 0.00 0.00 34.95 29.67 1s7u s ARG 21 CO 0.45 0.11 -0.14 -0.47 -0.81 0.00 0.00 175.30 174.43 1s7u s TYR 22 N 0.79 2.78 -0.05 5.12 6.14 -1.26 -1.62 117.35 129.26 1s7u s TYR 22 Ca 0.25 -0.82 0.02 0.00 0.64 0.00 0.00 57.07 57.16 1s7u s TYR 22 Cb -0.15 -1.86 0.01 0.00 0.42 0.00 0.00 41.96 40.39 1s7u s TYR 22 CO 0.10 -0.33 -0.09 0.42 0.64 0.00 0.00 175.55 176.29 1s7u s ILE 23 N 0.55 0.86 -0.05 3.14 1.01 -0.18 -1.39 121.20 125.13 1s7u s ILE 23 Ca -0.09 -0.34 0.06 0.00 0.00 0.00 0.00 60.65 60.28 1s7u s ILE 23 Cb -0.16 -0.80 -0.01 0.00 0.01 0.00 0.00 42.46 41.50 1s7u s ILE 23 CO 0.04 0.29 -0.23 -0.55 0.00 0.00 0.00 174.94 174.48 1s7u s SER 24 N 0.60 2.88 -0.08 3.58 0.15 -0.61 -0.79 113.70 119.43 1s7u s SER 24 Ca -0.11 -0.48 0.01 0.00 0.70 0.00 0.00 55.95 56.08 1s7u s SER 24 Cb -0.13 -0.76 0.02 0.00 -1.71 0.00 0.00 66.02 63.43 1s7u s SER 24 CO 0.02 0.23 -0.10 -0.69 1.20 0.00 0.00 173.24 173.90 1s7u s VAL 25 N -0.15 1.05 -0.01 4.45 1.01 -0.16 -1.19 120.40 125.40 1s7u s VAL 25 Ca -0.03 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 61.51 1s7u s VAL 25 Cb -0.13 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 1s7u s VAL 25 CO 0.03 0.35 0.21 -0.83 0.00 0.00 0.00 175.10 174.86 1s7u s GLY 26 N 0.96 2.20 -0.01 4.51 0.00 -0.71 0.03 107.32 114.30 1s7u s GLY 26 Ca -0.09 -0.69 0.03 0.00 0.00 0.00 0.00 44.72 43.97 1s7u s GLY 26 CO 0.00 -0.55 -0.11 -0.19 0.00 0.00 0.00 173.10 172.25 1s7u s TYR 27 N -1.31 1.05 -0.05 1.90 1.51 0.15 -1.39 117.35 119.21 1s7u s TYR 27 Ca 0.27 -0.21 0.04 0.00 -1.01 0.00 0.00 57.07 56.16 1s7u s TYR 27 Cb -0.13 -0.69 -0.02 0.00 -0.11 0.00 0.00 41.96 41.01 1s7u s TYR 27 CO 0.17 -0.03 -0.16 0.08 -1.11 0.00 0.00 175.55 174.50 1s7u s VAL 28 N -0.21 2.94 0.00 0.71 1.01 -0.37 -1.51 120.40 122.98 1s7u s VAL 28 Ca 0.03 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.25 1s7u s VAL 28 Cb -0.05 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 34.18 1s7u s VAL 28 CO -0.00 0.59 0.00 -0.90 0.00 0.00 0.00 175.10 174.78 1s7u n ASP 29 N 2.40 0.00 -0.54 3.32 3.85 -0.18 -1.04 116.55 124.37 1s7u n ASP 29 Ca -0.17 0.00 -0.07 0.00 -0.71 0.00 0.00 54.79 53.84 1s7u n ASP 29 Cb 0.52 0.00 -0.03 0.00 -1.35 0.00 0.00 41.12 40.26 1s7u n ASP 29 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 1s7u n ASN 30 N 0.34 -4.44 -4.14 -1.12 3.02 -1.26 -4.99 115.26 102.67 1s7u n ASN 30 Ca 0.00 0.17 -0.31 0.00 -0.03 0.00 0.00 54.58 54.41 1s7u n ASN 30 Cb 0.00 -2.56 -0.17 0.00 -0.61 0.00 0.00 39.78 36.45 1s7u n ASN 30 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1s7u s LYS 31 N -2.25 2.75 0.08 3.52 2.20 -0.21 -5.07 119.74 120.77 1s7u s LYS 31 Ca 0.00 -0.76 -0.31 0.00 -0.36 0.00 0.00 55.97 54.54 1s7u s LYS 31 Cb 0.00 -2.21 -0.08 0.00 -1.51 0.00 0.00 37.83 34.03 1s7u s LYS 31 CO 0.00 0.02 1.58 -2.00 -0.36 0.00 0.00 175.35 174.59 1s7u s GLU 32 N 0.75 4.22 0.00 4.03 2.12 -1.26 -1.23 118.70 127.33 1s7u s GLU 32 Ca -0.10 2.27 0.00 0.00 0.36 0.00 0.00 54.97 57.50 1s7u s GLU 32 Cb -0.16 -3.48 0.00 0.00 0.26 0.00 0.00 34.13 30.76 1s7u s GLU 32 CO 0.01 -0.66 0.00 1.97 -0.54 0.00 0.00 175.26 176.03 1s7u n PHE 33 N 5.10 0.00 -3.99 5.30 -1.74 -0.49 -4.42 117.46 117.22 1s7u n PHE 33 Ca 0.15 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.95 1s7u n PHE 33 Cb 0.41 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.32 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 -1.67 0.14 -0.28 1.97 -7.23 -1.23 -1.34 120.40 110.77 1s7u s VAL 34 Ca 0.00 -1.53 -0.17 0.00 -1.81 0.00 0.00 61.98 58.47 1s7u s VAL 34 Cb 0.00 -1.61 0.09 0.00 0.56 0.00 0.00 36.38 35.42 1s7u s VAL 34 CO 0.00 -0.65 0.74 -0.60 -0.31 0.00 0.00 175.10 174.29 1s7u s ARG 35 N -3.93 0.67 0.02 4.82 3.52 -0.93 -1.74 118.95 121.38 1s7u s ARG 35 Ca 0.11 1.11 0.09 0.00 -0.13 0.00 0.00 55.73 56.91 1s7u s ARG 35 Cb 0.06 0.16 -0.03 0.00 -1.56 0.00 0.00 34.95 33.58 1s7u s ARG 35 CO -0.06 -0.13 -0.26 0.12 -0.81 0.00 0.00 175.30 174.15 1s7u s PHE 36 N 1.45 2.31 -0.24 5.12 2.19 -0.34 -1.03 117.98 127.44 1s7u s PHE 36 Ca -0.09 -0.42 -0.02 0.00 0.33 0.00 0.00 56.93 56.73 1s7u s PHE 36 Cb -0.05 -1.42 0.12 0.00 -1.31 0.00 0.00 43.02 40.37 1s7u s PHE 36 CO -0.17 0.07 0.32 0.34 1.83 0.00 0.00 175.22 177.62 1s7u s ASP 37 N -1.04 0.77 0.65 6.13 -1.08 -1.26 -1.57 116.67 119.27 1s7u s ASP 37 Ca 0.11 -0.09 0.35 0.00 -0.52 0.00 0.00 52.55 52.40 1s7u s ASP 37 Cb -0.10 0.83 1.91 0.00 -1.46 0.00 0.00 42.92 44.09 1s7u s ASP 37 CO 0.01 -0.32 2.10 0.77 0.52 0.00 0.00 175.17 178.25 1s7u h SER 38 N 8.23 0.00 1.30 -0.34 4.64 -1.63 -1.82 113.55 123.93 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 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1s7u h SER 38 CO 0.28 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.71 1s7u n ASP 39 N -3.12 0.69 -4.75 4.97 9.92 -1.26 -4.83 116.55 118.16 1s7u n ASP 39 Ca -0.01 0.58 -0.34 0.00 -0.53 0.00 0.00 54.79 54.48 1s7u n ASP 39 Cb 0.28 -0.76 0.05 0.00 -0.64 0.00 0.00 41.12 40.04 1s7u n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1s7u s ALA 40 N -3.12 2.43 0.17 2.24 0.00 -0.68 -4.95 121.76 117.85 1s7u s ALA 40 Ca 0.10 0.78 -0.14 0.00 0.00 0.00 0.00 51.96 52.70 1s7u s ALA 40 Cb 0.13 -3.39 0.11 0.00 0.00 0.00 0.00 23.12 19.96 1s7u s ALA 40 CO 0.55 -1.33 1.78 1.49 0.00 0.00 0.00 175.76 178.26 1s7u h GLU 41 N 0.32 0.46 -3.25 0.00 4.81 -1.89 -3.26 114.58 111.77 1s7u h GLU 41 Ca -0.48 -0.03 -0.67 0.00 -0.13 0.00 0.00 59.36 58.05 1s7u h GLU 41 Cb 1.27 -0.10 -0.38 0.00 0.63 0.00 0.00 28.75 30.17 1s7u h GLU 41 CO 0.54 0.30 -0.29 1.21 -0.73 0.00 0.00 179.01 180.03 1s7u s ASN 42 N -5.48 5.50 -0.26 1.04 2.47 -1.26 -5.06 114.94 111.88 1s7u s ASN 42 Ca -0.13 -3.71 -0.34 0.00 0.42 0.00 0.00 52.86 49.10 1s7u s ASN 42 Cb 0.13 -1.80 -0.11 0.00 -1.45 0.00 0.00 41.25 38.02 1s7u s ASN 42 CO 0.73 -0.16 2.08 -2.65 -3.72 0.00 0.00 177.10 173.38 1s7u n PRO 43 N 2.28 1.49 -3.72 0.43 -0.02 -1.23 -4.92 135.00 129.31 1s7u n PRO 43 Ca 0.20 0.46 -0.13 0.00 -2.02 0.00 0.00 63.50 62.01 1s7u n PRO 43 Cb 0.36 -2.59 -0.07 0.00 -0.02 0.00 0.00 33.50 31.17 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 5.48 0.80 0.23 -0.52 0.52 -1.26 -5.02 118.95 119.17 1s7u s ARG 44 Ca 1.03 -0.30 -0.30 0.00 -0.52 0.00 0.00 55.73 55.64 1s7u s ARG 44 Cb -0.76 0.35 -0.09 0.00 0.52 0.00 0.00 34.95 34.97 1s7u s ARG 44 CO 0.49 -0.25 1.33 0.71 0.02 0.00 0.00 175.30 177.60 1s7u s TYR 45 N -1.97 3.20 0.03 -0.53 2.02 -1.26 -4.24 117.35 114.60 1s7u s TYR 45 Ca -0.09 1.22 0.05 0.00 -0.37 0.00 0.00 57.07 57.89 1s7u s TYR 45 Cb -0.02 -3.64 -0.02 0.00 -0.40 0.00 0.00 41.96 37.87 1s7u s TYR 45 CO 0.01 -1.98 -0.15 -1.21 -1.57 0.00 0.00 175.55 170.65 1s7u s GLU 46 N -0.41 1.04 0.55 -0.62 0.41 -0.20 -4.93 118.70 114.54 1s7u s GLU 46 Ca 0.56 -0.75 -0.21 0.00 -0.41 0.00 0.00 54.97 54.15 1s7u s GLU 46 Cb -0.38 -1.06 -0.05 0.00 -1.78 0.00 0.00 34.13 30.87 1s7u s GLU 46 CO 0.41 0.27 1.33 -1.25 -0.49 0.00 0.00 175.26 175.52 1s7u s PRO 47 N -1.03 3.12 0.00 0.39 0.04 -1.26 -2.20 135.00 134.06 1s7u s PRO 47 Ca 0.03 2.15 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1s7u s PRO 47 Cb -0.08 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 32.26 1s7u s PRO 47 CO 0.01 -1.18 0.42 0.54 0.04 0.00 0.00 177.00 176.84 1s7u n ARG 48 N -1.11 0.26 -3.85 4.56 5.12 -0.45 -4.87 116.66 116.32 1s7u n ARG 48 Ca 0.11 -0.51 -0.12 0.00 -1.93 0.00 0.00 57.85 55.40 1s7u n ARG 48 Cb 0.46 -0.73 -0.12 0.00 -1.16 0.00 0.00 32.46 30.91 1s7u n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1s7u s ALA 49 N -0.18 -0.25 0.48 7.54 0.00 -1.25 -4.76 121.76 123.34 1s7u s ALA 49 Ca 0.00 0.15 0.21 0.00 0.00 0.00 0.00 51.96 52.32 1s7u s ALA 49 Cb 0.00 -0.10 1.24 0.00 0.00 0.00 0.00 23.12 24.26 1s7u s ALA 49 CO 0.00 -0.09 1.95 -1.35 0.00 0.00 0.00 175.76 176.27 1s7u h PRO 50 N 5.54 0.20 0.00 0.00 0.11 -1.96 -1.83 132.00 134.06 1s7u h PRO 50 Ca -0.27 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.81 1s7u h PRO 50 Cb 1.20 -0.04 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1s7u h PRO 50 CO 0.43 0.13 -0.11 0.11 -0.21 0.00 0.00 178.00 178.35 1s7u h TRP 51 N 0.21 0.00 0.00 0.65 5.08 -1.98 -2.75 115.95 117.16 1s7u h TRP 51 Ca 0.33 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.30 1s7u h TRP 51 Cb 1.01 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.17 1s7u h TRP 51 CO -0.00 0.11 0.00 0.52 -1.28 0.00 0.00 178.44 177.79 1s7u h MET 52 N 0.00 0.00 0.00 0.12 2.86 -1.68 -3.14 114.93 113.09 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 0.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.11 1s7u h MET 52 CO 0.01 0.00 0.00 0.93 1.06 0.00 0.00 176.91 178.91 1s7u h GLU 53 N 0.00 0.00 -0.67 1.72 5.08 -1.63 -2.17 114.58 116.91 1s7u h GLU 53 Ca 0.00 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.50 1s7u h GLU 53 Cb 0.71 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.84 1s7u h GLU 53 CO 0.00 0.00 0.02 1.96 -1.00 0.00 0.00 179.01 179.99 1s7u h GLN 54 N 0.00 0.13 -6.76 2.33 4.20 -1.75 -3.44 115.11 109.82 1s7u h GLN 54 Ca 0.00 -0.01 -0.56 0.00 0.06 0.00 0.00 58.65 58.15 1s7u h GLN 54 Cb 0.11 -0.03 0.10 0.00 0.30 0.00 0.00 27.48 27.95 1s7u h GLN 54 CO 0.00 0.08 0.71 0.39 -0.67 0.00 0.00 178.83 179.34 1s7u n GLU 55 N -5.28 2.40 -1.85 1.46 -0.58 -0.82 -4.99 120.64 110.98 1s7u n GLU 55 Ca 0.11 0.85 -0.29 0.00 -0.42 0.00 0.00 57.16 57.40 1s7u n GLU 55 Cb 0.40 -2.54 0.12 0.00 -0.57 0.00 0.00 31.44 28.85 1s7u n GLU 55 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1s7u s GLY 56 N 0.14 1.63 0.55 0.62 0.00 -1.26 -4.93 107.32 104.07 1s7u s GLY 56 Ca 0.61 -0.77 0.24 0.00 0.00 0.00 0.00 44.72 44.80 1s7u s GLY 56 CO 0.55 -0.20 2.19 -0.56 0.00 0.00 0.00 173.10 175.08 1s7u h PRO 57 N -1.27 0.00 -0.41 2.90 0.13 -1.98 -2.32 132.00 129.04 1s7u h PRO 57 Ca -0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.61 1s7u h PRO 57 Cb 1.31 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.42 1s7u h PRO 57 CO 0.58 0.02 0.03 0.93 -0.23 0.00 0.00 178.00 179.34 1s7u h GLU 58 N 0.00 0.65 -0.09 0.86 3.07 -2.00 -1.88 114.58 115.19 1s7u h GLU 58 Ca -0.00 -0.14 -0.00 0.00 -0.50 0.00 0.00 59.36 58.71 1s7u h GLU 58 Cb 0.05 -0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 27.87 1s7u h GLU 58 CO 0.00 0.65 0.05 -0.92 -1.40 0.00 0.00 179.01 177.39 1s7u h TYR 59 N 0.62 0.13 -0.46 4.33 5.03 -1.78 -2.61 116.97 122.22 1s7u h TYR 59 Ca 0.13 -0.01 -0.11 0.00 2.58 0.00 0.00 58.73 61.32 1s7u h TYR 59 Cb 0.35 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 38.57 1s7u h TYR 59 CO 0.02 0.18 -0.16 -1.49 -1.32 0.00 0.00 178.16 175.38 1s7u h TRP 60 N 0.04 0.99 -0.46 -3.82 4.06 -1.48 -2.32 115.95 112.96 1s7u h TRP 60 Ca 0.03 -0.21 -0.02 0.00 2.06 0.00 0.00 58.89 60.75 1s7u h TRP 60 Cb 0.10 -0.24 -0.02 0.00 -1.00 0.00 0.00 29.16 28.00 1s7u h TRP 60 CO -0.04 0.97 0.20 0.93 -3.56 0.00 0.00 178.44 176.94 1s7u h GLU 61 N 0.78 0.68 0.04 0.49 5.08 -1.36 -1.17 114.58 119.12 1s7u h GLU 61 Ca 0.12 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1s7u h GLU 61 Cb 0.70 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1s7u h GLU 61 CO 0.05 0.61 -0.02 -0.09 -1.00 0.00 0.00 179.01 178.56 1s7u h ARG 62 N 0.60 -0.05 -0.78 2.33 2.43 -1.37 -1.35 114.38 116.19 1s7u h ARG 62 Ca 0.16 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.35 1s7u h ARG 62 Cb 0.17 0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.69 1s7u h ARG 62 CO -0.01 0.26 0.50 0.93 -1.51 0.00 0.00 179.97 180.13 1s7u h GLU 63 N -0.36 0.96 -0.69 0.20 4.39 -1.44 -1.15 114.58 116.49 1s7u h GLU 63 Ca -0.01 -0.06 0.01 0.00 0.34 0.00 0.00 59.36 59.65 1s7u h GLU 63 Cb 0.33 -0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 1s7u h GLU 63 CO 0.01 0.63 0.46 1.15 -1.16 0.00 0.00 179.01 180.10 1s7u h THR 64 N 0.99 1.17 -0.34 1.13 2.02 -1.17 -0.07 112.91 116.65 1s7u h THR 64 Ca 0.30 -0.32 -0.06 0.00 0.77 0.00 0.00 66.41 67.10 1s7u h THR 64 Cb -0.03 0.16 -0.02 0.00 -1.74 0.00 0.00 68.15 66.53 1s7u h THR 64 CO -0.10 0.17 -0.05 1.56 0.37 0.00 0.00 175.52 177.48 1s7u h GLN 65 N 0.93 0.55 -0.44 6.66 1.08 -0.74 -0.89 115.11 122.26 1s7u h GLN 65 Ca 0.25 -0.14 -0.05 0.00 -1.45 0.00 0.00 58.65 57.27 1s7u h GLN 65 Cb -0.10 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 27.24 1s7u h GLN 65 CO -0.06 0.61 0.07 0.87 -0.95 0.00 0.00 178.83 179.38 1s7u h LYS 66 N 0.52 0.73 -0.72 1.46 1.57 -0.78 -2.37 116.57 116.98 1s7u h LYS 66 Ca 0.10 -0.20 0.04 0.00 -1.87 0.00 0.00 60.65 58.73 1s7u h LYS 66 Cb 0.41 -0.09 -0.05 0.00 0.08 0.00 0.00 32.23 32.58 1s7u h LYS 66 CO 0.02 0.76 0.44 0.00 -0.57 0.00 0.00 179.45 180.10 1s7u h ALA 67 N 0.95 0.95 0.00 3.86 0.00 -0.18 -0.99 119.26 123.85 1s7u h ALA 67 Ca 0.13 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 1s7u h ALA 67 Cb 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1s7u h ALA 67 CO 0.01 0.21 -0.37 0.87 0.00 0.00 0.00 179.25 179.97 1s7u h LYS 68 N 0.86 0.00 -0.22 0.00 1.57 -1.07 -0.41 116.57 117.30 1s7u h LYS 68 Ca 0.30 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.03 1s7u h LYS 68 Cb 0.06 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1s7u h LYS 68 CO -0.12 0.37 -0.04 0.78 -0.57 0.00 0.00 179.45 179.86 1s7u h GLY 69 N 1.32 0.44 1.00 3.86 0.00 -0.87 -3.10 103.07 105.72 1s7u h GLY 69 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1s7u h GLY 69 CO 0.05 0.33 0.28 1.46 0.00 0.00 0.00 176.54 178.65 1s7u h GLN 70 N 0.14 0.57 -0.75 4.80 1.08 -0.62 -1.69 115.11 118.63 1s7u h GLN 70 Ca 0.06 -0.04 0.17 0.00 -1.45 0.00 0.00 58.65 57.39 1s7u h GLN 70 Cb 0.48 -0.13 -0.11 0.00 -0.05 0.00 0.00 27.48 27.67 1s7u h GLN 70 CO 0.02 0.38 0.17 1.49 -0.95 0.00 0.00 178.83 179.94 1s7u h GLU 71 N 0.58 0.24 -0.12 1.46 4.81 -1.13 -0.03 114.58 120.39 1s7u h GLU 71 Ca 0.16 -0.01 -0.19 0.00 -0.13 0.00 0.00 59.36 59.19 1s7u h GLU 71 Cb -0.05 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.27 1s7u h GLU 71 CO -0.03 0.16 -0.69 1.96 -0.73 0.00 0.00 179.01 179.68 1s7u h GLN 72 N 0.25 0.53 -0.85 1.92 1.08 -1.32 -2.20 115.11 114.51 1s7u h GLN 72 Ca 0.43 -0.40 0.02 0.00 -1.45 0.00 0.00 58.65 57.24 1s7u h GLN 72 Cb 0.74 0.07 -0.05 0.00 -0.05 0.00 0.00 27.48 28.20 1s7u h GLN 72 CO -0.53 1.03 0.56 2.35 -0.95 0.00 0.00 178.83 181.28 1s7u h TRP 73 N 0.37 1.06 -0.18 2.96 7.01 -0.48 -1.99 115.95 124.70 1s7u h TRP 73 Ca -0.02 0.03 -0.15 0.00 2.11 0.00 0.00 58.89 60.85 1s7u h TRP 73 Cb 1.27 -0.36 -0.01 0.00 -2.10 0.00 0.00 29.16 27.96 1s7u h TRP 73 CO 0.05 0.65 -0.51 0.74 -2.79 0.00 0.00 178.44 176.58 1s7u h PHE 74 N 1.13 0.63 -0.24 2.65 -1.00 -0.92 -1.36 116.94 117.84 1s7u h PHE 74 Ca 0.32 -0.21 -0.06 0.00 2.81 0.00 0.00 57.97 60.83 1s7u h PHE 74 Cb -0.09 -0.12 -0.01 0.00 3.61 0.00 0.00 35.95 39.34 1s7u h PHE 74 CO -0.02 0.92 -0.08 -0.09 -1.61 0.00 0.00 178.31 177.43 1s7u h ARG 75 N 0.40 0.47 -0.64 1.51 2.43 -1.08 0.07 114.38 117.55 1s7u h ARG 75 Ca 0.01 -0.19 -0.07 0.00 -0.81 0.00 0.00 59.98 58.93 1s7u h ARG 75 Cb 1.03 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.54 1s7u h ARG 75 CO 0.09 0.72 0.14 0.28 -1.51 0.00 0.00 179.97 179.70 1s7u h VAL 76 N 0.20 1.26 -0.60 0.20 2.07 -1.32 -2.47 116.25 115.59 1s7u h VAL 76 Ca 0.06 -0.96 -0.09 0.00 0.82 0.00 0.00 66.70 66.52 1s7u h VAL 76 Cb 0.56 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1s7u h VAL 76 CO 0.03 0.36 0.00 0.28 0.02 0.00 0.00 177.57 178.26 1s7u h SER 77 N 0.95 1.02 -0.75 0.57 0.02 -1.08 -1.18 113.55 113.10 1s7u h SER 77 Ca 0.20 -0.29 0.04 0.00 -0.84 0.00 0.00 61.79 60.90 1s7u h SER 77 Cb 0.38 -0.27 -0.05 0.00 0.14 0.00 0.00 62.40 62.60 1s7u h SER 77 CO 0.01 1.07 0.46 -0.07 -1.14 0.00 0.00 176.83 177.16 1s7u h LEU 78 N 0.96 0.75 -0.40 5.07 4.07 -0.83 -1.10 115.31 123.82 1s7u h LEU 78 Ca 0.17 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.12 1s7u h LEU 78 Cb 0.55 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 42.12 1s7u h LEU 78 CO 0.03 0.50 0.19 -0.09 -1.08 0.00 0.00 178.44 178.00 1s7u h ARG 79 N 0.88 0.58 -0.46 1.13 9.65 -0.98 -2.77 114.38 122.41 1s7u h ARG 79 Ca 0.31 -0.08 -0.06 0.00 -1.10 0.00 0.00 59.98 59.05 1s7u h ARG 79 Cb 0.08 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.53 1s7u h ARG 79 CO -0.14 0.50 0.03 -0.91 2.80 0.00 0.00 179.97 182.25 1s7u h ASN 80 N 0.51 0.71 0.08 -3.80 2.35 -0.69 -3.01 115.58 111.72 1s7u h ASN 80 Ca 0.14 -0.15 -0.14 0.00 -0.55 0.00 0.00 56.30 55.59 1s7u h ASN 80 Cb 0.12 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.29 1s7u h ASN 80 CO -0.02 0.76 -0.50 -0.07 -1.65 0.00 0.00 177.43 175.95 1s7u h LEU 81 N 0.70 0.52 -0.57 1.61 3.38 -1.12 -0.61 115.31 119.24 1s7u h LEU 81 Ca 0.14 -0.26 0.04 0.00 0.09 0.00 0.00 57.88 57.89 1s7u h LEU 81 Cb 0.39 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1s7u h LEU 81 CO 0.01 0.93 0.32 0.25 0.09 0.00 0.00 178.44 180.05 1s7u h LEU 82 N 0.38 0.50 -0.56 1.67 5.85 -1.37 -0.52 115.31 121.26 1s7u h LEU 82 Ca 0.02 0.02 -0.14 0.00 0.84 0.00 0.00 57.88 58.61 1s7u h LEU 82 Cb 1.01 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 1s7u h LEU 82 CO 0.09 0.34 -0.35 1.23 -0.34 0.00 0.00 178.44 179.41 1s7u h GLY 83 N 0.62 0.84 1.40 3.75 0.00 -1.38 -0.83 103.07 107.47 1s7u h GLY 83 Ca 0.24 -0.81 -0.05 0.00 0.00 0.00 0.00 47.33 46.71 1s7u h GLY 83 CO -0.13 0.74 0.09 -0.97 0.00 0.00 0.00 176.54 176.27 1s7u h TYR 84 N 0.64 0.78 -0.65 5.60 0.05 -0.52 -2.93 116.97 119.94 1s7u h TYR 84 Ca 0.06 -0.07 0.00 0.00 0.05 0.00 0.00 58.73 58.77 1s7u h TYR 84 Cb 0.89 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 38.40 1s7u h TYR 84 CO 0.05 0.67 0.00 0.66 -1.05 0.00 0.00 178.16 178.49 1s7u n TYR 85 N -4.27 0.86 -3.97 4.88 4.01 -0.26 -4.82 117.16 113.60 1s7u n TYR 85 Ca 0.03 -0.43 -0.28 0.00 -0.16 0.00 0.00 57.90 57.06 1s7u n TYR 85 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.25 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 1.58 -1.53 -4.80 7.72 5.15 -0.93 -4.95 115.26 117.50 1s7u n ASN 86 Ca 0.23 -0.96 -0.38 0.00 -0.60 0.00 0.00 54.58 52.88 1s7u n ASN 86 Cb 0.61 -3.22 -0.06 0.00 -0.53 0.00 0.00 39.78 36.57 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 -6.56 3.99 0.84 1.20 -0.21 -0.36 -5.05 119.66 113.50 1s7u s GLN 87 Ca 0.23 0.30 -0.09 0.00 0.02 0.00 0.00 55.36 55.82 1s7u s GLN 87 Cb -0.12 -3.29 0.16 0.00 1.00 0.00 0.00 33.01 30.76 1s7u s GLN 87 CO 0.88 0.54 1.16 -1.12 -2.12 0.00 0.00 175.29 174.63 1s7u s SER 88 N -0.54 3.79 0.69 5.90 0.01 -1.26 -4.67 113.70 117.62 1s7u s SER 88 Ca 0.22 0.03 -0.14 0.00 1.31 0.00 0.00 55.95 57.37 1s7u s SER 88 Cb -0.15 -0.27 0.01 0.00 0.21 0.00 0.00 66.02 65.82 1s7u s SER 88 CO 0.10 -2.26 1.10 0.00 0.41 0.00 0.00 173.24 172.59 1s7u s ALA 89 N -3.52 2.45 0.00 1.44 0.00 -1.26 -4.45 121.76 116.42 1s7u s ALA 89 Ca 0.69 0.44 0.00 0.00 0.00 0.00 0.00 51.96 53.09 1s7u s ALA 89 Cb -0.05 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.78 1s7u s ALA 89 CO 0.49 -1.36 0.00 0.41 0.00 0.00 0.00 175.76 175.29 1s7u n GLY 90 N -0.81 1.05 3.80 0.00 0.00 -1.26 -5.11 105.19 102.87 1s7u n GLY 90 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.00 2.87 -0.00 -0.02 0.00 -1.26 -4.81 107.32 102.09 1s7u s GLY 91 Ca 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 44.72 44.16 1s7u s GLY 91 CO 0.00 -2.14 0.02 -0.56 0.00 0.00 0.00 173.10 170.42 1s7u s SER 92 N -3.98 5.25 0.03 1.64 0.01 -1.26 -3.59 113.70 111.80 1s7u s SER 92 Ca 0.12 0.03 0.01 0.00 1.31 0.00 0.00 55.95 57.42 1s7u s SER 92 Cb 0.01 -1.41 -0.02 0.00 0.21 0.00 0.00 66.02 64.81 1s7u s SER 92 CO 0.07 0.28 -0.04 -1.00 0.41 0.00 0.00 173.24 172.96 1s7u s HIS 93 N -1.11 0.37 -0.04 2.43 0.09 -0.72 -4.98 115.29 111.33 1s7u s HIS 93 Ca 0.20 -0.54 0.02 0.00 -0.00 0.00 0.00 55.06 54.74 1s7u s HIS 93 Cb -0.12 -0.25 0.01 0.00 -0.00 0.00 0.00 32.58 32.22 1s7u s HIS 93 CO 0.11 -0.17 -0.10 0.99 -0.00 0.00 0.00 174.74 175.57 1s7u s THR 94 N -1.52 0.86 -0.11 1.30 2.01 -1.26 -1.34 115.64 115.59 1s7u s THR 94 Ca -0.14 -0.37 0.03 0.00 0.31 0.00 0.00 61.69 61.52 1s7u s THR 94 Cb -0.09 -0.79 0.01 0.00 0.01 0.00 0.00 72.50 71.64 1s7u s THR 94 CO -0.01 0.28 -0.21 -0.22 -0.69 0.00 0.00 174.62 173.77 1s7u s LEU 95 N 0.40 2.00 0.10 4.42 2.96 -0.40 -0.85 118.68 127.31 1s7u s LEU 95 Ca -0.07 -0.53 0.05 0.00 -0.22 0.00 0.00 54.13 53.37 1s7u s LEU 95 Cb -0.11 -1.32 -0.03 0.00 0.50 0.00 0.00 46.19 45.23 1s7u s LEU 95 CO 0.01 0.11 -0.14 -1.10 -1.32 0.00 0.00 176.35 173.91 1s7u s GLN 96 N 0.57 0.91 -0.01 1.98 -0.21 -0.11 -1.01 119.66 121.78 1s7u s GLN 96 Ca -0.14 -1.11 0.00 0.00 0.02 0.00 0.00 55.36 54.13 1s7u s GLN 96 Cb -0.17 -0.83 0.01 0.00 1.00 0.00 0.00 33.01 33.02 1s7u s GLN 96 CO 0.04 0.17 -0.00 -1.14 -2.12 0.00 0.00 175.29 172.24 1s7u s GLN 97 N -2.29 0.11 -0.08 2.91 0.74 -0.02 -0.84 119.66 120.19 1s7u s GLN 97 Ca 0.04 0.00 0.05 0.00 0.05 0.00 0.00 55.36 55.50 1s7u s GLN 97 Cb -0.07 -0.18 -0.01 0.00 1.10 0.00 0.00 33.01 33.86 1s7u s GLN 97 CO 0.02 -0.02 -0.23 -1.64 -0.55 0.00 0.00 175.29 172.87 1s7u s MET 98 N 0.28 2.85 0.04 1.67 -1.94 -0.52 -0.79 119.30 120.89 1s7u s MET 98 Ca -0.02 -0.87 -0.03 0.00 -1.71 0.00 0.00 55.69 53.05 1s7u s MET 98 Cb -0.04 -2.27 -0.02 0.00 2.01 0.00 0.00 34.83 34.51 1s7u s MET 98 CO -0.01 0.28 0.04 -1.54 -0.01 0.00 0.00 175.02 173.78 1s7u s SER 99 N 0.10 0.30 0.00 3.03 1.04 -0.78 -0.90 113.70 116.48 1s7u s SER 99 Ca -0.11 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.61 1s7u s SER 99 Cb -0.16 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.17 1s7u s SER 99 CO 0.06 -0.53 0.00 0.61 0.98 0.00 0.00 173.24 174.36 1s7u n GLY 100 N 0.58 0.07 2.96 7.32 0.00 -0.54 -1.30 105.19 114.28 1s7u n GLY 100 Ca -0.18 -1.56 -0.12 0.00 0.00 0.00 0.00 46.02 44.17 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 -0.88 5.49 -0.02 0.00 1.01 -0.33 -1.31 116.67 120.64 1s7u s ASP 102 Ca -0.08 0.10 0.03 0.00 0.71 0.00 0.00 52.55 53.31 1s7u s ASP 102 Cb -0.06 -1.84 -0.03 0.00 1.01 0.00 0.00 42.92 41.99 1s7u s ASP 102 CO -0.00 0.24 -0.08 -0.76 0.21 0.00 0.00 175.17 174.78 1s7u s LEU 103 N -0.03 3.13 0.00 1.23 1.43 0.05 -0.80 118.68 123.69 1s7u s LEU 103 Ca 0.05 -0.13 -0.07 0.00 -1.03 0.00 0.00 54.13 52.96 1s7u s LEU 103 Cb -0.12 -1.76 0.10 0.00 0.03 0.00 0.00 46.19 44.43 1s7u s LEU 103 CO 0.01 0.31 0.33 0.61 0.23 0.00 0.00 176.35 177.84 1s7u n GLY 104 N 1.76 -2.72 0.06 -3.19 0.00 -0.33 -2.08 105.19 98.69 1s7u n GLY 104 Ca -0.16 -1.43 0.11 0.00 0.00 0.00 0.00 46.02 44.54 1s7u n GLY 104 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1s7u n SER 105 N -3.62 0.37 -0.68 1.61 3.41 -1.26 -2.38 113.62 111.07 1s7u n SER 105 Ca 0.05 0.57 0.08 0.00 -0.26 0.00 0.00 58.87 59.31 1s7u n SER 105 Cb 0.18 -0.66 0.26 0.00 -0.26 0.00 0.00 64.21 63.73 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 -1.88 2.01 -0.63 4.04 5.68 -1.26 -4.27 116.55 120.24 1s7u n ASP 106 Ca 0.04 -1.88 -0.08 0.00 -0.50 0.00 0.00 54.79 52.37 1s7u n ASP 106 Cb 0.27 -0.20 -0.04 0.00 -1.14 0.00 0.00 41.12 40.02 1s7u n ASP 106 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1s7u n TRP 107 N 0.57 0.00 -3.67 2.11 7.02 -1.00 -5.00 117.44 117.47 1s7u n TRP 107 Ca 0.15 0.00 -0.34 0.00 -1.02 0.00 0.00 57.50 56.29 1s7u n TRP 107 Cb 0.35 -2.02 -0.05 0.00 -2.42 0.00 0.00 31.31 27.17 1s7u n TRP 107 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 1s7u s ARG 108 N -2.42 3.66 0.01 -0.99 6.06 -1.26 -4.84 118.95 119.16 1s7u s ARG 108 Ca 0.00 0.01 -0.32 0.00 -2.50 0.00 0.00 55.73 52.92 1s7u s ARG 108 Cb 0.00 -2.98 -0.10 0.00 0.06 0.00 0.00 34.95 31.93 1s7u s ARG 108 CO 0.00 0.56 1.91 -0.11 -2.50 0.00 0.00 175.30 175.17 1s7u n LEU 109 N 0.71 3.87 -0.03 -0.88 7.94 -1.26 -1.19 117.00 126.16 1s7u n LEU 109 Ca -0.07 0.94 -0.22 0.00 -1.11 0.00 0.00 56.01 55.55 1s7u n LEU 109 Cb 0.52 -1.47 -0.13 0.00 0.53 0.00 0.00 43.42 42.87 1s7u n LEU 109 CO 0.44 0.10 -0.81 -0.11 -1.11 0.00 0.00 177.39 175.90 1s7u n LEU 110 N 6.86 2.46 -3.64 -1.96 7.94 0.02 -4.85 117.00 123.84 1s7u n LEU 110 Ca 0.21 0.24 -0.07 0.00 -1.11 0.00 0.00 56.01 55.28 1s7u n LEU 110 Cb 0.36 -1.06 -0.07 0.00 0.53 0.00 0.00 43.42 43.18 1s7u n LEU 110 CO 0.70 0.72 0.52 -0.60 -1.11 0.00 0.00 177.39 177.61 1s7u s ARG 111 N -2.51 0.59 0.25 1.96 3.52 -1.17 -5.01 118.95 116.58 1s7u s ARG 111 Ca -0.25 0.93 -0.03 0.00 -0.13 0.00 0.00 55.73 56.24 1s7u s ARG 111 Cb 0.07 0.16 -0.05 0.00 -1.56 0.00 0.00 34.95 33.57 1s7u s ARG 111 CO 0.71 -0.11 0.49 0.20 -0.81 0.00 0.00 175.30 175.78 1s7u s GLY 112 N 1.21 1.84 -0.02 8.12 0.00 -1.26 -1.18 107.32 116.02 1s7u s GLY 112 Ca -0.07 -0.66 0.02 0.00 0.00 0.00 0.00 44.72 44.01 1s7u s GLY 112 CO -0.14 -0.58 -0.06 -0.19 0.00 0.00 0.00 173.10 172.13 1s7u s TYR 113 N -1.99 0.69 -0.26 1.90 1.51 0.47 -4.85 117.35 114.81 1s7u s TYR 113 Ca 0.42 -0.15 -0.01 0.00 -1.01 0.00 0.00 57.07 56.31 1s7u s TYR 113 Cb -0.11 -0.51 0.14 0.00 -0.11 0.00 0.00 41.96 41.37 1s7u s TYR 113 CO 0.29 -0.08 0.39 -1.17 -1.11 0.00 0.00 175.55 173.87 1s7u s LEU 114 N 0.26 -0.69 0.03 -1.29 0.20 -1.25 -1.46 118.68 114.47 1s7u s LEU 114 Ca -0.03 0.08 0.03 0.00 0.69 0.00 0.00 54.13 54.89 1s7u s LEU 114 Cb -0.08 1.14 -0.02 0.00 -0.43 0.00 0.00 46.19 46.80 1s7u s LEU 114 CO -0.00 -0.31 -0.08 -1.10 -0.29 0.00 0.00 176.35 174.56 1s7u s GLN 115 N 2.55 0.58 0.06 1.98 -0.21 -0.08 -0.69 119.66 123.86 1s7u s GLN 115 Ca 0.12 -0.58 0.07 0.00 0.02 0.00 0.00 55.36 54.99 1s7u s GLN 115 Cb -0.15 -0.46 -0.03 0.00 1.00 0.00 0.00 33.01 33.38 1s7u s GLN 115 CO -0.20 0.11 -0.19 -0.06 -2.12 0.00 0.00 175.29 172.83 1s7u s PHE 116 N -0.88 1.62 0.02 0.91 0.08 0.48 -1.43 117.98 118.78 1s7u s PHE 116 Ca -0.04 -0.39 0.06 0.00 0.12 0.00 0.00 56.93 56.68 1s7u s PHE 116 Cb -0.07 -0.93 -0.02 0.00 -0.57 0.00 0.00 43.02 41.43 1s7u s PHE 116 CO 0.00 0.11 -0.17 0.00 -0.10 0.00 0.00 175.22 175.06 1s7u s ALA 117 N -0.97 1.42 -0.06 5.36 0.00 -0.02 -0.85 121.76 126.64 1s7u s ALA 117 Ca 0.05 -0.86 0.06 0.00 0.00 0.00 0.00 51.96 51.20 1s7u s ALA 117 Cb -0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.73 1s7u s ALA 117 CO 0.02 0.31 -0.24 -0.47 0.00 0.00 0.00 175.76 175.39 1s7u s TYR 118 N -0.68 2.39 -1.29 0.00 5.04 -0.39 -0.94 117.35 121.49 1s7u s TYR 118 Ca 0.05 -0.76 -0.06 0.00 -2.44 0.00 0.00 57.07 53.86 1s7u s TYR 118 Cb -0.08 -1.58 0.04 0.00 0.35 0.00 0.00 41.96 40.69 1s7u s TYR 118 CO 0.01 -0.25 0.37 0.39 -1.34 0.00 0.00 175.55 174.73 1s7u n GLU 119 N 3.07 -3.35 -1.04 4.97 -0.58 -0.03 -1.93 120.64 121.75 1s7u n GLU 119 Ca -0.18 0.61 -0.01 0.00 -0.42 0.00 0.00 57.16 57.16 1s7u n GLU 119 Cb 0.52 -5.32 -0.01 0.00 -0.57 0.00 0.00 31.44 26.07 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 -1.14 0.50 3.12 0.62 0.00 -1.26 -5.00 105.19 102.03 1s7u n GLY 120 Ca -0.08 -0.49 -0.18 0.00 0.00 0.00 0.00 46.02 45.27 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 -1.23 0.81 -0.14 1.61 0.52 -0.81 -5.06 118.95 114.65 1s7u s ARG 121 Ca 0.00 -0.73 -0.40 0.00 -0.52 0.00 0.00 55.73 54.07 1s7u s ARG 121 Cb 0.00 -0.78 -0.18 0.00 0.52 0.00 0.00 34.95 34.51 1s7u s ARG 121 CO 0.00 0.19 1.41 -0.25 0.02 0.00 0.00 175.30 176.67 1s7u n ASP 122 N 1.84 1.29 -0.01 0.23 8.00 -1.26 -1.26 116.55 125.38 1s7u n ASP 122 Ca -0.19 1.13 -0.03 0.00 0.71 0.00 0.00 54.79 56.42 1s7u n ASP 122 Cb 0.55 -1.05 -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 3.22 0.00 -3.74 1.24 9.36 -0.03 -4.75 117.16 122.46 1s7u n TYR 123 Ca 0.23 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.32 1s7u n TYR 123 Cb 0.10 -0.15 -0.10 0.00 -0.63 0.00 0.00 39.34 38.56 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 -1.82 0.02 0.02 2.97 2.07 -1.18 -4.08 121.20 119.20 1s7u s ILE 124 Ca -0.09 -0.16 0.01 0.00 -1.41 0.00 0.00 60.65 59.01 1s7u s ILE 124 Cb 0.01 -0.57 -0.01 0.00 0.13 0.00 0.00 42.46 42.02 1s7u s ILE 124 CO 0.13 -0.09 -0.05 0.00 -1.91 0.00 0.00 174.94 173.02 1s7u s ALA 125 N -0.35 0.35 -0.00 1.50 0.00 -0.26 -0.39 121.76 122.61 1s7u s ALA 125 Ca -0.05 -0.48 -0.30 0.00 0.00 0.00 0.00 51.96 51.13 1s7u s ALA 125 Cb -0.03 0.02 -0.04 0.00 0.00 0.00 0.00 23.12 23.07 1s7u s ALA 125 CO 0.02 -0.02 1.16 -1.17 0.00 0.00 0.00 175.76 175.75 1s7u s LEU 126 N -0.97 4.33 1.02 0.00 2.96 0.14 -0.99 118.68 125.17 1s7u s LEU 126 Ca -0.07 1.86 -0.12 0.00 -0.22 0.00 0.00 54.13 55.57 1s7u s LEU 126 Cb -0.07 -3.57 0.20 0.00 0.50 0.00 0.00 46.19 43.26 1s7u s LEU 126 CO -0.00 -0.48 1.09 0.20 -1.32 0.00 0.00 176.35 175.84 1s7u s ASN 127 N 1.21 2.42 0.56 3.68 0.01 0.35 -4.56 114.94 118.60 1s7u s ASN 127 Ca 0.56 1.21 0.32 0.00 -0.71 0.00 0.00 52.86 54.24 1s7u s ASN 127 Cb -0.26 -1.89 1.63 0.00 0.41 0.00 0.00 41.25 41.14 1s7u s ASN 127 CO 0.26 -3.26 2.12 -0.08 -1.51 0.00 0.00 177.10 174.62 1s7u h GLU 128 N -1.98 0.00 0.00 -0.60 4.81 -1.88 -0.45 114.58 114.47 1s7u h GLU 128 Ca -0.55 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 1s7u h GLU 128 Cb 1.33 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.71 1s7u h GLU 128 CO 0.57 0.07 0.00 -0.40 -0.73 0.00 0.00 179.01 178.52 1s7u n ASP 129 N -3.44 0.00 -2.24 1.04 5.75 -1.26 -4.77 116.55 111.63 1s7u n ASP 129 Ca -0.02 0.19 -0.19 0.00 -0.01 0.00 0.00 54.79 54.77 1s7u n ASP 129 Cb 0.21 -0.36 -0.02 0.00 -1.03 0.00 0.00 41.12 39.92 1s7u n ASP 129 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1s7u n LEU 130 N -1.36 -1.66 0.00 -2.12 4.77 -0.18 -4.75 117.00 111.70 1s7u n LEU 130 Ca 0.07 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.18 1s7u n LEU 130 Cb 0.17 -2.71 0.00 0.00 -2.33 0.00 0.00 43.42 38.55 1s7u n LEU 130 CO 0.15 -0.35 -0.15 0.29 -1.33 0.00 0.00 177.39 176.00 1s7u n LYS 131 N -2.82 0.39 -4.42 3.23 5.02 -1.26 -4.60 118.16 113.70 1s7u n LYS 131 Ca -0.21 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.82 1s7u n LYS 131 Cb 0.66 -0.65 -0.09 0.00 -0.02 0.00 0.00 35.03 34.92 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 -1.30 2.44 0.03 -0.18 -4.23 -1.26 -4.84 115.64 106.30 1s7u s THR 132 Ca 0.00 -2.04 0.09 0.00 -1.18 0.00 0.00 61.69 58.55 1s7u s THR 132 Cb 0.00 -2.76 -0.03 0.00 1.34 0.00 0.00 72.50 71.05 1s7u s THR 132 CO 0.00 -0.18 -0.25 0.26 -0.54 0.00 0.00 174.62 173.91 1s7u s TRP 133 N -2.56 2.20 -0.12 3.99 0.52 -1.26 -0.50 118.94 121.21 1s7u s TRP 133 Ca 0.34 -0.41 -0.01 0.00 0.02 0.00 0.00 56.10 56.04 1s7u s TRP 133 Cb 0.02 -1.34 -0.03 0.00 -1.15 0.00 0.00 33.47 30.97 1s7u s TRP 133 CO 0.18 0.08 -0.06 0.99 0.02 0.00 0.00 176.95 178.16 1s7u s THR 134 N -0.75 3.68 -0.23 2.01 2.01 -0.16 -4.90 115.64 117.31 1s7u s THR 134 Ca 0.10 -0.45 -0.04 0.00 0.31 0.00 0.00 61.69 61.61 1s7u s THR 134 Cb -0.10 -2.56 0.12 0.00 0.01 0.00 0.00 72.50 69.97 1s7u s THR 134 CO 0.01 0.54 0.37 0.00 -0.69 0.00 0.00 174.62 174.86 1s7u s ALA 135 N -0.12 -1.03 -0.05 7.40 0.00 -1.26 -1.10 121.76 125.60 1s7u s ALA 135 Ca 0.01 1.00 -0.26 0.00 0.00 0.00 0.00 51.96 52.71 1s7u s ALA 135 Cb -0.13 -1.55 -0.21 0.00 0.00 0.00 0.00 23.12 21.22 1s7u s ALA 135 CO 0.03 -1.12 1.14 0.00 0.00 0.00 0.00 175.76 175.81 1s7u h ALA 136 N 8.19 -0.01 -2.85 0.00 0.00 -1.88 -3.45 119.26 119.26 1s7u h ALA 136 Ca -0.18 -0.30 -0.52 0.00 0.00 0.00 0.00 54.91 53.91 1s7u h ALA 136 Cb 1.14 0.00 0.07 0.00 0.00 0.00 0.00 17.79 19.00 1s7u h ALA 136 CO 0.24 -0.20 0.60 -0.51 0.00 0.00 0.00 179.25 179.37 1s7u s ASP 137 N -5.80 6.59 0.23 0.00 1.11 -1.26 -4.90 116.67 112.63 1s7u s ASP 137 Ca -0.17 2.60 -0.06 0.00 0.18 0.00 0.00 52.55 55.11 1s7u s ASP 137 Cb 0.01 -2.64 0.37 0.00 1.07 0.00 0.00 42.92 41.73 1s7u s ASP 137 CO 0.67 -0.65 1.79 0.24 1.18 0.00 0.00 175.17 178.39 1s7u h MET 138 N 3.02 0.64 -0.53 8.23 2.86 -2.00 -0.52 114.93 126.63 1s7u h MET 138 Ca -0.49 -0.04 0.03 0.00 -2.06 0.00 0.00 59.70 57.14 1s7u h MET 138 Cb 1.23 -0.14 -0.03 0.00 0.06 0.00 0.00 31.60 32.72 1s7u h MET 138 CO 0.64 0.42 0.35 0.00 1.06 0.00 0.00 176.91 179.38 1s7u h ALA 139 N 1.45 1.72 0.00 6.32 0.00 -1.90 -2.62 119.26 124.23 1s7u h ALA 139 Ca 0.38 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1s7u h ALA 139 Cb 0.40 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1s7u h ALA 139 CO -0.27 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.20 1s7u h ALA 140 N 1.69 1.00 0.00 0.00 0.00 -1.44 -3.20 119.26 117.31 1s7u h ALA 140 Ca 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1s7u h ALA 140 Cb 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 1s7u h ALA 140 CO -0.05 0.00 -0.07 1.96 0.00 0.00 0.00 179.25 181.09 1s7u h GLN 141 N 0.00 0.00 -0.26 0.00 1.08 -1.23 -1.72 115.11 112.99 1s7u h GLN 141 Ca 0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 1s7u h GLN 141 Cb 0.60 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.02 1s7u h GLN 141 CO 0.00 0.07 0.13 0.82 -0.95 0.00 0.00 178.83 178.90 1s7u h ILE 142 N 0.00 1.14 -0.48 2.54 2.04 -1.74 -1.38 117.51 119.63 1s7u h ILE 142 Ca -0.00 -0.39 -0.10 0.00 1.00 0.00 0.00 64.86 65.37 1s7u h ILE 142 Cb 0.15 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.14 1s7u h ILE 142 CO 0.01 0.14 -0.07 0.74 0.00 0.00 0.00 178.15 178.97 1s7u h THR 143 N 0.29 1.27 -0.04 -0.27 2.02 -1.62 -2.35 112.91 112.21 1s7u h THR 143 Ca 0.09 -1.19 0.03 0.00 0.77 0.00 0.00 66.41 66.11 1s7u h THR 143 Cb 0.11 1.05 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 1s7u h THR 143 CO -0.01 0.41 -0.16 -0.09 0.37 0.00 0.00 175.52 176.04 1s7u h ARG 144 N 0.75 -0.24 -0.65 6.66 2.43 -1.17 -0.56 114.38 121.61 1s7u h ARG 144 Ca 0.13 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1s7u h ARG 144 Cb 0.61 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 1s7u h ARG 144 CO 0.04 -0.16 0.35 0.00 -1.51 0.00 0.00 179.97 178.69 1s7u h ARG 145 N -0.25 0.91 -0.68 0.20 3.08 -1.22 -0.14 114.38 116.28 1s7u h ARG 145 Ca 0.07 -0.11 0.02 0.00 0.07 0.00 0.00 59.98 60.02 1s7u h ARG 145 Cb 0.34 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 1s7u h ARG 145 CO -0.19 0.69 0.44 -0.22 -1.07 0.00 0.00 179.97 179.62 1s7u h LYS 146 N 0.88 0.85 -0.01 0.04 3.64 -1.12 -1.73 116.57 119.13 1s7u h LYS 146 Ca 0.23 -0.05 -0.19 0.00 -1.27 0.00 0.00 60.65 59.37 1s7u h LYS 146 Cb 0.05 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.67 1s7u h LYS 146 CO -0.04 0.56 -0.83 -1.49 -2.27 0.00 0.00 179.45 175.39 1s7u h TRP 147 N 0.88 0.31 -0.70 1.91 4.06 -0.68 -2.42 115.95 119.31 1s7u h TRP 147 Ca 0.26 -0.16 -0.05 0.00 2.06 0.00 0.00 58.89 61.00 1s7u h TRP 147 Cb -0.05 -0.04 -0.03 0.00 -1.00 0.00 0.00 29.16 28.04 1s7u h TRP 147 CO -0.03 0.95 0.24 0.93 -3.56 0.00 0.00 178.44 176.96 1s7u h GLU 148 N 0.12 1.07 0.00 0.49 5.08 -0.81 -2.20 114.58 118.33 1s7u h GLU 148 Ca -0.04 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1s7u h GLU 148 Cb 1.44 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1s7u h GLU 148 CO 0.13 0.91 -0.07 1.96 -1.00 0.00 0.00 179.01 180.94 1s7u h GLN 149 N 1.01 0.00 -0.02 2.33 4.20 -1.17 -3.16 115.11 118.30 1s7u h GLN 149 Ca 0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.94 1s7u h GLN 149 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1s7u h GLN 149 CO -0.01 0.00 -0.06 -1.13 -0.67 0.00 0.00 178.83 176.96 1s7u n SER 150 N -3.06 2.34 -3.02 1.46 3.41 -0.93 -4.97 113.62 108.87 1s7u n SER 150 Ca 0.04 -1.74 -0.20 0.00 -0.26 0.00 0.00 58.87 56.71 1s7u n SER 150 Cb 0.53 0.05 0.06 0.00 -0.26 0.00 0.00 64.21 64.59 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 1.30 -0.27 0.27 5.00 0.00 -1.13 -4.93 105.19 105.43 1s7u n GLY 151 Ca 0.15 0.08 0.03 0.00 0.00 0.00 0.00 46.02 46.28 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 0.83 1.56 -0.44 4.61 0.00 -1.68 -3.00 119.26 121.14 1s7u h ALA 152 Ca -0.46 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.23 1s7u h ALA 152 Cb 1.30 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1s7u h ALA 152 CO 0.46 0.32 -0.03 0.00 0.00 0.00 0.00 179.25 180.00 1s7u h ALA 153 N 1.66 1.11 -0.69 0.00 0.00 -1.89 -2.42 119.26 117.04 1s7u h ALA 153 Ca 0.09 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1s7u h ALA 153 Cb 0.22 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1s7u h ALA 153 CO 0.00 0.56 0.20 0.93 0.00 0.00 0.00 179.25 180.94 1s7u h GLU 154 N 0.69 1.07 -0.17 0.00 3.07 -1.78 0.14 114.58 117.61 1s7u h GLU 154 Ca 0.13 -0.23 -0.01 0.00 -0.50 0.00 0.00 59.36 58.75 1s7u h GLU 154 Cb 0.47 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 28.22 1s7u h GLU 154 CO 0.02 0.93 0.06 1.25 -1.40 0.00 0.00 179.01 179.87 1s7u h HIS 155 N 1.03 0.26 -0.55 4.33 -0.00 -1.52 -2.29 115.15 116.41 1s7u h HIS 155 Ca 0.22 -0.02 -0.11 0.00 -0.00 0.00 0.00 60.37 60.46 1s7u h HIS 155 Cb 0.31 -0.08 -0.02 0.00 -0.00 0.00 0.00 27.41 27.63 1s7u h HIS 155 CO 0.02 0.35 -0.07 1.88 -0.00 0.00 0.00 177.93 180.11 1s7u h TYR 156 N 0.10 1.12 -0.77 5.26 0.05 -0.97 -2.90 116.97 118.86 1s7u h TYR 156 Ca 0.05 -0.21 0.08 0.00 0.05 0.00 0.00 58.73 58.70 1s7u h TYR 156 Cb 0.21 -0.28 -0.07 0.00 1.01 0.00 0.00 36.73 37.60 1s7u h TYR 156 CO -0.01 1.02 0.43 -0.22 -1.05 0.00 0.00 178.16 178.34 1s7u h LYS 157 N 0.91 0.73 -0.51 4.88 3.64 -0.71 -0.54 116.57 124.97 1s7u h LYS 157 Ca 0.15 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.42 1s7u h LYS 157 Cb 0.63 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.26 1s7u h LYS 157 CO 0.04 0.49 0.04 0.00 -2.27 0.00 0.00 179.45 177.75 1s7u h ALA 158 N 1.41 1.12 -0.07 5.00 0.00 -1.22 -0.81 119.26 124.69 1s7u h ALA 158 Ca 0.36 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 1s7u h ALA 158 Cb 0.29 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1s7u h ALA 158 CO -0.22 0.57 0.00 -0.92 0.00 0.00 0.00 179.25 178.68 1s7u h TYR 159 N 0.78 0.14 -0.31 0.00 3.20 -1.25 -2.07 116.97 117.46 1s7u h TYR 159 Ca 0.16 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.96 1s7u h TYR 159 Cb 0.41 -0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 1s7u h TYR 159 CO 0.02 0.38 0.01 -0.07 -1.64 0.00 0.00 178.16 176.86 1s7u h LEU 160 N -0.14 0.43 0.00 2.82 3.38 -0.69 -0.63 115.31 120.49 1s7u h LEU 160 Ca 0.02 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.80 1s7u h LEU 160 Cb 0.32 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1s7u h LEU 160 CO 0.00 0.50 -1.36 -0.62 0.09 0.00 0.00 178.44 177.05 1s7u n GLU 161 N -4.30 0.62 0.00 1.13 1.02 -0.35 -4.10 120.64 114.65 1s7u n GLU 161 Ca 0.01 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 1s7u n GLU 161 Cb 0.23 -1.79 0.00 0.00 -0.02 0.00 0.00 31.44 29.85 1s7u n GLU 161 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1s7u n GLY 162 N 1.34 0.19 0.29 0.62 0.00 -0.78 -4.65 105.19 102.22 1s7u n GLY 162 Ca -0.08 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.02 1s7u n GLY 162 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1s7u h GLU 163 N 0.00 0.44 -0.63 1.61 4.81 -1.65 -1.15 114.58 118.01 1s7u h GLU 163 Ca 0.00 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.19 1s7u h GLU 163 Cb 0.00 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 1s7u h GLU 163 CO 0.00 0.29 0.34 0.00 -0.73 0.00 0.00 179.01 178.91 1s7u h VAL 165 N 0.86 0.90 -0.74 0.00 2.07 -1.51 -1.94 116.25 115.89 1s7u h VAL 165 Ca 0.22 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.78 1s7u h VAL 165 Cb 0.05 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 1s7u h VAL 165 CO -0.03 0.20 0.35 -0.33 0.02 0.00 0.00 177.57 177.77 1s7u h GLU 166 N -0.74 1.08 -0.00 1.57 5.08 -1.19 0.03 114.58 120.40 1s7u h GLU 166 Ca -0.02 -0.16 -0.18 0.00 -1.00 0.00 0.00 59.36 58.00 1s7u h GLU 166 Cb 0.51 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1s7u h GLU 166 CO 0.04 0.84 -0.82 -1.49 -1.00 0.00 0.00 179.01 176.58 1s7u h TRP 167 N 1.05 0.12 -0.79 4.33 4.06 -1.23 -2.13 115.95 121.37 1s7u h TRP 167 Ca 0.26 -0.07 -0.03 0.00 2.06 0.00 0.00 58.89 61.11 1s7u h TRP 167 Cb 0.13 -0.01 -0.04 0.00 -1.00 0.00 0.00 29.16 28.23 1s7u h TRP 167 CO 0.01 0.86 0.37 1.25 -3.56 0.00 0.00 178.44 177.37 1s7u h LEU 168 N 0.05 1.02 -0.50 -4.49 5.85 -0.86 -0.73 115.31 115.65 1s7u h LEU 168 Ca -0.02 -0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.59 1s7u h LEU 168 Cb 1.43 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 42.17 1s7u h LEU 168 CO 0.11 0.87 0.33 0.45 -0.34 0.00 0.00 178.44 179.86 1s7u h HIS 169 N 1.12 0.62 -0.91 1.25 3.86 -0.63 -0.76 115.15 119.69 1s7u h HIS 169 Ca 0.27 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.49 1s7u h HIS 169 Cb 0.12 -0.21 -0.04 0.00 1.06 0.00 0.00 27.41 28.34 1s7u h HIS 169 CO 0.01 0.38 0.56 -0.09 0.86 0.00 0.00 177.93 179.65 1s7u h ARG 170 N 0.66 1.24 -0.34 2.45 2.43 -1.04 -2.35 114.38 117.43 1s7u h ARG 170 Ca 0.19 -0.11 -0.16 0.00 -0.81 0.00 0.00 59.98 59.10 1s7u h ARG 170 Cb -0.05 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 29.23 1s7u h ARG 170 CO -0.05 0.86 -0.41 1.88 -1.51 0.00 0.00 179.97 180.74 1s7u h TYR 171 N 1.26 1.00 -0.45 2.20 0.05 -0.67 -2.07 116.97 118.28 1s7u h TYR 171 Ca 0.33 -0.31 -0.06 0.00 0.05 0.00 0.00 58.73 58.75 1s7u h TYR 171 Cb -0.06 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 37.44 1s7u h TYR 171 CO 0.00 1.10 0.05 -0.07 -1.05 0.00 0.00 178.16 178.19 1s7u h LEU 172 N 0.68 0.66 -0.26 3.88 3.38 -0.85 -1.27 115.31 121.53 1s7u h LEU 172 Ca 0.05 -0.13 -0.18 0.00 0.09 0.00 0.00 57.88 57.71 1s7u h LEU 172 Cb 0.98 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1s7u h LEU 172 CO 0.09 0.70 -0.54 0.11 0.09 0.00 0.00 178.44 178.90 1s7u h LYS 173 N 0.67 0.83 -0.09 1.13 1.57 -1.34 -3.21 116.57 116.13 1s7u h LYS 173 Ca 0.14 -0.54 -0.12 0.00 -1.87 0.00 0.00 60.65 58.26 1s7u h LYS 173 Cb 0.35 0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 1s7u h LYS 173 CO 0.01 1.17 -0.50 -0.91 -0.57 0.00 0.00 179.45 178.65 1s7u h ASN 174 N 0.59 0.25 -1.70 0.86 4.21 -0.86 -3.26 115.58 115.68 1s7u h ASN 174 Ca 0.01 -0.12 -0.58 0.00 1.21 0.00 0.00 56.30 56.81 1s7u h ASN 174 Cb 1.15 -0.07 -0.42 0.00 -1.12 0.00 0.00 38.32 37.86 1s7u h ASN 174 CO 0.12 0.71 -0.73 0.61 -1.29 0.00 0.00 177.43 176.85 1s7u n GLY 175 N 0.02 5.72 0.08 2.83 0.00 -0.53 -4.85 105.19 108.48 1s7u n GLY 175 Ca -0.02 -2.71 -0.08 0.00 0.00 0.00 0.00 46.02 43.21 1s7u n GLY 175 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1s7u h ASN 176 N 2.70 0.10 -0.68 1.61 7.08 -1.60 -3.07 115.58 121.71 1s7u h ASN 176 Ca 0.24 -0.09 -0.40 0.00 -3.08 0.00 0.00 56.30 52.97 1s7u h ASN 176 Cb 0.83 -0.03 -0.16 0.00 -2.08 0.00 0.00 38.32 36.88 1s7u h ASN 176 CO 0.83 1.02 0.44 0.00 -2.08 0.00 0.00 177.43 177.63 1s7u n ALA 177 N -2.40 5.61 0.00 4.14 0.00 -1.26 -3.52 120.51 123.08 1s7u n ALA 177 Ca -0.02 -2.19 0.00 0.00 0.00 0.00 0.00 53.44 51.23 1s7u n ALA 177 Cb 0.91 -1.63 0.00 0.00 0.00 0.00 0.00 19.45 18.72 1s7u n ALA 177 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1s7u n THR 178 N 0.43 0.00 -1.37 0.00 -1.04 -1.20 -4.95 114.28 106.16 1s7u n THR 178 Ca 0.38 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 62.46 1s7u n THR 178 Cb 0.58 0.00 0.12 0.00 -1.82 0.00 0.00 70.33 69.21 1s7u n THR 178 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1s7u n LEU 179 N -1.14 1.95 -0.02 -4.42 -0.00 -1.16 -4.61 117.00 107.59 1s7u n LEU 179 Ca 0.00 -2.82 -0.09 0.00 -0.00 0.00 0.00 56.01 53.11 1s7u n LEU 179 Cb 0.00 -0.35 -0.14 0.00 -0.00 0.00 0.00 43.42 42.93 1s7u n LEU 179 CO 0.00 0.73 -0.52 -0.11 -0.00 0.00 0.00 177.39 177.49 1s7u n LEU 180 N -1.07 0.91 -4.88 1.47 7.94 -1.23 -4.98 117.00 115.16 1s7u n LEU 180 Ca 0.13 0.42 -0.31 0.00 -1.11 0.00 0.00 56.01 55.14 1s7u n LEU 180 Cb 0.68 0.15 -0.05 0.00 0.53 0.00 0.00 43.42 44.73 1s7u n LEU 180 CO -0.00 0.39 0.17 0.00 -1.11 0.00 0.00 177.39 176.84 1s7u s ARG 181 N -2.60 3.74 0.12 1.96 1.70 -1.26 -5.10 118.95 117.50 1s7u s ARG 181 Ca -0.05 0.15 0.09 0.00 -0.47 0.00 0.00 55.73 55.45 1s7u s ARG 181 Cb 0.08 -2.70 -0.04 0.00 -0.57 0.00 0.00 34.95 31.72 1s7u s ARG 181 CO 0.82 0.34 -0.17 0.95 -1.08 0.00 0.00 175.30 176.17 1s7u s THR 182 N -1.81 2.93 -0.17 4.99 -4.23 -1.26 -4.89 115.64 111.20 1s7u s THR 182 Ca 0.45 -1.47 -0.08 0.00 -1.18 0.00 0.00 61.69 59.41 1s7u s THR 182 Cb -0.11 -2.35 -0.04 0.00 1.34 0.00 0.00 72.50 71.33 1s7u s THR 182 CO 0.23 0.10 0.09 -1.81 -0.54 0.00 0.00 174.62 172.68 1s7u s ASP 183 N -2.17 5.86 0.27 3.99 1.11 -0.22 -4.93 116.67 120.57 1s7u s ASP 183 Ca 0.19 0.18 -0.16 0.00 0.18 0.00 0.00 52.55 52.93 1s7u s ASP 183 Cb -0.11 -1.98 -0.08 0.00 1.07 0.00 0.00 42.92 41.82 1s7u s ASP 183 CO 0.11 0.22 0.71 -0.44 1.18 0.00 0.00 175.17 176.95 1s7u s SER 184 N 0.09 6.88 0.07 0.27 0.01 -1.26 -1.46 113.70 118.30 1s7u s SER 184 Ca 0.07 1.30 -0.31 0.00 1.31 0.00 0.00 55.95 58.32 1s7u s SER 184 Cb -0.12 -2.38 -0.08 0.00 0.21 0.00 0.00 66.02 63.65 1s7u s SER 184 CO 0.00 -0.09 1.60 -2.16 0.41 0.00 0.00 173.24 173.00 1s7u s PRO 185 N -2.52 4.22 -0.33 12.44 0.04 -1.26 -4.47 135.00 143.11 1s7u s PRO 185 Ca 0.48 2.27 -0.18 0.00 0.04 0.00 0.00 61.00 63.62 1s7u s PRO 185 Cb -0.13 -3.53 -0.01 0.00 0.04 0.00 0.00 34.50 30.87 1s7u s PRO 185 CO 0.19 -0.69 0.51 0.15 0.04 0.00 0.00 177.00 177.20 1s7u s LYS 186 N 2.37 3.73 0.14 4.56 1.02 -0.75 -4.90 119.74 125.90 1s7u s LYS 186 Ca 0.72 -0.05 0.09 0.00 0.02 0.00 0.00 55.97 56.74 1s7u s LYS 186 Cb -0.39 -3.77 -0.04 0.00 -0.52 0.00 0.00 37.83 33.11 1s7u s LYS 186 CO 0.31 -0.57 -0.13 0.00 -0.92 0.00 0.00 175.35 174.04 1s7u s ALA 187 N 2.37 2.84 0.20 5.17 0.00 -1.26 -1.79 121.76 129.28 1s7u s ALA 187 Ca 0.19 -1.38 -0.10 0.00 0.00 0.00 0.00 51.96 50.68 1s7u s ALA 187 Cb -0.15 -0.73 -0.01 0.00 0.00 0.00 0.00 23.12 22.23 1s7u s ALA 187 CO 0.12 0.56 0.34 -3.38 0.00 0.00 0.00 175.76 173.40 1s7u s HIS 188 N -1.37 0.45 -0.09 0.00 -3.43 -1.07 -5.00 115.29 104.78 1s7u s HIS 188 Ca 0.21 -0.80 0.04 0.00 -0.80 0.00 0.00 55.06 53.71 1s7u s HIS 188 Cb -0.10 -0.01 -0.01 0.00 -1.43 0.00 0.00 32.58 31.03 1s7u s HIS 188 CO 0.13 -0.81 -0.21 0.08 -2.00 0.00 0.00 174.74 171.93 1s7u s VAL 189 N -4.00 2.37 0.14 -5.38 1.01 -1.26 -1.16 120.40 112.11 1s7u s VAL 189 Ca 0.21 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.31 1s7u s VAL 189 Cb 0.02 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.45 1s7u s VAL 189 CO 0.04 0.56 0.06 0.42 0.00 0.00 0.00 175.10 176.18 1s7u s THR 190 N 0.09 4.20 -0.13 3.92 -4.23 -0.82 -4.85 115.64 113.82 1s7u s THR 190 Ca -0.10 -1.10 -0.01 0.00 -1.18 0.00 0.00 61.69 59.31 1s7u s THR 190 Cb -0.16 -3.09 -0.02 0.00 1.34 0.00 0.00 72.50 70.58 1s7u s THR 190 CO 0.06 -0.02 -0.11 -2.28 -0.54 0.00 0.00 174.62 171.73 1s7u s HIS 191 N -1.59 2.85 -0.09 3.99 2.46 -1.26 -2.21 115.29 119.44 1s7u s HIS 191 Ca 0.29 -0.51 -0.04 0.00 0.47 0.00 0.00 55.06 55.27 1s7u s HIS 191 Cb -0.11 -1.85 0.05 0.00 -0.13 0.00 0.00 32.58 30.54 1s7u s HIS 191 CO 0.21 -0.13 0.19 -1.01 -2.47 0.00 0.00 174.74 171.53 1s7u s HIS 192 N 0.23 -0.25 0.89 3.88 3.76 -0.78 -5.04 115.29 117.98 1s7u s HIS 192 Ca -0.07 0.68 -0.10 0.00 -0.15 0.00 0.00 55.06 55.42 1s7u s HIS 192 Cb -0.15 -0.12 0.13 0.00 1.11 0.00 0.00 32.58 33.55 1s7u s HIS 192 CO 0.05 -0.26 1.13 -2.14 -0.85 0.00 0.00 174.74 172.67 1s7u s PRO 193 N 1.87 1.24 0.00 8.40 0.02 -1.26 -0.22 135.00 145.06 1s7u s PRO 193 Ca -0.02 1.43 0.00 0.00 0.02 0.00 0.00 61.00 62.43 1s7u s PRO 193 Cb -0.12 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.64 1s7u s PRO 193 CO -0.07 -2.44 0.00 0.54 -0.33 0.00 0.00 177.00 174.70 1s7u n ARG 194 N -4.09 0.00 -3.40 5.54 5.12 -1.03 -4.53 116.66 114.26 1s7u n ARG 194 Ca 0.11 0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.90 1s7u n ARG 194 Cb 0.52 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.78 1s7u n ARG 194 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1s7u n SER 195 N -1.41 0.07 -4.68 0.55 3.41 -1.17 -5.05 113.62 105.36 1s7u n SER 195 Ca 0.00 -2.34 -0.45 0.00 -0.26 0.00 0.00 58.87 55.82 1s7u n SER 195 Cb 0.00 0.90 -0.04 0.00 -0.26 0.00 0.00 64.21 64.81 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 -0.45 2.49 -3.09 4.33 5.02 -1.26 -2.54 118.16 122.67 1s7u n LYS 196 Ca 0.02 0.91 -0.19 0.00 -2.02 0.00 0.00 58.31 57.03 1s7u n LYS 196 Cb 0.37 -2.79 0.04 0.00 -0.02 0.00 0.00 35.03 32.64 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 4.32 -0.30 3.50 0.72 0.00 -1.26 -5.01 105.19 107.16 1s7u n GLY 197 Ca 0.20 0.02 -0.11 0.00 0.00 0.00 0.00 46.02 46.13 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 -5.73 0.65 0.01 1.61 2.02 -1.05 -2.43 118.70 113.78 1s7u s GLU 198 Ca 0.34 0.93 0.02 0.00 0.02 0.00 0.00 54.97 56.28 1s7u s GLU 198 Cb -0.15 0.23 -0.01 0.00 0.10 0.00 0.00 34.13 34.30 1s7u s GLU 198 CO 0.42 -0.11 -0.06 0.14 0.02 0.00 0.00 175.26 175.67 1s7u s VAL 199 N 0.82 0.49 0.04 2.63 -7.23 -0.56 -2.47 120.40 114.12 1s7u s VAL 199 Ca -0.04 -0.46 -0.29 0.00 -1.81 0.00 0.00 61.98 59.39 1s7u s VAL 199 Cb -0.05 -0.45 -0.04 0.00 0.56 0.00 0.00 36.38 36.40 1s7u s VAL 199 CO -0.07 0.01 0.91 -0.89 -0.31 0.00 0.00 175.10 174.75 1s7u s THR 200 N -0.44 4.74 -0.25 5.32 2.01 0.70 -2.98 115.64 124.74 1s7u s THR 200 Ca -0.01 1.94 -0.05 0.00 0.31 0.00 0.00 61.69 63.88 1s7u s THR 200 Cb -0.04 -4.26 -0.01 0.00 0.01 0.00 0.00 72.50 68.20 1s7u s THR 200 CO -0.00 0.25 0.02 -0.76 -0.69 0.00 0.00 174.62 173.44 1s7u s LEU 201 N 0.48 3.28 -0.37 4.42 1.43 -1.16 -1.87 118.68 124.89 1s7u s LEU 201 Ca 0.47 -0.42 -0.07 0.00 -1.03 0.00 0.00 54.13 53.08 1s7u s LEU 201 Cb -0.21 -1.83 0.06 0.00 0.03 0.00 0.00 46.19 44.24 1s7u s LEU 201 CO 0.27 -0.07 0.16 -0.60 0.23 0.00 0.00 176.35 176.34 1s7u s ARG 202 N 1.52 2.56 -0.35 1.70 3.52 -0.94 -2.61 118.95 124.36 1s7u s ARG 202 Ca 0.05 -1.32 -0.29 0.00 -0.13 0.00 0.00 55.73 54.04 1s7u s ARG 202 Cb -0.15 -3.57 0.02 0.00 -1.56 0.00 0.00 34.95 29.69 1s7u s ARG 202 CO 0.00 -0.79 1.06 0.00 -0.81 0.00 0.00 175.30 174.77 1s7u s TRP 204 N 3.73 3.58 -0.10 0.00 0.52 -0.31 -1.75 118.94 124.61 1s7u s TRP 204 Ca 0.45 0.46 0.02 0.00 0.02 0.00 0.00 56.10 57.05 1s7u s TRP 204 Cb -0.11 -1.90 0.01 0.00 -1.15 0.00 0.00 33.47 30.32 1s7u s TRP 204 CO 0.18 0.68 -0.14 0.00 0.02 0.00 0.00 176.95 177.69 1s7u s ALA 205 N -1.19 1.56 0.07 0.98 0.00 -0.12 -2.59 121.76 120.47 1s7u s ALA 205 Ca 0.22 -0.64 0.03 0.00 0.00 0.00 0.00 51.96 51.57 1s7u s ALA 205 Cb -0.12 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.20 1s7u s ALA 205 CO 0.12 -0.03 -0.08 -0.51 0.00 0.00 0.00 175.76 175.25 1s7u s LEU 206 N 0.93 2.37 -0.88 0.00 1.43 -0.74 -2.10 118.68 119.69 1s7u s LEU 206 Ca -0.08 -0.75 -0.01 0.00 -1.03 0.00 0.00 54.13 52.26 1s7u s LEU 206 Cb -0.15 -0.20 0.00 0.00 0.03 0.00 0.00 46.19 45.87 1s7u s LEU 206 CO -0.00 -0.28 0.09 0.61 0.23 0.00 0.00 176.35 176.99 1s7u n GLY 207 N 0.79 -0.03 3.68 -3.19 0.00 -1.08 -1.81 105.19 103.55 1s7u n GLY 207 Ca -0.18 -0.40 -0.30 0.00 0.00 0.00 0.00 46.02 45.13 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 -2.62 2.99 -0.16 1.61 -0.12 -1.21 -4.35 117.98 114.12 1s7u s PHE 208 Ca 0.04 -0.02 -0.11 0.00 -0.05 0.00 0.00 56.93 56.79 1s7u s PHE 208 Cb -0.02 -1.54 0.05 0.00 -0.63 0.00 0.00 43.02 40.88 1s7u s PHE 208 CO 0.05 0.48 0.39 -0.47 -0.05 0.00 0.00 175.22 175.63 1s7u s TYR 209 N -1.30 -0.51 0.96 3.49 5.04 -0.54 -1.25 117.35 123.25 1s7u s TYR 209 Ca 0.25 1.15 -0.16 0.00 -2.44 0.00 0.00 57.07 55.87 1s7u s TYR 209 Cb -0.12 0.20 0.23 0.00 0.35 0.00 0.00 41.96 42.62 1s7u s TYR 209 CO 0.18 -0.27 1.18 -0.35 -1.34 0.00 0.00 175.55 174.95 1s7u n PRO 210 N 3.60 -1.63 0.26 4.97 -0.04 -1.26 -1.05 135.00 139.84 1s7u n PRO 210 Ca -0.19 -1.84 0.16 0.00 -0.04 0.00 0.00 63.50 61.60 1s7u n PRO 210 Cb 0.56 -1.33 0.63 0.00 -0.04 0.00 0.00 33.50 33.32 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 -2.02 1.00 -2.41 0.55 0.00 -1.97 -3.44 119.26 110.97 1s7u h ALA 211 Ca -0.40 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 53.98 1s7u h ALA 211 Cb 1.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1s7u h ALA 211 CO 0.27 0.00 0.81 -0.51 0.00 0.00 0.00 179.25 179.82 1s7u s ASP 212 N -5.56 6.84 0.16 0.00 1.11 -1.26 -4.98 116.67 112.98 1s7u s ASP 212 Ca 0.02 2.17 -0.23 0.00 0.18 0.00 0.00 52.55 54.68 1s7u s ASP 212 Cb 0.09 -2.57 0.07 0.00 1.07 0.00 0.00 42.92 41.58 1s7u s ASP 212 CO 0.54 -0.70 0.67 -0.51 1.18 0.00 0.00 175.17 176.34 1s7u s ILE 213 N 2.11 0.00 -0.01 0.77 2.07 -1.26 -4.66 121.20 120.21 1s7u s ILE 213 Ca 0.64 -0.18 0.00 0.00 -1.41 0.00 0.00 60.65 59.70 1s7u s ILE 213 Cb -0.33 -1.19 0.02 0.00 0.13 0.00 0.00 42.46 41.08 1s7u s ILE 213 CO 0.28 0.00 0.00 -0.89 -1.91 0.00 0.00 174.94 172.42 1s7u s THR 214 N -3.68 0.07 -0.10 4.00 2.01 -0.76 -4.99 115.64 112.18 1s7u s THR 214 Ca 0.03 0.06 0.03 0.00 0.31 0.00 0.00 61.69 62.13 1s7u s THR 214 Cb -0.02 -0.13 -0.00 0.00 0.01 0.00 0.00 72.50 72.36 1s7u s THR 214 CO -0.09 0.08 -0.22 -0.76 -0.69 0.00 0.00 174.62 172.94 1s7u s LEU 215 N 0.56 2.20 0.05 4.42 1.02 -1.26 -1.41 118.68 124.25 1s7u s LEU 215 Ca -0.05 -0.52 0.05 0.00 0.02 0.00 0.00 54.13 53.63 1s7u s LEU 215 Cb -0.07 -1.44 -0.02 0.00 0.02 0.00 0.00 46.19 44.67 1s7u s LEU 215 CO -0.01 0.16 -0.14 0.42 0.02 0.00 0.00 176.35 176.80 1s7u s THR 216 N 0.33 1.08 -0.04 5.49 -4.23 -1.04 -5.00 115.64 112.23 1s7u s THR 216 Ca -0.17 -1.05 0.03 0.00 -1.18 0.00 0.00 61.69 59.31 1s7u s THR 216 Cb -0.18 -0.99 -0.03 0.00 1.34 0.00 0.00 72.50 72.64 1s7u s THR 216 CO 0.08 -0.06 -0.10 0.26 -0.54 0.00 0.00 174.62 174.27 1s7u s TRP 217 N -0.95 2.83 0.02 3.99 0.52 -1.26 -1.87 118.94 122.21 1s7u s TRP 217 Ca 0.00 -0.07 0.04 0.00 0.02 0.00 0.00 56.10 56.10 1s7u s TRP 217 Cb -0.08 -1.64 -0.02 0.00 -1.15 0.00 0.00 33.47 30.58 1s7u s TRP 217 CO 0.01 0.29 -0.12 -0.65 0.02 0.00 0.00 176.95 176.50 1s7u s GLN 218 N -0.97 0.87 -0.94 4.98 -0.21 -0.32 -2.41 119.66 120.66 1s7u s GLN 218 Ca 0.13 -0.60 -0.03 0.00 0.02 0.00 0.00 55.36 54.89 1s7u s GLN 218 Cb -0.11 -0.84 0.24 0.00 1.00 0.00 0.00 33.01 33.30 1s7u s GLN 218 CO 0.03 0.22 0.90 -0.11 -2.12 0.00 0.00 175.29 174.20 1s7u n LEU 219 N 2.26 4.59 -3.70 2.90 7.94 -1.12 -2.31 117.00 127.57 1s7u n LEU 219 Ca -0.17 -5.14 -0.17 0.00 -1.11 0.00 0.00 56.01 49.43 1s7u n LEU 219 Cb 0.55 -1.16 0.01 0.00 0.53 0.00 0.00 43.42 43.35 1s7u n LEU 219 CO 0.23 1.56 -0.07 -0.46 -1.11 0.00 0.00 177.39 177.54 1s7u n ASN 220 N 2.23 -1.66 0.00 1.96 0.23 -1.21 -4.18 115.26 112.63 1s7u n ASN 220 Ca 0.23 -0.49 0.00 0.00 -0.53 0.00 0.00 54.58 53.79 1s7u n ASN 220 Cb 0.37 -0.62 0.00 0.00 -2.08 0.00 0.00 39.78 37.45 1s7u n ASN 220 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1s7u n GLY 221 N -1.30 -0.68 3.93 4.83 0.00 -1.26 -5.15 105.19 105.56 1s7u n GLY 221 Ca -0.06 0.25 -0.25 0.00 0.00 0.00 0.00 46.02 45.96 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 3.23 0.75 1.61 8.01 -1.26 -5.04 118.70 126.00 1s7u s GLU 222 Ca 0.00 -0.13 -0.13 0.00 0.01 0.00 0.00 54.97 54.72 1s7u s GLU 222 Cb 0.00 -2.44 0.18 0.00 -4.31 0.00 0.00 34.13 27.56 1s7u s GLU 222 CO 0.00 -0.31 0.96 0.39 0.01 0.00 0.00 175.26 176.31 1s7u n GLU 223 N -2.23 -1.23 -3.59 1.61 1.02 -1.26 -2.78 120.64 112.18 1s7u n GLU 223 Ca 0.01 -1.48 -0.29 0.00 -0.02 0.00 0.00 57.16 55.38 1s7u n GLU 223 Cb 0.57 -1.05 -0.15 0.00 -0.02 0.00 0.00 31.44 30.79 1s7u n GLU 223 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1s7u s LEU 224 N 0.00 0.87 0.00 -4.62 2.01 -1.01 -4.79 118.68 111.14 1s7u s LEU 224 Ca 0.55 -1.29 0.25 0.00 0.01 0.00 0.00 54.13 53.66 1s7u s LEU 224 Cb -0.02 -0.45 0.54 0.00 0.01 0.00 0.00 46.19 46.27 1s7u s LEU 224 CO 0.39 -0.42 1.43 0.41 1.01 0.00 0.00 176.35 179.17 1s7u n THR 225 N 5.17 0.00 -1.71 5.49 -1.04 -1.26 -4.45 114.28 116.47 1s7u n THR 225 Ca -0.05 -0.08 -0.17 0.00 -2.04 0.00 0.00 64.05 61.70 1s7u n THR 225 Cb 0.43 0.45 -0.08 0.00 -1.82 0.00 0.00 70.33 69.31 1s7u n THR 225 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1s7u s GLN 226 N -2.71 1.70 -1.42 -2.82 -0.44 -1.26 -3.90 119.66 108.81 1s7u s GLN 226 Ca 0.18 -0.11 -0.08 0.00 -2.50 0.00 0.00 55.36 52.86 1s7u s GLN 226 Cb 0.18 -4.94 0.01 0.00 -1.64 0.00 0.00 33.01 26.62 1s7u s GLN 226 CO 0.61 -4.58 0.31 -0.25 0.50 0.00 0.00 175.29 171.88 1s7u n ASP 227 N 17.83 -0.77 -4.68 6.67 8.00 -1.26 -4.89 116.55 137.44 1s7u n ASP 227 Ca 0.44 -1.18 -0.42 0.00 0.71 0.00 0.00 54.79 54.33 1s7u n ASP 227 Cb 0.45 -2.19 -0.03 0.00 -0.02 0.00 0.00 41.12 39.33 1s7u n ASP 227 CO 0.00 0.00 0.00 -0.32 -0.39 0.00 0.00 177.20 176.49 1s7u s MET 228 N -7.03 4.29 0.18 -1.24 1.75 -1.25 -4.80 119.30 111.19 1s7u s MET 228 Ca 0.12 1.79 -0.30 0.00 -1.25 0.00 0.00 55.69 56.05 1s7u s MET 228 Cb -0.06 -3.65 -0.08 0.00 2.84 0.00 0.00 34.83 33.88 1s7u s MET 228 CO 0.95 -0.58 1.03 -1.21 -0.65 0.00 0.00 175.02 174.55 1s7u s GLU 229 N 2.76 4.69 0.28 4.11 2.02 -0.51 -4.93 118.70 127.12 1s7u s GLU 229 Ca 0.59 1.60 -0.12 0.00 0.02 0.00 0.00 54.97 57.06 1s7u s GLU 229 Cb -0.26 -3.30 0.00 0.00 0.10 0.00 0.00 34.13 30.67 1s7u s GLU 229 CO 0.22 0.22 0.52 -0.48 0.02 0.00 0.00 175.26 175.76 1s7u s LEU 230 N -0.53 0.37 0.18 1.80 0.05 -1.26 -0.32 118.68 118.97 1s7u s LEU 230 Ca 0.46 -1.03 0.08 0.00 0.05 0.00 0.00 54.13 53.69 1s7u s LEU 230 Cb -0.27 1.88 -0.04 0.00 -2.05 0.00 0.00 46.19 45.71 1s7u s LEU 230 CO 0.33 -1.24 -0.16 0.68 -0.55 0.00 0.00 176.35 175.42 1s7u s VAL 231 N -3.68 1.70 0.38 1.48 -7.23 -1.06 -5.01 120.40 106.99 1s7u s VAL 231 Ca 0.22 -2.02 -0.27 0.00 -1.81 0.00 0.00 61.98 58.10 1s7u s VAL 231 Cb -0.01 -1.89 -0.09 0.00 0.56 0.00 0.00 36.38 34.95 1s7u s VAL 231 CO 0.11 -0.46 1.31 -1.83 -0.31 0.00 0.00 175.10 173.92 1s7u s GLU 232 N -3.16 4.09 0.36 4.82 1.03 -1.26 -4.64 118.70 119.94 1s7u s GLU 232 Ca 0.18 2.18 -0.28 0.00 0.03 0.00 0.00 54.97 57.08 1s7u s GLU 232 Cb -0.03 -2.86 -0.11 0.00 -0.80 0.00 0.00 34.13 30.33 1s7u s GLU 232 CO 0.06 -0.40 1.50 2.41 -1.33 0.00 0.00 175.26 177.50 1s7u n THR 233 N 0.34 1.84 -4.00 1.83 -1.04 -1.26 -4.88 114.28 107.11 1s7u n THR 233 Ca 0.02 -0.46 -0.12 0.00 -2.04 0.00 0.00 64.05 61.45 1s7u n THR 233 Cb 0.43 -1.96 -0.13 0.00 -1.82 0.00 0.00 70.33 66.85 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 -1.83 0.28 0.04 -2.82 1.70 -0.77 -4.98 118.95 110.57 1s7u s ARG 234 Ca 0.55 -0.34 -0.30 0.00 -0.47 0.00 0.00 55.73 55.17 1s7u s ARG 234 Cb -0.48 -0.12 -0.05 0.00 -0.57 0.00 0.00 34.95 33.73 1s7u s ARG 234 CO 0.61 0.02 1.08 -1.25 -1.08 0.00 0.00 175.30 174.69 1s7u s PRO 235 N -0.69 4.51 0.41 3.89 0.04 -1.26 -0.55 135.00 141.34 1s7u s PRO 235 Ca -0.05 1.59 0.09 0.00 0.04 0.00 0.00 61.00 62.67 1s7u s PRO 235 Cb -0.05 -3.40 0.87 0.00 0.04 0.00 0.00 34.50 31.97 1s7u s PRO 235 CO -0.00 -0.12 2.00 0.00 0.04 0.00 0.00 177.00 178.91 1s7u h ALA 236 N 6.65 1.64 0.00 8.56 0.00 -1.64 -3.47 119.26 131.00 1s7u h ALA 236 Ca -0.42 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1s7u h ALA 236 Cb 1.22 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1s7u h ALA 236 CO 0.77 0.28 0.00 0.41 0.00 0.00 0.00 179.25 180.71 1s7u n GLY 237 N -1.19 0.57 1.10 0.00 0.00 -1.26 -4.93 105.19 99.48 1s7u n GLY 237 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 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 4.10 0.00 1.61 5.68 -1.26 -4.94 116.55 121.73 1s7u n ASP 238 Ca 0.00 -2.69 0.00 0.00 -0.50 0.00 0.00 54.79 51.60 1s7u n ASP 238 Cb 0.00 -0.50 0.00 0.00 -1.14 0.00 0.00 41.12 39.48 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 0.16 0.96 3.80 6.12 0.00 -1.26 -5.07 105.19 109.90 1s7u n GLY 239 Ca 0.21 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.02 1s7u n GLY 239 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1s7u n THR 240 N -2.00 0.00 -4.26 2.61 -2.24 -1.26 -4.85 114.28 102.28 1s7u n THR 240 Ca 0.00 -1.97 -0.14 0.00 -2.27 0.00 0.00 64.05 59.67 1s7u n THR 240 Cb 0.00 -0.37 -0.10 0.00 -2.10 0.00 0.00 70.33 67.76 1s7u n THR 240 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1s7u s PHE 241 N -2.57 1.29 0.08 4.78 0.40 -0.38 -1.69 117.98 119.88 1s7u s PHE 241 Ca 0.50 -1.09 0.02 0.00 -0.60 0.00 0.00 56.93 55.77 1s7u s PHE 241 Cb -0.04 -0.74 -0.03 0.00 0.51 0.00 0.00 43.02 42.72 1s7u s PHE 241 CO 0.32 -0.28 -0.08 -0.65 0.70 0.00 0.00 175.22 175.23 1s7u s GLN 242 N -3.96 0.72 -0.14 0.44 -0.21 0.28 -2.63 119.66 114.16 1s7u s GLN 242 Ca 0.29 -1.07 -0.29 0.00 0.02 0.00 0.00 55.36 54.31 1s7u s GLN 242 Cb 0.07 -0.33 0.08 0.00 1.00 0.00 0.00 33.01 33.83 1s7u s GLN 242 CO 0.07 0.04 0.75 0.21 -2.12 0.00 0.00 175.29 174.24 1s7u s LYS 243 N -2.70 0.90 0.07 2.91 2.20 -0.89 -1.84 119.74 120.38 1s7u s LYS 243 Ca 0.02 0.47 0.02 0.00 -0.36 0.00 0.00 55.97 56.12 1s7u s LYS 243 Cb -0.03 0.43 -0.03 0.00 -1.51 0.00 0.00 37.83 36.69 1s7u s LYS 243 CO -0.02 -0.23 -0.08 1.67 -0.36 0.00 0.00 175.35 176.34 1s7u s TRP 244 N -0.66 0.81 0.05 4.03 1.48 -1.26 -0.95 118.94 122.43 1s7u s TRP 244 Ca -0.06 -0.67 0.03 0.00 -1.06 0.00 0.00 56.10 54.34 1s7u s TRP 244 Cb -0.02 -0.47 -0.02 0.00 -1.16 0.00 0.00 33.47 31.80 1s7u s TRP 244 CO 0.05 -0.10 -0.10 0.00 -4.06 0.00 0.00 176.95 172.75 1s7u s ALA 245 N -2.33 0.76 0.11 2.67 0.00 -0.72 -2.55 121.76 119.70 1s7u s ALA 245 Ca -0.00 -0.79 -0.06 0.00 0.00 0.00 0.00 51.96 51.11 1s7u s ALA 245 Cb -0.03 -0.02 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 1s7u s ALA 245 CO -0.02 0.06 0.15 -1.54 0.00 0.00 0.00 175.76 174.41 1s7u s SER 246 N -1.48 0.20 0.05 0.00 1.04 0.57 -0.15 113.70 113.93 1s7u s SER 246 Ca -0.06 -0.90 -0.02 0.00 0.48 0.00 0.00 55.95 55.45 1s7u s SER 246 Cb -0.09 0.33 -0.03 0.00 0.10 0.00 0.00 66.02 66.33 1s7u s SER 246 CO 0.01 -0.76 -0.01 0.68 0.98 0.00 0.00 173.24 174.14 1s7u s VAL 247 N -3.95 0.20 -0.09 5.02 -7.23 -1.07 -1.42 120.40 111.87 1s7u s VAL 247 Ca 0.13 -1.66 -0.24 0.00 -1.81 0.00 0.00 61.98 58.40 1s7u s VAL 247 Cb 0.06 -1.37 -0.03 0.00 0.56 0.00 0.00 36.38 35.59 1s7u s VAL 247 CO -0.05 -0.92 0.74 0.68 -0.31 0.00 0.00 175.10 175.25 1s7u s VAL 248 N -3.65 5.00 -0.05 1.32 -7.23 -1.26 -3.01 120.40 111.52 1s7u s VAL 248 Ca 0.04 1.51 -0.04 0.00 -1.81 0.00 0.00 61.98 61.69 1s7u s VAL 248 Cb 0.06 -4.07 0.02 0.00 0.56 0.00 0.00 36.38 32.94 1s7u s VAL 248 CO -0.09 0.19 0.12 -0.69 -0.31 0.00 0.00 175.10 174.32 1s7u s VAL 249 N 1.15 -0.01 0.41 1.32 1.01 -1.16 -5.03 120.40 118.08 1s7u s VAL 249 Ca 0.38 0.05 -0.27 0.00 0.00 0.00 0.00 61.98 62.14 1s7u s VAL 249 Cb -0.18 -0.18 -0.10 0.00 0.00 0.00 0.00 36.38 35.93 1s7u s VAL 249 CO 0.17 0.02 1.45 -2.16 0.00 0.00 0.00 175.10 174.58 1s7u s PRO 250 N 0.34 3.91 -0.07 2.72 0.04 -1.26 -1.49 135.00 139.19 1s7u s PRO 250 Ca -0.02 2.48 -0.30 0.00 0.04 0.00 0.00 61.00 63.19 1s7u s PRO 250 Cb -0.04 -2.82 -0.03 0.00 0.04 0.00 0.00 34.50 31.65 1s7u s PRO 250 CO -0.01 -0.66 1.26 -1.17 0.04 0.00 0.00 177.00 176.46 1s7u s LEU 251 N -2.39 4.27 0.00 -3.56 0.20 -1.02 -2.90 118.68 113.28 1s7u s LEU 251 Ca 0.57 1.85 0.00 0.00 0.69 0.00 0.00 54.13 57.23 1s7u s LEU 251 Cb -0.45 -3.55 0.00 0.00 -0.43 0.00 0.00 46.19 41.76 1s7u s LEU 251 CO 0.59 -0.65 0.00 0.61 -0.29 0.00 0.00 176.35 176.61 1s7u n GLY 252 N 3.48 1.92 2.34 7.98 0.00 -1.26 -4.92 105.19 114.74 1s7u n GLY 252 Ca 0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.82 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 -0.03 3.00 -0.09 1.61 4.76 -1.14 -4.69 118.16 121.59 1s7u n LYS 253 Ca 0.00 -3.65 0.12 0.00 -2.87 0.00 0.00 58.31 51.91 1s7u n LYS 253 Cb 0.00 -2.28 0.15 0.00 -1.84 0.00 0.00 35.03 31.06 1s7u n LYS 253 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1s7u n GLU 254 N -0.78 2.38 0.05 1.97 0.28 -1.26 -3.92 120.64 119.37 1s7u n GLU 254 Ca 0.55 -2.09 0.04 0.00 -0.16 0.00 0.00 57.16 55.51 1s7u n GLU 254 Cb 0.68 -1.48 -0.06 0.00 1.43 0.00 0.00 31.44 32.01 1s7u n GLU 254 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1s7u n GLN 255 N 1.40 0.62 -0.06 3.44 1.13 -1.26 -4.02 117.38 118.63 1s7u n GLN 255 Ca 0.16 0.16 0.01 0.00 -1.94 0.00 0.00 57.00 55.39 1s7u n GLN 255 Cb 0.60 -1.79 0.04 0.00 0.11 0.00 0.00 30.24 29.19 1s7u n GLN 255 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 1s7u n ASN 256 N -2.78 0.83 -4.42 1.08 2.04 -1.25 -4.73 115.26 106.03 1s7u n ASN 256 Ca -0.07 -2.04 -0.33 0.00 -0.44 0.00 0.00 54.58 51.71 1s7u n ASN 256 Cb 0.73 -0.23 -0.14 0.00 -2.53 0.00 0.00 39.78 37.61 1s7u n ASN 256 CO 0.00 0.00 0.00 -0.31 -0.44 0.00 0.00 177.26 176.51 1s7u s TYR 257 N -1.62 2.84 0.02 -2.53 2.02 -1.26 -3.32 117.35 113.50 1s7u s TYR 257 Ca 0.05 -0.48 0.05 0.00 -0.37 0.00 0.00 57.07 56.33 1s7u s TYR 257 Cb 0.03 -1.82 -0.02 0.00 -0.40 0.00 0.00 41.96 39.75 1s7u s TYR 257 CO 0.03 -0.09 -0.16 0.95 -1.57 0.00 0.00 175.55 174.70 1s7u s THR 258 N 0.13 1.26 -0.09 -0.71 -4.23 -0.98 -4.71 115.64 106.31 1s7u s THR 258 Ca -0.05 -0.90 0.01 0.00 -1.18 0.00 0.00 61.69 59.57 1s7u s THR 258 Cb -0.15 -1.10 -0.02 0.00 1.34 0.00 0.00 72.50 72.57 1s7u s THR 258 CO 0.04 0.19 -0.10 0.00 -0.54 0.00 0.00 174.62 174.20 1s7u s ARG 260 N -0.27 2.43 -0.19 0.00 0.52 -0.78 -1.84 118.95 118.81 1s7u s ARG 260 Ca 0.03 -0.84 -0.01 0.00 -0.52 0.00 0.00 55.73 54.38 1s7u s ARG 260 Cb -0.13 -2.20 0.00 0.00 0.52 0.00 0.00 34.95 33.14 1s7u s ARG 260 CO 0.03 0.50 -0.12 0.08 0.02 0.00 0.00 175.30 175.81 1s7u s VAL 261 N -0.45 2.81 -0.32 3.52 1.01 -0.95 -2.49 120.40 123.53 1s7u s VAL 261 Ca 0.05 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.27 1s7u s VAL 261 Cb -0.12 -2.23 0.03 0.00 0.00 0.00 0.00 36.38 34.07 1s7u s VAL 261 CO 0.01 0.49 0.09 -0.31 0.00 0.00 0.00 175.10 175.37 1s7u s TYR 262 N 1.18 3.21 0.04 5.22 1.51 -0.50 -2.32 117.35 125.70 1s7u s TYR 262 Ca 0.02 -1.31 -0.06 0.00 -1.01 0.00 0.00 57.07 54.71 1s7u s TYR 262 Cb -0.14 -2.25 -0.01 0.00 -0.11 0.00 0.00 41.96 39.44 1s7u s TYR 262 CO -0.05 -0.69 0.10 -1.58 -1.11 0.00 0.00 175.55 172.23 1s7u s HIS 263 N 1.42 0.21 0.05 2.71 2.46 -1.26 -1.82 115.29 119.06 1s7u s HIS 263 Ca -0.00 -0.53 0.18 0.00 0.47 0.00 0.00 55.06 55.17 1s7u s HIS 263 Cb -0.19 -0.15 0.47 0.00 -0.13 0.00 0.00 32.58 32.59 1s7u s HIS 263 CO 0.02 -0.38 1.63 1.05 -2.47 0.00 0.00 174.74 174.59 1s7u h GLU 264 N 3.57 0.00 0.00 2.88 4.11 -1.95 -2.72 114.58 120.46 1s7u h GLU 264 Ca -0.33 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.07 1s7u h GLU 264 Cb 1.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.43 1s7u h GLU 264 CO 0.52 0.42 -0.14 0.78 0.07 0.00 0.00 179.01 180.66 1s7u h GLY 265 N 2.58 0.00 -3.91 1.06 0.00 -1.88 -3.45 103.07 97.47 1s7u h GLY 265 Ca -0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 1s7u h GLY 265 CO 0.06 0.00 0.61 1.08 0.00 0.00 0.00 176.54 178.29 1s7u s LEU 266 N -6.58 4.45 0.36 3.11 1.02 -1.03 -4.82 118.68 115.19 1s7u s LEU 266 Ca 0.01 2.58 0.15 0.00 0.02 0.00 0.00 54.13 56.90 1s7u s LEU 266 Cb 0.10 -3.64 0.68 0.00 0.02 0.00 0.00 46.19 43.35 1s7u s LEU 266 CO 0.60 -0.46 1.76 1.55 0.02 0.00 0.00 176.35 179.82 1s7u h PRO 267 N 3.70 0.00 -3.14 1.29 0.13 -1.87 -3.47 132.00 128.65 1s7u h PRO 267 Ca -0.48 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1s7u h PRO 267 Cb 1.22 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 32.25 1s7u h PRO 267 CO 0.67 0.41 0.13 -1.83 -0.23 0.00 0.00 178.00 177.16 1s7u s GLU 268 N -3.85 1.41 0.21 0.86 -1.05 -1.26 -5.14 118.70 109.88 1s7u s GLU 268 Ca -0.01 -0.74 -0.32 0.00 -0.15 0.00 0.00 54.97 53.75 1s7u s GLU 268 Cb 0.13 0.56 -0.12 0.00 -0.44 0.00 0.00 34.13 34.26 1s7u s GLU 268 CO 0.71 -0.61 1.72 -2.14 0.95 0.00 0.00 175.26 175.88 1s7u s PRO 269 N -3.83 4.12 0.40 -4.83 0.02 -1.26 -4.94 135.00 124.68 1s7u s PRO 269 Ca 0.06 2.61 -0.25 0.00 0.02 0.00 0.00 61.00 63.44 1s7u s PRO 269 Cb -0.02 -3.07 -0.08 0.00 0.02 0.00 0.00 34.50 31.35 1s7u s PRO 269 CO -0.05 -0.75 1.17 -0.51 -0.33 0.00 0.00 177.00 176.53 1s7u s LEU 270 N 1.08 4.19 0.05 -5.54 1.43 -0.98 -4.87 118.68 114.05 1s7u s LEU 270 Ca 0.74 2.34 0.08 0.00 -1.03 0.00 0.00 54.13 56.26 1s7u s LEU 270 Cb -0.50 -4.02 -0.03 0.00 0.03 0.00 0.00 46.19 41.67 1s7u s LEU 270 CO 0.33 -0.67 -0.21 -0.89 0.23 0.00 0.00 176.35 175.14 1s7u s THR 271 N -1.42 2.55 -0.16 5.49 2.01 -1.26 -2.23 115.64 120.61 1s7u s THR 271 Ca 0.57 -1.31 -0.28 0.00 0.31 0.00 0.00 61.69 60.98 1s7u s THR 271 Cb -0.30 -2.06 0.08 0.00 0.01 0.00 0.00 72.50 70.23 1s7u s THR 271 CO 0.38 0.32 0.77 -0.76 -0.69 0.00 0.00 174.62 174.64 1s7u s LEU 272 N -1.45 -0.63 0.00 4.42 1.43 -0.77 -5.00 118.68 116.68 1s7u s LEU 272 Ca 0.14 0.94 0.07 0.00 -1.03 0.00 0.00 54.13 54.25 1s7u s LEU 272 Cb -0.10 2.36 -0.03 0.00 0.03 0.00 0.00 46.19 48.45 1s7u s LEU 272 CO 0.05 -0.40 0.27 0.54 0.23 0.00 0.00 176.35 177.03 1s7u n ARG 273 N 1.64 0.39 0.00 1.70 1.74 -1.26 -1.19 116.66 119.68 1s7u n ARG 273 Ca -0.15 -3.14 0.00 0.00 -0.77 0.00 0.00 57.85 53.79 1s7u n ARG 273 Cb 0.56 2.59 0.00 0.00 -1.02 0.00 0.00 32.46 34.59 1s7u n ARG 273 CO 0.00 0.00 0.00 1.87 -1.52 0.00 0.00 177.63 177.98