#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u6s s THR -9 N 0.00 5.26 0.08 1.12 2.01 -1.26 -5.09 115.64 117.76 1u6s s THR -9 Ca 0.00 0.12 -0.30 0.00 0.31 0.00 0.00 61.69 61.81 1u6s s THR -9 Cb 0.00 -3.28 -0.05 0.00 0.01 0.00 0.00 72.50 69.18 1u6s s THR -9 CO 0.00 0.61 1.01 -0.70 -0.69 0.00 0.00 174.62 174.85 1u6s s GLU -8 N -0.91 4.61 0.25 4.92 2.12 -1.26 -5.01 118.70 123.43 1u6s s GLU -8 Ca 0.14 1.51 -0.31 0.00 0.36 0.00 0.00 54.97 56.68 1u6s s GLU -8 Cb -0.12 -3.39 -0.11 0.00 0.26 0.00 0.00 34.13 30.78 1u6s s GLU -8 CO 0.03 0.06 1.57 0.42 -0.54 0.00 0.00 175.26 176.80 1u6s s ILE -7 N 0.41 2.30 0.66 -3.70 1.01 -1.26 -4.98 121.20 115.64 1u6s s ILE -7 Ca 0.50 0.24 -0.14 0.00 0.00 0.00 0.00 60.65 61.25 1u6s s ILE -7 Cb -0.24 -3.15 -0.00 0.00 0.01 0.00 0.00 42.46 39.08 1u6s s ILE -7 CO 0.30 0.03 1.08 0.00 0.00 0.00 0.00 174.94 176.35 1u6s s ALA -6 N 0.37 2.56 -0.12 9.38 0.00 -1.26 -5.06 121.76 127.64 1u6s s ALA -6 Ca 0.65 0.38 0.02 0.00 0.00 0.00 0.00 51.96 53.02 1u6s s ALA -6 Cb -0.46 -3.26 -0.00 0.00 0.00 0.00 0.00 23.12 19.40 1u6s s ALA -6 CO 0.41 -1.18 -0.20 0.99 0.00 0.00 0.00 175.76 175.78 1u6s s THR -5 N -2.57 2.38 0.40 0.00 2.01 -1.26 -5.13 115.64 111.47 1u6s s THR -5 Ca 0.64 -0.90 -0.01 0.00 0.31 0.00 0.00 61.69 61.73 1u6s s THR -5 Cb -0.17 -1.95 -0.02 0.00 0.01 0.00 0.00 72.50 70.36 1u6s s THR -5 CO 0.44 0.55 0.63 0.28 -0.69 0.00 0.00 174.62 175.83 1u6s s THR -4 N 0.41 4.75 -0.01 -0.82 -1.32 -1.26 -5.11 115.64 112.28 1u6s s THR -4 Ca -0.15 -0.35 0.02 0.00 -1.21 0.00 0.00 61.69 60.00 1u6s s THR -4 Cb -0.17 -3.75 0.00 0.00 -1.51 0.00 0.00 72.50 67.07 1u6s s THR -4 CO 0.07 -0.55 -0.06 -0.44 -2.21 0.00 0.00 174.62 171.42 1u6s s SER -3 N -4.10 0.79 0.00 8.08 0.01 -1.24 -4.67 113.70 112.57 1u6s s SER -3 Ca 0.44 -0.12 0.00 0.00 1.31 0.00 0.00 55.95 57.58 1u6s s SER -3 Cb -0.10 -0.15 0.00 0.00 0.21 0.00 0.00 66.02 65.98 1u6s s SER -3 CO 0.38 0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.70 1u6s n GLY -2 N 3.13 4.83 3.78 3.44 0.00 -0.23 -4.49 105.19 115.63 1u6s n GLY -2 Ca -0.15 -1.93 -0.35 0.00 0.00 0.00 0.00 46.02 43.59 1u6s n GLY -2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u6s s ALA -1 N -2.19 2.69 -0.16 4.61 0.00 -1.19 -4.87 121.76 120.65 1u6s s ALA -1 Ca 0.00 0.78 -0.19 0.00 0.00 0.00 0.00 51.96 52.54 1u6s s ALA -1 Cb 0.00 -3.35 -0.23 0.00 0.00 0.00 0.00 23.12 19.54 1u6s s ALA -1 CO 0.00 -0.79 0.40 -0.09 0.00 0.00 0.00 175.76 175.28 1u6s h ARG 1 N 1.09 0.10 -5.13 0.00 2.43 -1.93 -3.37 114.38 107.58 1u6s h ARG 1 Ca -0.50 -0.18 -0.62 0.00 -0.81 0.00 0.00 59.98 57.88 1u6s h ARG 1 Cb 1.26 0.07 -0.14 0.00 -0.42 0.00 0.00 29.97 30.73 1u6s h ARG 1 CO 0.57 1.08 -0.44 -1.12 -1.51 0.00 0.00 179.97 178.55 1u6s s SER 2 N -6.85 6.17 0.02 -3.80 0.01 -1.26 -4.95 113.70 103.04 1u6s s SER 2 Ca -0.24 0.18 0.04 0.00 1.31 0.00 0.00 55.95 57.24 1u6s s SER 2 Cb 0.04 -2.13 -0.02 0.00 0.21 0.00 0.00 66.02 64.12 1u6s s SER 2 CO 0.68 0.02 -0.11 0.54 0.41 0.00 0.00 173.24 174.77 1u6s s VAL 3 N 1.22 0.88 0.30 3.43 0.11 -1.26 -2.28 120.40 122.80 1u6s s VAL 3 Ca 0.10 -0.77 -0.01 0.00 -2.93 0.00 0.00 61.98 58.37 1u6s s VAL 3 Cb -0.14 -0.80 -0.02 0.00 -1.53 0.00 0.00 36.38 33.90 1u6s s VAL 3 CO 0.06 0.03 0.35 -0.83 -3.33 0.00 0.00 175.10 171.38 1u6s s GLY 4 N -0.84 1.59 -0.41 6.54 0.00 0.17 -0.76 107.32 113.61 1u6s s GLY 4 Ca 0.01 -1.63 -0.21 0.00 0.00 0.00 0.00 44.72 42.89 1u6s s GLY 4 CO 0.01 -1.17 0.66 1.08 0.00 0.00 0.00 173.10 173.67 1u6s s LEU 5 N -3.23 4.38 0.07 0.66 1.43 -1.26 -2.41 118.68 118.32 1u6s s LEU 5 Ca 0.34 -0.13 -0.10 0.00 -1.03 0.00 0.00 54.13 53.21 1u6s s LEU 5 Cb 0.02 -2.78 -0.25 0.00 0.03 0.00 0.00 46.19 43.21 1u6s s LEU 5 CO 0.19 -0.72 1.15 -0.07 0.23 0.00 0.00 176.35 177.13 1u6s h LEU 6 N 9.62 0.70 -7.96 1.79 3.38 -0.89 -3.36 115.31 118.60 1u6s h LEU 6 Ca -0.26 -0.66 0.08 0.00 0.09 0.00 0.00 57.88 57.14 1u6s h LEU 6 Cb 1.10 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.58 1u6s h LEU 6 CO 0.88 1.48 0.26 -0.94 0.09 0.00 0.00 178.44 180.21 1u6s s SER 7 N -7.30 -0.25 0.00 -0.43 1.04 -1.24 -1.36 113.70 104.15 1u6s s SER 7 Ca -0.07 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 55.77 1u6s s SER 7 Cb 0.06 0.70 -0.00 0.00 0.10 0.00 0.00 66.02 66.89 1u6s s SER 7 CO 0.91 -1.30 -0.01 0.54 0.98 0.00 0.00 173.24 174.35 1u6s s VAL 8 N -3.83 0.09 -0.02 5.02 0.11 -1.26 -1.94 120.40 118.56 1u6s s VAL 8 Ca 0.11 -0.11 0.05 0.00 -2.93 0.00 0.00 61.98 59.10 1u6s s VAL 8 Cb -0.05 -0.09 -0.01 0.00 -1.53 0.00 0.00 36.38 34.69 1u6s s VAL 8 CO 0.07 -0.02 -0.18 -0.83 -3.33 0.00 0.00 175.10 170.81 1u6s s GLY 9 N -0.13 0.88 -0.10 6.54 0.00 0.26 -4.59 107.32 110.18 1u6s s GLY 9 Ca -0.01 -0.75 0.04 0.00 0.00 0.00 0.00 44.72 44.00 1u6s s GLY 9 CO -0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 173.10 172.31 1u6s s ALA 10 N -0.31 2.03 -0.20 3.20 0.00 -1.26 -0.98 121.76 124.23 1u6s s ALA 10 Ca 0.04 -0.89 -0.03 0.00 0.00 0.00 0.00 51.96 51.09 1u6s s ALA 10 Cb -0.08 -0.79 -0.01 0.00 0.00 0.00 0.00 23.12 22.24 1u6s s ALA 10 CO -0.00 0.22 -0.07 -0.47 0.00 0.00 0.00 175.76 175.44 1u6s s TYR 11 N 0.45 2.92 -0.18 0.00 5.04 0.13 -4.90 117.35 120.82 1u6s s TYR 11 Ca -0.17 -0.96 0.01 0.00 -2.44 0.00 0.00 57.07 53.51 1u6s s TYR 11 Cb -0.17 -2.04 0.02 0.00 0.35 0.00 0.00 41.96 40.11 1u6s s TYR 11 CO 0.07 -0.52 -0.19 1.03 -1.34 0.00 0.00 175.55 174.60 1u6s s ARG 12 N 1.27 2.91 0.50 4.97 0.52 -1.26 -1.39 118.95 126.47 1u6s s ARG 12 Ca 0.03 -0.80 -0.21 0.00 -0.52 0.00 0.00 55.73 54.23 1u6s s ARG 12 Cb -0.14 -2.51 -0.09 0.00 0.52 0.00 0.00 34.95 32.73 1u6s s ARG 12 CO -0.03 -0.21 0.83 -2.30 0.02 0.00 0.00 175.30 173.61 1u6s n PRO 13 N 4.63 0.94 -0.07 3.54 -0.02 -1.26 -4.93 135.00 137.83 1u6s n PRO 13 Ca -0.21 0.35 -0.09 0.00 -2.02 0.00 0.00 63.50 61.53 1u6s n PRO 13 Cb 0.50 -1.93 -0.02 0.00 -0.02 0.00 0.00 33.50 32.03 1u6s n PRO 13 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1u6s h GLU 14 N 0.87 0.34 -6.39 -0.52 4.81 -1.98 -3.43 114.58 108.27 1u6s h GLU 14 Ca -0.45 -0.02 -0.54 0.00 -0.13 0.00 0.00 59.36 58.21 1u6s h GLU 14 Cb 1.37 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 30.67 1u6s h GLU 14 CO 0.52 0.23 0.81 0.50 -0.73 0.00 0.00 179.01 180.34 1u6s s ARG 15 N -6.16 4.29 -0.21 1.92 3.52 -1.25 -4.96 118.95 116.11 1u6s s ARG 15 Ca -0.13 1.95 -0.09 0.00 -0.13 0.00 0.00 55.73 57.33 1u6s s ARG 15 Cb 0.09 -3.54 -0.05 0.00 -1.56 0.00 0.00 34.95 29.89 1u6s s ARG 15 CO 0.70 -0.55 0.12 0.08 -0.81 0.00 0.00 175.30 174.84 1u6s s VAL 16 N 2.25 5.22 -0.32 7.11 1.01 -1.26 -1.42 120.40 132.99 1u6s s VAL 16 Ca 0.63 0.12 -0.04 0.00 0.00 0.00 0.00 61.98 62.70 1u6s s VAL 16 Cb -0.31 -3.39 0.05 0.00 0.00 0.00 0.00 36.38 32.72 1u6s s VAL 16 CO 0.27 0.42 0.05 -0.69 0.00 0.00 0.00 175.10 175.14 1u6s s VAL 17 N 0.55 3.31 0.70 2.92 1.01 0.12 -4.97 120.40 124.05 1u6s s VAL 17 Ca 0.07 -1.30 -0.11 0.00 0.00 0.00 0.00 61.98 60.64 1u6s s VAL 17 Cb -0.12 -2.90 0.01 0.00 0.00 0.00 0.00 36.38 33.37 1u6s s VAL 17 CO 0.00 -0.15 1.08 0.42 0.00 0.00 0.00 175.10 176.45 1u6s s THR 18 N 1.31 3.78 0.28 3.92 -4.23 -1.26 -2.22 115.64 117.21 1u6s s THR 18 Ca -0.04 0.58 -0.03 0.00 -1.18 0.00 0.00 61.69 61.02 1u6s s THR 18 Cb -0.20 -3.49 0.26 0.00 1.34 0.00 0.00 72.50 70.42 1u6s s THR 18 CO 0.00 -0.75 1.94 0.78 -0.54 0.00 0.00 174.62 176.05 1u6s h ASN 19 N -0.66 1.04 -0.40 3.99 2.35 -1.93 -2.02 115.58 117.94 1u6s h ASN 19 Ca -0.45 -0.02 -0.01 0.00 -0.55 0.00 0.00 56.30 55.27 1u6s h ASN 19 Cb 1.24 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 39.33 1u6s h ASN 19 CO 0.62 0.74 0.22 0.44 -1.65 0.00 0.00 177.43 177.79 1u6s h ASP 20 N 1.22 0.54 -0.36 5.81 3.32 -1.93 0.16 116.42 125.18 1u6s h ASP 20 Ca 0.35 -0.04 -0.11 0.00 0.02 0.00 0.00 57.03 57.25 1u6s h ASP 20 Cb -0.09 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 1u6s h ASP 20 CO -0.09 0.46 -0.17 -0.08 -1.72 0.00 0.00 179.24 177.64 1u6s h GLU 21 N 0.61 0.83 -0.16 3.56 4.81 -1.76 -2.58 114.58 119.89 1u6s h GLU 21 Ca 0.16 -0.31 -0.12 0.00 -0.13 0.00 0.00 59.36 58.95 1u6s h GLU 21 Cb 0.06 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1u6s h GLU 21 CO -0.02 0.94 -0.42 0.82 -0.73 0.00 0.00 179.01 179.60 1u6s h ILE 22 N 0.73 1.31 0.00 2.32 1.08 -0.81 -3.16 117.51 118.99 1u6s h ILE 22 Ca 0.11 -1.57 0.00 0.00 -0.39 0.00 0.00 64.86 63.01 1u6s h ILE 22 Cb 0.69 1.65 0.00 0.00 -3.07 0.00 0.00 36.82 36.09 1u6s h ILE 22 CO 0.05 0.48 0.00 0.00 -0.69 0.00 0.00 178.15 177.99 1u6s n GLN 24 N -0.77 0.18 0.00 0.00 6.02 -1.15 -3.97 117.38 117.69 1u6s n GLN 24 Ca 0.10 0.26 0.00 0.00 -0.01 0.00 0.00 57.00 57.35 1u6s n GLN 24 Cb 0.05 -1.76 0.00 0.00 1.02 0.00 0.00 30.24 29.55 1u6s n GLN 24 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1u6s n HIS 25 N -2.09 0.00 -4.24 1.08 8.25 -1.20 -5.06 115.22 111.96 1u6s n HIS 25 Ca 0.04 -0.02 -0.15 0.00 -0.26 0.00 0.00 57.72 57.34 1u6s n HIS 25 Cb 0.33 -0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.33 1u6s n HIS 25 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 1u6s s ILE 26 N -0.04 1.19 -0.70 1.59 -4.36 -1.25 -4.45 121.20 113.17 1u6s s ILE 26 Ca 0.00 -1.95 -0.21 0.00 -0.26 0.00 0.00 60.65 58.23 1u6s s ILE 26 Cb 0.00 -1.73 0.09 0.00 1.25 0.00 0.00 42.46 42.07 1u6s s ILE 26 CO 0.00 -0.66 0.95 -0.62 0.24 0.00 0.00 174.94 174.85 1u6s s ASP 27 N -2.95 6.27 0.00 4.36 2.15 -1.26 -4.76 116.67 120.47 1u6s s ASP 27 Ca 0.14 -1.31 0.00 0.00 0.43 0.00 0.00 52.55 51.81 1u6s s ASP 27 Cb 0.00 -2.39 0.00 0.00 -0.30 0.00 0.00 42.92 40.23 1u6s s ASP 27 CO 0.01 -1.30 0.00 -0.24 -0.17 0.00 0.00 175.17 173.47 1u6s n SER 28 N 7.19 0.00 -3.92 -0.34 2.88 -1.26 -5.11 113.62 113.06 1u6s n SER 28 Ca 0.01 -0.83 -0.09 0.00 -1.33 0.00 0.00 58.87 56.63 1u6s n SER 28 Cb 0.46 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.83 1u6s n SER 28 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1u6s s SER 29 N -0.51 0.20 0.24 -3.46 1.04 -1.26 -5.02 113.70 104.94 1u6s s SER 29 Ca 0.00 -0.69 -0.07 0.00 0.48 0.00 0.00 55.95 55.67 1u6s s SER 29 Cb 0.00 0.29 0.23 0.00 0.10 0.00 0.00 66.02 66.64 1u6s s SER 29 CO 0.00 -0.66 1.89 -0.78 0.98 0.00 0.00 173.24 174.67 1u6s h ASP 30 N 3.00 1.13 -0.31 7.02 3.58 -1.98 -2.59 116.42 126.26 1u6s h ASP 30 Ca -0.34 -0.06 0.01 0.00 0.42 0.00 0.00 57.03 57.06 1u6s h ASP 30 Cb 1.18 -0.28 -0.02 0.00 1.72 0.00 0.00 39.33 41.93 1u6s h ASP 30 CO 0.57 0.86 0.20 -0.08 -2.88 0.00 0.00 179.24 177.90 1u6s h GLU 31 N 1.30 0.39 0.25 0.28 4.81 -1.97 -1.86 114.58 117.78 1u6s h GLU 31 Ca 0.34 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.54 1u6s h GLU 31 Cb -0.08 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.22 1u6s h GLU 31 CO -0.07 0.26 -0.13 2.35 -0.73 0.00 0.00 179.01 180.69 1u6s h TRP 32 N 0.40 -0.33 -0.27 0.92 7.01 -1.91 -1.68 115.95 120.09 1u6s h TRP 32 Ca 0.12 -0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.16 1u6s h TRP 32 Cb -0.02 0.11 -0.04 0.00 -2.10 0.00 0.00 29.16 27.11 1u6s h TRP 32 CO -0.07 -0.20 0.02 0.82 -2.79 0.00 0.00 178.44 176.22 1u6s h ILE 33 N -0.35 0.83 -0.03 2.65 2.04 -1.43 -0.44 117.51 120.78 1u6s h ILE 33 Ca -0.03 -0.04 0.01 0.00 1.00 0.00 0.00 64.86 65.81 1u6s h ILE 33 Cb 0.27 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 1u6s h ILE 33 CO 0.05 0.02 -0.04 0.22 0.00 0.00 0.00 178.15 178.40 1u6s h TYR 34 N 0.10 -0.10 0.00 1.37 5.03 -1.25 -0.29 116.97 121.83 1u6s h TYR 34 Ca 0.13 0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.44 1u6s h TYR 34 Cb 0.15 0.05 0.00 0.00 1.55 0.00 0.00 36.73 38.48 1u6s h TYR 34 CO -0.19 -0.06 0.00 1.79 -1.32 0.00 0.00 178.16 178.37 1u6s h THR 35 N -0.06 0.00 0.00 1.81 1.35 -1.10 0.46 112.91 115.37 1u6s h THR 35 Ca 0.03 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.32 1u6s h THR 35 Cb 0.10 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.04 1u6s h THR 35 CO -0.07 0.00 -1.32 0.54 -0.25 0.00 0.00 175.52 174.43 1u6s n ARG 36 N -2.90 0.33 0.00 4.72 5.12 -0.19 -4.67 116.66 119.07 1u6s n ARG 36 Ca 0.02 -0.06 0.00 0.00 -1.93 0.00 0.00 57.85 55.88 1u6s n ARG 36 Cb 0.35 -1.55 0.00 0.00 -1.16 0.00 0.00 32.46 30.10 1u6s n ARG 36 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 1u6s n THR 37 N -1.94 0.00 -0.48 0.55 -2.24 -0.15 -4.74 114.28 105.28 1u6s n THR 37 Ca 0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1u6s n THR 37 Cb 0.45 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.46 1u6s n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u6s n GLY 38 N 1.27 0.75 3.70 3.38 0.00 0.16 0.19 105.19 114.63 1u6s n GLY 38 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1u6s n GLY 38 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u6s s ILE 39 N -2.65 5.11 -0.26 -0.61 1.01 -1.26 -3.85 121.20 118.69 1u6s s ILE 39 Ca 0.00 1.14 -0.09 0.00 0.00 0.00 0.00 60.65 61.70 1u6s s ILE 39 Cb 0.00 -3.91 -0.13 0.00 0.01 0.00 0.00 42.46 38.43 1u6s s ILE 39 CO 0.00 0.24 -0.31 0.29 0.00 0.00 0.00 174.94 175.16 1u6s n LYS 40 N 4.11 0.59 -4.13 2.79 5.02 1.00 -3.61 118.16 123.92 1u6s n LYS 40 Ca -0.04 0.22 -0.12 0.00 -2.02 0.00 0.00 58.31 56.35 1u6s n LYS 40 Cb 0.51 -1.47 -0.08 0.00 -0.02 0.00 0.00 35.03 33.97 1u6s n LYS 40 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1u6s s THR 41 N -2.49 0.00 0.12 -0.18 -4.23 -0.72 -3.29 115.64 104.84 1u6s s THR 41 Ca -0.36 -1.79 -0.10 0.00 -1.18 0.00 0.00 61.69 58.26 1u6s s THR 41 Cb 0.13 -2.42 0.00 0.00 1.34 0.00 0.00 72.50 71.55 1u6s s THR 41 CO 0.50 0.00 0.25 0.00 -0.54 0.00 0.00 174.62 174.84 1u6s s ARG 42 N -4.01 0.98 -0.13 3.99 3.03 -0.94 -3.17 118.95 118.70 1u6s s ARG 42 Ca 0.33 -0.98 -0.05 0.00 2.03 0.00 0.00 55.73 57.07 1u6s s ARG 42 Cb 0.04 0.37 -0.04 0.00 -1.03 0.00 0.00 34.95 34.30 1u6s s ARG 42 CO 0.12 -0.34 0.04 -0.98 -1.13 0.00 0.00 175.30 173.02 1u6s s ARG 43 N -3.88 3.42 -0.06 3.89 3.03 -1.26 0.15 118.95 124.24 1u6s s ARG 43 Ca 0.08 -0.34 0.03 0.00 2.03 0.00 0.00 55.73 57.53 1u6s s ARG 43 Cb 0.04 -3.01 -0.02 0.00 -1.03 0.00 0.00 34.95 30.93 1u6s s ARG 43 CO -0.08 0.56 -0.14 -0.06 -1.13 0.00 0.00 175.30 174.45 1u6s s PHE 44 N -0.45 2.74 0.66 5.89 0.40 -0.51 -1.19 117.98 125.52 1u6s s PHE 44 Ca 0.09 -0.21 -0.12 0.00 -0.60 0.00 0.00 56.93 56.09 1u6s s PHE 44 Cb -0.12 -1.67 -0.01 0.00 0.51 0.00 0.00 43.02 41.73 1u6s s PHE 44 CO 0.02 0.14 1.06 0.00 0.70 0.00 0.00 175.22 177.14 1u6s s ALA 45 N -0.58 2.73 0.72 5.36 0.00 -1.26 -3.77 121.76 124.96 1u6s s ALA 45 Ca 0.08 0.17 -0.11 0.00 0.00 0.00 0.00 51.96 52.10 1u6s s ALA 45 Cb -0.11 -3.19 0.02 0.00 0.00 0.00 0.00 23.12 19.84 1u6s s ALA 45 CO 0.01 -1.05 1.07 0.00 0.00 0.00 0.00 175.76 175.79 1u6s s ALA 46 N -2.87 2.55 0.35 0.00 0.00 -1.26 -4.95 121.76 115.58 1u6s s ALA 46 Ca 0.59 0.13 0.05 0.00 0.00 0.00 0.00 51.96 52.73 1u6s s ALA 46 Cb -0.14 -3.20 0.71 0.00 0.00 0.00 0.00 23.12 20.49 1u6s s ALA 46 CO 0.49 -1.39 1.93 -0.44 0.00 0.00 0.00 175.76 176.35 1u6s h ASP 47 N -0.85 0.71 0.21 0.00 3.32 -2.05 -1.32 116.42 116.44 1u6s h ASP 47 Ca -0.44 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1u6s h ASP 47 Cb 1.22 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1u6s h ASP 47 CO 0.55 0.44 -0.01 -0.90 -1.72 0.00 0.00 179.24 177.60 1u6s n ASP 48 N -4.49 0.17 -4.91 6.45 5.75 -1.26 -4.84 116.55 113.41 1u6s n ASP 48 Ca 0.12 -0.74 -0.29 0.00 -0.01 0.00 0.00 54.79 53.88 1u6s n ASP 48 Cb 0.26 -0.09 -0.03 0.00 -1.03 0.00 0.00 41.12 40.23 1u6s n ASP 48 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1u6s s GLU 49 N -2.22 3.58 0.34 0.11 2.02 -0.50 -5.06 118.70 116.96 1u6s s GLU 49 Ca 0.39 -0.17 0.07 0.00 0.02 0.00 0.00 54.97 55.28 1u6s s GLU 49 Cb 0.21 -2.78 -0.03 0.00 0.10 0.00 0.00 34.13 31.63 1u6s s GLU 49 CO 0.41 0.35 0.25 -1.54 0.02 0.00 0.00 175.26 174.75 1u6s s SER 50 N -3.00 1.79 0.19 -0.19 1.04 -1.26 -4.84 113.70 107.42 1u6s s SER 50 Ca 0.41 -1.74 -0.08 0.00 0.48 0.00 0.00 55.95 55.02 1u6s s SER 50 Cb -0.11 0.55 0.09 0.00 0.10 0.00 0.00 66.02 66.65 1u6s s SER 50 CO 0.28 -1.04 1.64 0.00 0.98 0.00 0.00 173.24 175.10 1u6s h ALA 51 N 2.10 0.84 -0.39 5.32 0.00 -1.91 -2.17 119.26 123.04 1u6s h ALA 51 Ca -0.27 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.22 1u6s h ALA 51 Cb 1.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 1u6s h ALA 51 CO 0.40 0.66 -0.14 0.00 0.00 0.00 0.00 179.25 180.17 1u6s h ALA 52 N 1.01 0.55 -0.40 0.00 0.00 -1.95 -2.07 119.26 116.40 1u6s h ALA 52 Ca 0.16 -0.34 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 1u6s h ALA 52 Cb 0.60 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1u6s h ALA 52 CO 0.04 0.46 -0.28 0.66 0.00 0.00 0.00 179.25 180.12 1u6s h SER 53 N 0.60 0.89 -0.24 0.00 4.64 -1.94 -1.69 113.55 115.80 1u6s h SER 53 Ca 0.09 -0.35 -0.15 0.00 -0.47 0.00 0.00 61.79 60.90 1u6s h SER 53 Cb 0.68 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.52 1u6s h SER 53 CO 0.05 1.11 -0.41 0.24 -0.87 0.00 0.00 176.83 176.94 1u6s h MET 54 N 0.73 0.79 -0.75 4.77 0.00 -1.45 -2.79 114.93 116.23 1u6s h MET 54 Ca 0.08 -0.42 0.08 0.00 0.00 0.00 0.00 59.70 59.44 1u6s h MET 54 Cb 0.83 0.02 -0.07 0.00 0.00 0.00 0.00 31.60 32.39 1u6s h MET 54 CO 0.07 1.05 0.41 0.00 0.00 0.00 0.00 176.91 178.44 1u6s h ALA 55 N 0.89 1.04 0.19 6.32 0.00 -1.22 -0.72 119.26 125.76 1u6s h ALA 55 Ca 0.05 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1u6s h ALA 55 Cb 0.98 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1u6s h ALA 55 CO 0.09 0.05 -0.11 1.15 0.00 0.00 0.00 179.25 180.43 1u6s h THR 56 N 0.71 0.77 -0.71 0.00 2.02 -1.18 0.84 112.91 115.36 1u6s h THR 56 Ca 0.35 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.57 1u6s h THR 56 Cb 0.31 0.77 -0.05 0.00 -1.74 0.00 0.00 68.15 67.44 1u6s h THR 56 CO -0.23 0.00 0.44 -0.33 0.37 0.00 0.00 175.52 175.77 1u6s h GLU 57 N -0.28 0.82 -0.65 6.66 4.39 -1.29 -0.27 114.58 123.96 1u6s h GLU 57 Ca -0.02 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1u6s h GLU 57 Cb 0.23 -0.19 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 1u6s h GLU 57 CO 0.03 0.54 0.42 0.00 -1.16 0.00 0.00 179.01 178.84 1u6s h ALA 58 N 1.32 0.82 -0.54 3.43 0.00 -0.86 -2.08 119.26 121.34 1u6s h ALA 58 Ca 0.29 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1u6s h ALA 58 Cb 0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1u6s h ALA 58 CO -0.12 0.27 0.18 0.00 0.00 0.00 0.00 179.25 179.57 1u6s h ARG 60 N 0.75 0.58 -0.48 0.00 2.47 -0.61 0.74 114.38 117.83 1u6s h ARG 60 Ca 0.18 -0.03 -0.12 0.00 -1.26 0.00 0.00 59.98 58.74 1u6s h ARG 60 Cb 0.26 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.44 1u6s h ARG 60 CO -0.01 0.38 -0.19 0.00 0.56 0.00 0.00 179.97 180.72 1u6s h ARG 61 N 0.59 0.97 -0.55 0.04 3.08 -1.31 -0.94 114.38 116.26 1u6s h ARG 61 Ca 0.27 -0.39 -0.02 0.00 0.07 0.00 0.00 59.98 59.90 1u6s h ARG 61 Cb 0.17 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 1u6s h ARG 61 CO -0.18 1.06 0.24 0.00 -1.07 0.00 0.00 179.97 180.03 1u6s h ALA 62 N 0.93 0.71 -0.44 0.04 0.00 -0.87 0.51 119.26 120.15 1u6s h ALA 62 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1u6s h ALA 62 Cb 0.75 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 1u6s h ALA 62 CO 0.06 0.29 0.29 -0.07 0.00 0.00 0.00 179.25 179.82 1u6s h LEU 63 N 0.74 0.50 -0.40 0.00 3.38 -0.71 -2.43 115.31 116.38 1u6s h LEU 63 Ca 0.19 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.15 1u6s h LEU 63 Cb 0.15 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1u6s h LEU 63 CO -0.02 0.36 0.26 -1.28 0.09 0.00 0.00 178.44 177.86 1u6s h SER 64 N 0.59 0.45 0.63 -0.43 0.87 -0.84 -0.46 113.55 114.36 1u6s h SER 64 Ca 0.16 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 1u6s h SER 64 Cb -0.07 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 61.78 1u6s h SER 64 CO -0.03 0.32 0.00 0.59 -0.53 0.00 0.00 176.83 177.18 1u6s n ASN 65 N -4.82 0.41 -0.29 6.23 4.13 0.14 -1.97 115.26 119.09 1u6s n ASN 65 Ca 0.01 0.60 0.10 0.00 1.68 0.00 0.00 54.58 56.97 1u6s n ASN 65 Cb 0.03 -0.69 -0.05 0.00 -1.54 0.00 0.00 39.78 37.53 1u6s n ASN 65 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1u6s n ALA 66 N -1.67 3.92 -2.44 5.41 0.00 -0.93 -4.84 120.51 119.97 1u6s n ALA 66 Ca 0.03 -0.60 -0.11 0.00 0.00 0.00 0.00 53.44 52.75 1u6s n ALA 66 Cb 0.20 -0.74 0.01 0.00 0.00 0.00 0.00 19.45 18.92 1u6s n ALA 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u6s n GLY 67 N 1.41 0.01 3.54 0.00 0.00 -0.83 -5.03 105.19 104.27 1u6s n GLY 67 Ca 0.07 -0.38 -0.25 0.00 0.00 0.00 0.00 46.02 45.46 1u6s n GLY 67 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1u6s s LEU 68 N -3.37 2.62 0.32 0.99 1.43 -0.24 -5.04 118.68 115.39 1u6s s LEU 68 Ca 0.08 -1.32 0.06 0.00 -1.03 0.00 0.00 54.13 51.92 1u6s s LEU 68 Cb -0.04 -0.74 -0.06 0.00 0.03 0.00 0.00 46.19 45.38 1u6s s LEU 68 CO 0.10 -0.44 -0.01 -0.94 0.23 0.00 0.00 176.35 175.30 1u6s s SER 69 N -3.60 2.87 0.37 2.29 1.04 -1.26 -4.19 113.70 111.22 1u6s s SER 69 Ca 0.34 -1.29 0.19 0.00 0.48 0.00 0.00 55.95 55.68 1u6s s SER 69 Cb 0.08 -0.19 1.24 0.00 0.10 0.00 0.00 66.02 67.24 1u6s s SER 69 CO 0.16 -0.45 1.63 0.00 0.98 0.00 0.00 173.24 175.56 1u6s h ALA 70 N 2.12 2.17 -0.32 5.32 0.00 -1.94 0.17 119.26 126.77 1u6s h ALA 70 Ca -0.41 0.20 0.09 0.00 0.00 0.00 0.00 54.91 54.79 1u6s h ALA 70 Cb 1.24 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 1u6s h ALA 70 CO 0.71 -0.84 0.31 0.00 0.00 0.00 0.00 179.25 179.43 1u6s h ALA 71 N 1.85 2.05 -0.00 0.00 0.00 -1.91 -0.78 119.26 120.48 1u6s h ALA 71 Ca 0.79 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.69 1u6s h ALA 71 Cb 2.02 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.83 1u6s h ALA 71 CO -0.62 -0.48 -0.10 -0.25 0.00 0.00 0.00 179.25 177.80 1u6s n ASP 72 N -3.91 0.16 -4.78 0.00 8.00 0.61 -4.86 116.55 111.76 1u6s n ASP 72 Ca 0.05 0.10 -0.37 0.00 0.71 0.00 0.00 54.79 55.29 1u6s n ASP 72 Cb 0.47 -0.27 -0.07 0.00 -0.02 0.00 0.00 41.12 41.23 1u6s n ASP 72 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1u6s s ILE 73 N -2.85 5.33 -0.04 0.53 -1.09 -0.30 -4.57 121.20 118.21 1u6s s ILE 73 Ca 0.18 0.45 0.20 0.00 -2.23 0.00 0.00 60.65 59.25 1u6s s ILE 73 Cb 0.19 -3.56 -0.31 0.00 -1.58 0.00 0.00 42.46 37.20 1u6s s ILE 73 CO 0.54 0.49 0.41 0.47 -1.23 0.00 0.00 174.94 175.62 1u6s n ASP 74 N 2.89 0.31 -3.53 3.58 10.43 0.55 -4.93 116.55 125.85 1u6s n ASP 74 Ca -0.15 0.00 -0.12 0.00 2.57 0.00 0.00 54.79 57.09 1u6s n ASP 74 Cb 0.53 1.85 -0.04 0.00 1.84 0.00 0.00 41.12 45.29 1u6s n ASP 74 CO 0.00 0.00 0.00 -0.83 -1.07 0.00 0.00 177.20 175.30 1u6s s GLY 75 N -4.45 -0.43 -0.05 0.44 0.00 -1.22 -3.18 107.32 98.44 1u6s s GLY 75 Ca -0.08 1.46 0.02 0.00 0.00 0.00 0.00 44.72 46.12 1u6s s GLY 75 CO 0.85 0.75 -0.08 0.54 0.00 0.00 0.00 173.10 175.16 1u6s s VAL 76 N -1.89 0.81 -0.25 1.40 0.11 -0.65 -0.86 120.40 119.06 1u6s s VAL 76 Ca -0.02 -0.29 -0.02 0.00 -2.93 0.00 0.00 61.98 58.72 1u6s s VAL 76 Cb -0.01 -0.77 0.02 0.00 -1.53 0.00 0.00 36.38 34.10 1u6s s VAL 76 CO -0.00 0.28 -0.04 -0.63 -3.33 0.00 0.00 175.10 171.37 1u6s s ILE 77 N 0.75 3.04 -0.25 7.04 1.01 -0.35 -2.92 121.20 129.52 1u6s s ILE 77 Ca -0.13 -0.96 -0.18 0.00 0.00 0.00 0.00 60.65 59.38 1u6s s ILE 77 Cb -0.15 -2.54 -0.03 0.00 0.01 0.00 0.00 42.46 39.75 1u6s s ILE 77 CO 0.02 0.19 0.53 -0.69 0.00 0.00 0.00 174.94 174.99 1u6s s VAL 78 N 1.35 5.06 -0.16 2.92 1.01 -0.95 -1.86 120.40 127.77 1u6s s VAL 78 Ca 0.01 0.93 -0.04 0.00 0.00 0.00 0.00 61.98 62.88 1u6s s VAL 78 Cb -0.17 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 1u6s s VAL 78 CO -0.03 0.09 -0.03 0.28 0.00 0.00 0.00 175.10 175.40 1u6s s THR 79 N 2.24 3.94 0.10 3.92 -1.32 -0.39 -0.91 115.64 123.21 1u6s s THR 79 Ca 0.22 -0.34 -0.26 0.00 -1.21 0.00 0.00 61.69 60.10 1u6s s THR 79 Cb -0.16 -2.73 0.08 0.00 -1.51 0.00 0.00 72.50 68.18 1u6s s THR 79 CO 0.09 0.49 0.93 0.28 -2.21 0.00 0.00 174.62 174.20 1u6s s THR 80 N 0.39 0.00 0.00 5.08 -1.32 -1.05 -1.78 115.64 116.96 1u6s s THR 80 Ca -0.04 -0.41 0.00 0.00 -1.21 0.00 0.00 61.69 60.04 1u6s s THR 80 Cb -0.14 -1.61 0.00 0.00 -1.51 0.00 0.00 72.50 69.24 1u6s s THR 80 CO 0.03 0.00 0.38 0.59 -2.21 0.00 0.00 174.62 173.41 1u6s n ASN 81 N -0.39 0.72 -0.68 8.08 3.02 -1.26 -4.37 115.26 120.38 1u6s n ASN 81 Ca -0.07 -1.07 0.06 0.00 -0.03 0.00 0.00 54.58 53.46 1u6s n ASN 81 Cb 0.61 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.91 1u6s n ASN 81 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1u6s n THR 82 N -0.04 1.35 -2.60 3.41 -2.24 -1.26 -4.96 114.28 107.95 1u6s n THR 82 Ca 0.00 -2.11 -0.43 0.00 -2.27 0.00 0.00 64.05 59.24 1u6s n THR 82 Cb 0.12 0.14 -0.02 0.00 -2.10 0.00 0.00 70.33 68.47 1u6s n THR 82 CO 0.00 0.00 0.00 -2.28 -0.57 0.00 0.00 175.07 172.22 1u6s s HIS 83 N -2.01 2.85 -0.27 4.78 5.04 -1.26 -4.57 115.29 119.85 1u6s s HIS 83 Ca 0.31 0.78 -0.00 0.00 -1.54 0.00 0.00 55.06 54.61 1u6s s HIS 83 Cb 0.31 -4.34 0.22 0.00 0.04 0.00 0.00 32.58 28.81 1u6s s HIS 83 CO -0.06 -1.22 1.85 1.19 -2.34 0.00 0.00 174.74 174.16 1u6s n PHE 84 N 7.74 1.40 -4.06 3.88 3.01 -1.26 -4.75 117.46 123.42 1u6s n PHE 84 Ca 0.12 -1.68 -0.17 0.00 1.01 0.00 0.00 57.45 56.73 1u6s n PHE 84 Cb 0.49 -0.82 -0.16 0.00 -0.01 0.00 0.00 39.48 38.98 1u6s n PHE 84 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1u6s s LEU 85 N -1.61 1.44 0.45 4.37 1.43 -1.26 -5.01 118.68 118.47 1u6s s LEU 85 Ca 0.28 -0.07 0.13 0.00 -1.03 0.00 0.00 54.13 53.43 1u6s s LEU 85 Cb 0.22 -0.30 1.00 0.00 0.03 0.00 0.00 46.19 47.14 1u6s s LEU 85 CO 0.01 -0.04 2.03 1.56 0.23 0.00 0.00 176.35 180.13 1u6s h GLN 86 N 6.91 0.13 -1.68 1.70 1.08 -2.04 -3.45 115.11 117.76 1u6s h GLN 86 Ca -0.38 -0.02 0.16 0.00 -1.45 0.00 0.00 58.65 56.96 1u6s h GLN 86 Cb 1.15 -0.02 -0.20 0.00 -0.05 0.00 0.00 27.48 28.36 1u6s h GLN 86 CO 0.48 0.20 0.65 -0.08 -0.95 0.00 0.00 178.83 179.14 1u6s s THR 87 N -4.89 0.00 0.85 -0.54 -1.32 -1.26 -4.78 115.64 103.69 1u6s s THR 87 Ca -0.05 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.32 1u6s s THR 87 Cb 0.16 -1.00 0.10 0.00 -1.51 0.00 0.00 72.50 70.25 1u6s s THR 87 CO 0.70 0.00 1.09 -2.16 -2.21 0.00 0.00 174.62 172.04 1u6s s PRO 88 N -2.03 1.67 0.74 7.08 0.04 -1.26 -5.14 135.00 136.10 1u6s s PRO 88 Ca 0.04 0.93 -0.12 0.00 0.04 0.00 0.00 61.00 61.89 1u6s s PRO 88 Cb -0.01 -1.85 0.04 0.00 0.04 0.00 0.00 34.50 32.73 1u6s s PRO 88 CO -0.04 -1.99 1.11 -2.14 0.04 0.00 0.00 177.00 173.99 1u6s s PRO 89 N -4.94 2.30 0.10 0.56 0.02 -1.26 -4.91 135.00 126.86 1u6s s PRO 89 Ca 0.62 1.34 -0.16 0.00 0.02 0.00 0.00 61.00 62.83 1u6s s PRO 89 Cb -0.17 -1.89 -0.07 0.00 0.02 0.00 0.00 34.50 32.38 1u6s s PRO 89 CO 0.56 -1.63 1.47 0.00 -0.33 0.00 0.00 177.00 177.07 1u6s h ALA 90 N -0.73 0.43 -0.29 -1.55 0.00 -1.94 -3.38 119.26 111.80 1u6s h ALA 90 Ca -0.45 -0.32 0.07 0.00 0.00 0.00 0.00 54.91 54.20 1u6s h ALA 90 Cb 1.25 -0.10 -0.08 0.00 0.00 0.00 0.00 17.79 18.85 1u6s h ALA 90 CO 0.51 0.31 -0.32 0.00 0.00 0.00 0.00 179.25 179.75 1u6s h ALA 91 N 0.76 -0.25 -0.38 0.00 0.00 -1.92 -0.44 119.26 117.04 1u6s h ALA 91 Ca 0.07 0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1u6s h ALA 91 Cb 0.65 0.65 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1u6s h ALA 91 CO 0.04 -0.75 0.25 -1.35 0.00 0.00 0.00 179.25 177.45 1u6s h PRO 92 N -0.30 0.29 -0.14 0.00 0.11 -1.86 0.12 132.00 130.23 1u6s h PRO 92 Ca 0.14 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.21 1u6s h PRO 92 Cb 0.53 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 1u6s h PRO 92 CO -0.46 0.19 0.01 0.52 -0.21 0.00 0.00 178.00 178.06 1u6s h MET 93 N 0.30 0.23 -0.60 1.05 2.86 -1.31 -1.17 114.93 116.30 1u6s h MET 93 Ca 0.16 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.72 1u6s h MET 93 Cb 0.26 -0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.87 1u6s h MET 93 CO -0.03 0.45 0.31 0.28 1.06 0.00 0.00 176.91 178.97 1u6s h VAL 94 N -0.01 1.20 -0.99 -2.22 2.07 -0.72 -1.15 116.25 114.42 1u6s h VAL 94 Ca 0.04 -0.54 0.06 0.00 0.82 0.00 0.00 66.70 67.07 1u6s h VAL 94 Cb 0.34 0.47 -0.06 0.00 -1.52 0.00 0.00 31.29 30.51 1u6s h VAL 94 CO 0.01 0.23 0.65 0.00 0.02 0.00 0.00 177.57 178.47 1u6s h ALA 95 N 1.13 1.40 -0.03 1.67 0.00 -0.67 -1.76 119.26 121.00 1u6s h ALA 95 Ca 0.21 -0.03 -0.23 0.00 0.00 0.00 0.00 54.91 54.86 1u6s h ALA 95 Cb 0.08 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.56 1u6s h ALA 95 CO -0.03 0.46 -0.90 0.00 0.00 0.00 0.00 179.25 178.78 1u6s h ALA 96 N 1.45 0.36 0.00 0.00 0.00 -0.81 -0.50 119.26 119.75 1u6s h ALA 96 Ca 0.42 -0.67 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 1u6s h ALA 96 Cb 0.13 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1u6s h ALA 96 CO -0.16 0.76 -0.20 0.77 0.00 0.00 0.00 179.25 180.42 1u6s h SER 97 N 0.31 0.00 0.88 0.00 0.02 -0.98 -2.40 113.55 111.38 1u6s h SER 97 Ca -0.08 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1u6s h SER 97 Cb 1.53 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.07 1u6s h SER 97 CO 0.16 0.20 -0.03 0.18 -1.14 0.00 0.00 176.83 176.20 1u6s n LEU 98 N -4.29 0.04 0.00 5.07 4.77 -0.68 -4.91 117.00 117.01 1u6s n LEU 98 Ca -0.02 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 1u6s n LEU 98 Cb 0.26 -0.44 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1u6s n LEU 98 CO 0.37 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1u6s n GLY 99 N 1.46 0.52 2.68 -0.72 0.00 -0.90 -4.63 105.19 103.59 1u6s n GLY 99 Ca 0.08 -0.62 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 1u6s n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u6s n ALA 100 N 0.49 4.23 0.32 4.61 0.00 -0.21 -4.85 120.51 125.10 1u6s n ALA 100 Ca 0.00 -4.62 0.13 0.00 0.00 0.00 0.00 53.44 48.96 1u6s n ALA 100 Cb 0.00 -0.81 0.60 0.00 0.00 0.00 0.00 19.45 19.24 1u6s n ALA 100 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1u6s h LYS 101 N 3.47 0.00 0.00 0.00 2.10 -1.81 -3.13 116.57 117.19 1u6s h LYS 101 Ca 0.15 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.57 1u6s h LYS 101 Cb 0.60 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.89 1u6s h LYS 101 CO 0.80 0.00 -1.45 0.78 -2.00 0.00 0.00 179.45 177.57 1u6s h GLY 102 N 1.59 0.00 -2.41 0.07 0.00 -1.92 -3.43 103.07 96.96 1u6s h GLY 102 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 1u6s h GLY 102 CO 0.00 0.00 0.40 0.29 0.00 0.00 0.00 176.54 177.23 1u6s n ILE 103 N -3.05 4.36 -1.07 2.60 -5.35 -1.18 -4.97 119.36 110.70 1u6s n ILE 103 Ca -0.11 -0.50 -0.32 0.00 -0.27 0.00 0.00 62.75 61.54 1u6s n ILE 103 Cb 0.95 -1.40 0.13 0.00 -1.74 0.00 0.00 39.64 37.58 1u6s n ILE 103 CO 0.00 0.00 0.00 -1.48 -1.76 0.00 0.00 176.55 173.31 1u6s s LEU 104 N -3.41 3.06 0.00 7.28 0.05 -1.19 -4.85 118.68 119.61 1u6s s LEU 104 Ca 0.79 2.19 0.00 0.00 0.05 0.00 0.00 54.13 57.16 1u6s s LEU 104 Cb -0.40 -4.57 0.00 0.00 -2.05 0.00 0.00 46.19 39.17 1u6s s LEU 104 CO 0.44 -2.61 0.00 0.61 -0.55 0.00 0.00 176.35 174.24 1u6s n GLY 105 N 0.04 1.99 3.60 -3.48 0.00 -1.26 -1.64 105.19 104.44 1u6s n GLY 105 Ca 0.12 -0.75 -0.09 0.00 0.00 0.00 0.00 46.02 45.30 1u6s n GLY 105 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1u6s s PHE 106 N -2.00 -0.04 -0.06 1.61 -0.71 -1.15 -4.75 117.98 110.88 1u6s s PHE 106 Ca 0.00 -0.33 -0.13 0.00 -1.04 0.00 0.00 56.93 55.43 1u6s s PHE 106 Cb 0.00 0.41 -0.05 0.00 -1.21 0.00 0.00 43.02 42.17 1u6s s PHE 106 CO 0.00 -0.99 0.34 -0.51 -1.34 0.00 0.00 175.22 172.71 1u6s s ASP 107 N -2.91 6.65 -0.13 1.98 1.11 -1.26 -2.25 116.67 119.86 1u6s s ASP 107 Ca 0.12 0.77 0.02 0.00 0.18 0.00 0.00 52.55 53.65 1u6s s ASP 107 Cb -0.02 -2.20 0.01 0.00 1.07 0.00 0.00 42.92 41.78 1u6s s ASP 107 CO 0.01 0.29 -0.21 -0.22 1.18 0.00 0.00 175.17 176.22 1u6s s LEU 108 N -0.72 2.04 -0.12 1.23 0.20 -0.09 -4.98 118.68 116.25 1u6s s LEU 108 Ca 0.21 -0.57 0.02 0.00 0.69 0.00 0.00 54.13 54.47 1u6s s LEU 108 Cb -0.15 -1.38 -0.01 0.00 -0.43 0.00 0.00 46.19 44.22 1u6s s LEU 108 CO 0.10 0.07 -0.18 -0.44 -0.29 0.00 0.00 176.35 175.61 1u6s s SER 109 N 0.82 3.62 -0.31 3.68 0.01 -1.26 -2.53 113.70 117.72 1u6s s SER 109 Ca -0.08 -0.43 0.12 0.00 1.31 0.00 0.00 55.95 56.88 1u6s s SER 109 Cb -0.16 -1.52 0.37 0.00 0.21 0.00 0.00 66.02 64.93 1u6s s SER 109 CO -0.01 0.17 1.46 0.00 0.41 0.00 0.00 173.24 175.26 1u6s n ALA 110 N 3.51 2.55 -0.82 1.44 0.00 -1.26 -4.96 120.51 120.97 1u6s n ALA 110 Ca -0.18 -0.92 0.00 0.00 0.00 0.00 0.00 53.44 52.34 1u6s n ALA 110 Cb 0.53 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.19 1u6s n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u6s n GLY 111 N -1.41 1.89 0.06 0.00 0.00 -1.26 -2.22 105.19 102.25 1u6s n GLY 111 Ca -0.17 -0.47 0.10 0.00 0.00 0.00 0.00 46.02 45.49 1u6s n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u6s n ALA 112 N 6.56 1.81 1.23 4.61 0.00 -1.26 -2.01 120.51 131.45 1u6s n ALA 112 Ca 0.00 -0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.58 1u6s n ALA 112 Cb 0.00 -1.35 0.67 0.00 0.00 0.00 0.00 19.45 18.77 1u6s n ALA 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1u6s n ALA 113 N -1.64 2.50 -0.25 0.00 0.00 -0.94 -4.09 120.51 116.08 1u6s n ALA 113 Ca 0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 53.44 53.32 1u6s n ALA 113 Cb 0.24 -1.45 0.06 0.00 0.00 0.00 0.00 19.45 18.30 1u6s n ALA 113 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1u6s h GLY 114 N 5.00 0.33 0.32 0.00 0.00 -1.34 -2.10 103.07 105.28 1u6s h GLY 114 Ca 0.00 0.31 0.02 0.00 0.00 0.00 0.00 47.33 47.67 1u6s h GLY 114 CO 0.00 -0.26 -0.36 -2.75 0.00 0.00 0.00 176.54 173.17 1u6s h PHE 115 N -0.05 -1.01 -0.77 5.60 3.57 -1.73 0.34 116.94 122.90 1u6s h PHE 115 Ca 0.32 0.03 0.11 0.00 3.53 0.00 0.00 57.97 61.96 1u6s h PHE 115 Cb 0.55 0.43 -0.08 0.00 2.79 0.00 0.00 35.95 39.64 1u6s h PHE 115 CO -0.62 -0.46 0.38 0.78 -2.23 0.00 0.00 178.31 176.16 1u6s h GLY 116 N -0.57 1.18 0.87 2.40 0.00 -1.77 0.67 103.07 105.85 1u6s h GLY 116 Ca 0.04 -0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 1u6s h GLY 116 CO -0.24 0.02 0.03 -0.97 0.00 0.00 0.00 176.54 175.38 1u6s h TYR 117 N 0.60 0.50 -0.54 5.60 0.05 -0.83 -0.50 116.97 121.85 1u6s h TYR 117 Ca 0.39 -0.08 -0.01 0.00 0.05 0.00 0.00 58.73 59.09 1u6s h TYR 117 Cb 0.48 -0.13 -0.03 0.00 1.01 0.00 0.00 36.73 38.06 1u6s h TYR 117 CO -0.11 0.58 0.31 0.00 -1.05 0.00 0.00 178.16 177.89 1u6s h ALA 118 N 0.85 0.69 -0.17 3.88 0.00 0.51 0.20 119.26 125.23 1u6s h ALA 118 Ca 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1u6s h ALA 118 Cb 0.37 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1u6s h ALA 118 CO 0.01 0.20 0.08 1.25 0.00 0.00 0.00 179.25 180.79 1u6s h LEU 119 N 0.73 0.22 -0.58 0.00 5.85 0.35 0.16 115.31 122.03 1u6s h LEU 119 Ca 0.19 -0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.82 1u6s h LEU 119 Cb 0.02 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 1u6s h LEU 119 CO -0.03 0.28 0.35 1.23 -0.34 0.00 0.00 178.44 179.93 1u6s h GLY 120 N 0.14 0.83 0.98 3.75 0.00 -0.80 -0.96 103.07 107.02 1u6s h GLY 120 Ca 0.06 -0.26 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 1u6s h GLY 120 CO -0.01 0.22 0.21 0.00 0.00 0.00 0.00 176.54 176.96 1u6s h ALA 121 N 1.26 0.71 -0.71 3.60 0.00 -0.40 -0.85 119.26 122.87 1u6s h ALA 121 Ca 0.24 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.96 1u6s h ALA 121 Cb 0.04 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1u6s h ALA 121 CO -0.11 0.33 0.34 0.00 0.00 0.00 0.00 179.25 179.81 1u6s h ALA 122 N 1.06 0.91 -0.63 0.00 0.00 -0.49 0.01 119.26 120.12 1u6s h ALA 122 Ca 0.18 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1u6s h ALA 122 Cb 0.21 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1u6s h ALA 122 CO -0.01 0.48 0.19 0.00 0.00 0.00 0.00 179.25 179.91 1u6s h ALA 123 N 1.16 0.83 -0.34 0.00 0.00 -1.03 -0.75 119.26 119.14 1u6s h ALA 123 Ca 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1u6s h ALA 123 Cb 0.12 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1u6s h ALA 123 CO -0.03 0.50 0.12 -0.44 0.00 0.00 0.00 179.25 179.40 1u6s h ASP 124 N 0.91 0.49 -0.67 0.00 3.32 -0.73 -1.06 116.42 118.67 1u6s h ASP 124 Ca 0.20 -0.19 -0.07 0.00 0.02 0.00 0.00 57.03 56.99 1u6s h ASP 124 Cb 0.30 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1u6s h ASP 124 CO -0.01 0.55 0.16 -0.03 -1.72 0.00 0.00 179.24 178.20 1u6s h MET 125 N 0.40 1.08 -0.09 3.56 4.05 -0.89 0.15 114.93 123.19 1u6s h MET 125 Ca 0.11 -0.26 -0.01 0.00 -0.28 0.00 0.00 59.70 59.25 1u6s h MET 125 Cb 0.23 -0.14 -0.00 0.00 -0.80 0.00 0.00 31.60 30.89 1u6s h MET 125 CO -0.01 0.97 -0.00 0.82 0.23 0.00 0.00 176.91 178.92 1u6s h ILE 126 N 1.01 1.25 -0.39 1.77 2.04 -1.03 0.11 117.51 122.27 1u6s h ILE 126 Ca 0.21 -0.80 -0.06 0.00 1.00 0.00 0.00 64.86 65.22 1u6s h ILE 126 Cb 0.37 1.61 -0.02 0.00 -0.74 0.00 0.00 36.82 38.04 1u6s h ILE 126 CO 0.00 0.22 0.00 0.03 0.00 0.00 0.00 178.15 178.41 1u6s h ARG 127 N -0.12 0.62 0.00 2.37 3.08 -1.13 -1.76 114.38 117.43 1u6s h ARG 127 Ca 0.02 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1u6s h ARG 127 Cb 0.35 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.31 1u6s h ARG 127 CO 0.00 0.64 0.00 0.78 -1.07 0.00 0.00 179.97 180.33 1u6s h GLY 128 N 0.90 0.00 0.00 0.04 0.00 -0.59 -0.60 103.07 102.81 1u6s h GLY 128 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.45 1u6s h GLY 128 CO 0.01 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.16 1u6s n GLY 129 N 0.15 0.69 0.01 4.60 0.00 -0.43 -3.66 105.19 106.55 1u6s n GLY 129 Ca 0.01 -0.57 0.14 0.00 0.00 0.00 0.00 46.02 45.61 1u6s n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1u6s n GLY 130 N -2.47 -1.39 3.56 -0.02 0.00 0.26 -4.79 105.19 100.34 1u6s n GLY 130 Ca 0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 46.02 45.80 1u6s n GLY 130 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u6s s ALA 131 N -2.89 -1.96 -0.17 4.61 0.00 -1.22 -4.98 121.76 115.15 1u6s s ALA 131 Ca 0.17 1.38 -0.02 0.00 0.00 0.00 0.00 51.96 53.50 1u6s s ALA 131 Cb 0.19 -0.04 -0.10 0.00 0.00 0.00 0.00 23.12 23.17 1u6s s ALA 131 CO 0.54 -0.58 -0.17 0.00 0.00 0.00 0.00 175.76 175.54 1u6s n ALA 132 N -0.02 1.70 -2.92 0.00 0.00 -1.26 -4.13 120.51 113.89 1u6s n ALA 132 Ca -0.04 -0.71 -0.20 0.00 0.00 0.00 0.00 53.44 52.48 1u6s n ALA 132 Cb 0.60 0.16 -0.15 0.00 0.00 0.00 0.00 19.45 20.06 1u6s n ALA 132 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1u6s s THR 133 N -2.33 0.80 0.06 0.00 2.01 -1.26 -3.99 115.64 110.92 1u6s s THR 133 Ca -0.23 -0.39 0.00 0.00 0.31 0.00 0.00 61.69 61.38 1u6s s THR 133 Cb 0.07 -0.70 -0.03 0.00 0.01 0.00 0.00 72.50 71.85 1u6s s THR 133 CO 0.36 0.24 -0.05 -0.04 -0.69 0.00 0.00 174.62 174.45 1u6s s MET 134 N 0.07 0.60 -0.15 4.92 1.00 0.13 -0.33 119.30 125.54 1u6s s MET 134 Ca -0.01 -1.06 -0.06 0.00 0.00 0.00 0.00 55.69 54.55 1u6s s MET 134 Cb -0.07 0.01 -0.04 0.00 0.00 0.00 0.00 34.83 34.72 1u6s s MET 134 CO 0.00 -0.05 0.06 -0.51 0.00 0.00 0.00 175.02 174.52 1u6s s LEU 135 N -2.47 3.85 -0.20 -0.03 1.43 -0.04 -0.27 118.68 120.95 1u6s s LEU 135 Ca 0.01 0.15 0.01 0.00 -1.03 0.00 0.00 54.13 53.28 1u6s s LEU 135 Cb 0.01 -1.95 0.04 0.00 0.03 0.00 0.00 46.19 44.32 1u6s s LEU 135 CO -0.05 0.25 -0.15 -0.69 0.23 0.00 0.00 176.35 175.94 1u6s s VAL 136 N -0.09 1.95 -0.13 -1.59 1.01 -0.81 -1.21 120.40 119.53 1u6s s VAL 136 Ca 0.07 -1.11 0.01 0.00 0.00 0.00 0.00 61.98 60.95 1u6s s VAL 136 Cb -0.12 -1.90 0.02 0.00 0.00 0.00 0.00 36.38 34.37 1u6s s VAL 136 CO 0.01 0.30 -0.16 0.54 0.00 0.00 0.00 175.10 175.79 1u6s s VAL 137 N 1.28 1.64 -0.16 2.92 0.11 -0.78 -1.04 120.40 124.38 1u6s s VAL 137 Ca -0.00 -0.70 -0.17 0.00 -2.93 0.00 0.00 61.98 58.18 1u6s s VAL 137 Cb -0.16 -1.51 -0.04 0.00 -1.53 0.00 0.00 36.38 33.15 1u6s s VAL 137 CO -0.10 0.47 0.44 -0.83 -3.33 0.00 0.00 175.10 171.75 1u6s s GLY 138 N 1.20 2.25 -0.00 6.54 0.00 0.10 -1.27 107.32 116.13 1u6s s GLY 138 Ca -0.01 -0.34 -0.03 0.00 0.00 0.00 0.00 44.72 44.34 1u6s s GLY 138 CO -0.06 0.78 0.06 -1.08 0.00 0.00 0.00 173.10 172.79 1u6s s THR 139 N 0.91 0.06 -0.23 0.90 -1.32 -0.73 -1.10 115.64 114.12 1u6s s THR 139 Ca 0.23 -0.50 -0.10 0.00 -1.21 0.00 0.00 61.69 60.10 1u6s s THR 139 Cb -0.15 -0.26 0.09 0.00 -1.51 0.00 0.00 72.50 70.67 1u6s s THR 139 CO 0.09 -0.28 0.52 -0.70 -2.21 0.00 0.00 174.62 172.04 1u6s s GLU 140 N -0.87 0.48 -0.81 7.08 2.56 -0.49 -4.30 118.70 122.36 1u6s s GLU 140 Ca -0.10 1.10 0.02 0.00 0.00 0.00 0.00 54.97 55.99 1u6s s GLU 140 Cb -0.06 0.30 0.26 0.00 2.00 0.00 0.00 34.13 36.64 1u6s s GLU 140 CO 0.00 -0.19 0.97 1.17 -0.56 0.00 0.00 175.26 176.65 1u6s n LYS 141 N 4.86 3.11 0.21 4.30 4.81 -1.26 -2.00 118.16 132.18 1u6s n LYS 141 Ca -0.16 -4.61 0.09 0.00 -0.87 0.00 0.00 58.31 52.76 1u6s n LYS 141 Cb 0.53 -2.35 0.35 0.00 0.02 0.00 0.00 35.03 33.57 1u6s n LYS 141 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1u6s h LEU 142 N 4.81 0.00 -0.99 3.14 3.38 -1.94 -3.37 115.31 120.34 1u6s h LEU 142 Ca 0.19 0.00 0.12 0.00 0.09 0.00 0.00 57.88 58.29 1u6s h LEU 142 Cb 0.67 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.33 1u6s h LEU 142 CO 0.99 0.25 0.61 0.77 0.09 0.00 0.00 178.44 181.15 1u6s h SER 143 N 0.00 0.89 0.32 -0.43 4.64 -1.87 0.97 113.55 118.08 1u6s h SER 143 Ca -0.00 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1u6s h SER 143 Cb 0.90 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1u6s h SER 143 CO 0.03 0.46 0.00 -2.65 -0.87 0.00 0.00 176.83 173.81 1u6s n PRO 144 N -4.65 0.15 0.00 4.77 -0.02 -1.26 -2.46 135.00 131.53 1u6s n PRO 144 Ca 0.19 0.18 0.11 0.00 -2.02 0.00 0.00 63.50 61.95 1u6s n PRO 144 Cb 0.36 -1.50 0.04 0.00 -0.02 0.00 0.00 33.50 32.39 1u6s n PRO 144 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1u6s n THR 145 N -1.34 0.00 -2.83 3.45 -2.24 0.33 -4.95 114.28 106.70 1u6s n THR 145 Ca 0.06 -0.39 -0.41 0.00 -2.27 0.00 0.00 64.05 61.04 1u6s n THR 145 Cb 0.13 1.35 -0.04 0.00 -2.10 0.00 0.00 70.33 69.67 1u6s n THR 145 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1u6s s ILE 146 N -2.06 4.83 -0.62 2.28 1.01 -1.03 -0.73 121.20 124.87 1u6s s ILE 146 Ca 0.21 1.86 -0.23 0.00 0.00 0.00 0.00 60.65 62.48 1u6s s ILE 146 Cb 0.17 -4.23 0.06 0.00 0.01 0.00 0.00 42.46 38.47 1u6s s ILE 146 CO 0.40 0.24 0.98 -0.62 0.00 0.00 0.00 174.94 175.93 1u6s s ASP 147 N 0.62 6.23 0.03 3.58 3.68 -1.26 -4.91 116.67 124.64 1u6s s ASP 147 Ca 0.46 -0.71 0.03 0.00 2.13 0.00 0.00 52.55 54.47 1u6s s ASP 147 Cb -0.21 -2.44 0.17 0.00 -1.45 0.00 0.00 42.92 39.00 1u6s s ASP 147 CO 0.25 -1.39 1.10 0.23 0.13 0.00 0.00 175.17 175.50 1u6s n MET 148 N 7.74 0.01 0.00 4.34 2.81 -1.26 -0.49 117.12 130.28 1u6s n MET 148 Ca -0.01 0.49 0.10 0.00 -1.81 0.00 0.00 57.70 56.47 1u6s n MET 148 Cb 0.46 -1.55 -0.05 0.00 -0.71 0.00 0.00 33.22 31.38 1u6s n MET 148 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1u6s n TYR 149 N -1.58 0.00 -2.19 2.03 4.02 -1.26 -4.35 117.16 113.84 1u6s n TYR 149 Ca 0.00 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.50 1u6s n TYR 149 Cb 0.02 -0.03 -0.03 0.00 -0.02 0.00 0.00 39.34 39.28 1u6s n TYR 149 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1u6s s ASP 150 N -2.87 5.55 0.00 7.72 3.68 0.36 -4.83 116.67 126.28 1u6s s ASP 150 Ca 0.11 0.14 0.03 0.00 2.13 0.00 0.00 52.55 54.97 1u6s s ASP 150 Cb 0.17 -2.54 0.15 0.00 -1.45 0.00 0.00 42.92 39.24 1u6s s ASP 150 CO 0.78 -2.20 1.11 -1.14 0.13 0.00 0.00 175.17 173.85 1u6s n ARG 151 N 9.21 0.00 0.01 4.34 0.63 -1.26 -2.07 116.66 127.51 1u6s n ARG 151 Ca 0.15 0.44 0.11 0.00 -0.92 0.00 0.00 57.85 57.63 1u6s n ARG 151 Cb 0.51 -1.50 -0.09 0.00 0.45 0.00 0.00 32.46 31.83 1u6s n ARG 151 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1u6s n GLY 152 N -1.15 -1.07 0.00 5.14 0.00 -1.26 -4.80 105.19 102.05 1u6s n GLY 152 Ca 0.01 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1u6s n GLY 152 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1u6s n ASN 153 N -1.91 0.00 0.15 1.61 0.23 -1.04 -4.88 115.26 109.43 1u6s n ASN 153 Ca 0.01 0.00 0.18 0.00 -0.53 0.00 0.00 54.58 54.24 1u6s n ASN 153 Cb 0.44 0.00 0.79 0.00 -2.08 0.00 0.00 39.78 38.93 1u6s n ASN 153 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1u6s n PHE 155 N -3.80 0.16 -0.10 0.00 1.16 -1.26 -4.53 117.46 109.08 1u6s n PHE 155 Ca 0.04 -0.08 -0.17 0.00 -1.87 0.00 0.00 57.45 55.37 1u6s n PHE 155 Cb 0.45 0.00 -0.08 0.00 -1.61 0.00 0.00 39.48 38.24 1u6s n PHE 155 CO 0.00 0.00 0.00 -0.89 -1.87 0.00 0.00 176.76 174.00 1u6s n ILE 156 N 0.54 1.50 -3.18 1.97 5.41 0.36 -4.89 119.36 121.06 1u6s n ILE 156 Ca 0.17 0.02 -0.33 0.00 1.00 0.00 0.00 62.75 63.62 1u6s n ILE 156 Cb 0.40 -2.15 -0.06 0.00 -0.71 0.00 0.00 39.64 37.13 1u6s n ILE 156 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 1u6s s PHE 157 N -2.36 3.39 0.29 1.39 0.40 -1.25 -0.50 117.98 119.34 1u6s s PHE 157 Ca -0.25 1.17 -0.05 0.00 -0.60 0.00 0.00 56.93 57.19 1u6s s PHE 157 Cb 0.05 -2.49 -0.01 0.00 0.51 0.00 0.00 43.02 41.08 1u6s s PHE 157 CO 0.46 0.13 0.42 0.00 0.70 0.00 0.00 175.22 176.93 1u6s s ALA 158 N -1.93 0.56 0.20 5.36 0.00 0.36 -4.77 121.76 121.53 1u6s s ALA 158 Ca 0.52 -1.37 0.05 0.00 0.00 0.00 0.00 51.96 51.16 1u6s s ALA 158 Cb -0.11 1.18 -0.04 0.00 0.00 0.00 0.00 23.12 24.15 1u6s s ALA 158 CO 0.18 -0.78 0.22 -0.51 0.00 0.00 0.00 175.76 174.88 1u6s s ASP 159 N -3.16 5.85 0.00 0.00 1.01 -0.33 -3.97 116.67 116.06 1u6s s ASP 159 Ca 0.30 -0.06 0.00 0.00 0.71 0.00 0.00 52.55 53.50 1u6s s ASP 159 Cb 0.01 -1.61 0.00 0.00 1.01 0.00 0.00 42.92 42.33 1u6s s ASP 159 CO 0.16 0.01 0.00 0.61 0.21 0.00 0.00 175.17 176.16 1u6s n GLY 160 N -0.80 2.46 3.36 0.21 0.00 -0.85 -4.61 105.19 104.97 1u6s n GLY 160 Ca -0.08 -1.30 -0.15 0.00 0.00 0.00 0.00 46.02 44.49 1u6s n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u6s s ALA 161 N -2.00 -1.20 -0.06 4.61 0.00 -0.48 -1.39 121.76 121.24 1u6s s ALA 161 Ca 0.00 0.83 -0.15 0.00 0.00 0.00 0.00 51.96 52.64 1u6s s ALA 161 Cb 0.00 -0.08 0.03 0.00 0.00 0.00 0.00 23.12 23.07 1u6s s ALA 161 CO 0.00 -0.30 0.35 0.00 0.00 0.00 0.00 175.76 175.81 1u6s s ALA 162 N -1.05 -0.87 0.13 0.00 0.00 -0.26 0.22 121.76 119.93 1u6s s ALA 162 Ca -0.11 0.60 0.07 0.00 0.00 0.00 0.00 51.96 52.52 1u6s s ALA 162 Cb -0.03 -0.15 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 1u6s s ALA 162 CO 0.06 -0.24 -0.17 0.00 0.00 0.00 0.00 175.76 175.41 1u6s s ALA 163 N -0.83 1.70 0.04 0.00 0.00 -0.15 -0.73 121.76 121.79 1u6s s ALA 163 Ca -0.09 -1.33 0.09 0.00 0.00 0.00 0.00 51.96 50.63 1u6s s ALA 163 Cb -0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 23.12 22.91 1u6s s ALA 163 CO 0.03 0.20 -0.24 0.14 0.00 0.00 0.00 175.76 175.89 1u6s s VAL 164 N -1.86 2.31 -0.16 0.00 -7.23 -0.21 -0.57 120.40 112.68 1u6s s VAL 164 Ca 0.10 -1.33 -0.17 0.00 -1.81 0.00 0.00 61.98 58.77 1u6s s VAL 164 Cb -0.06 -1.92 -0.04 0.00 0.56 0.00 0.00 36.38 34.92 1u6s s VAL 164 CO 0.04 0.37 0.46 -0.69 -0.31 0.00 0.00 175.10 174.97 1u6s s VAL 165 N -0.83 5.18 -0.11 1.32 1.01 -0.82 -1.92 120.40 124.23 1u6s s VAL 165 Ca 0.12 0.88 0.02 0.00 0.00 0.00 0.00 61.98 63.00 1u6s s VAL 165 Cb -0.10 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.47 1u6s s VAL 165 CO 0.03 0.28 -0.17 -0.69 0.00 0.00 0.00 175.10 174.54 1u6s s VAL 166 N 1.00 2.70 0.13 2.92 1.01 0.63 -0.15 120.40 128.64 1u6s s VAL 166 Ca 0.23 -0.80 -0.18 0.00 0.00 0.00 0.00 61.98 61.23 1u6s s VAL 166 Cb -0.15 -2.09 0.06 0.00 0.00 0.00 0.00 36.38 34.21 1u6s s VAL 166 CO 0.09 0.55 0.87 0.61 0.00 0.00 0.00 175.10 177.22 1u6s n GLY 167 N 3.32 0.68 3.74 4.51 0.00 -1.01 0.22 105.19 116.64 1u6s n GLY 167 Ca -0.18 -1.10 -0.41 0.00 0.00 0.00 0.00 46.02 44.32 1u6s n GLY 167 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1u6s s GLU 168 N -2.04 4.31 0.22 1.61 2.12 -1.26 -0.66 118.70 123.01 1u6s s GLU 168 Ca 0.20 2.19 0.09 0.00 0.36 0.00 0.00 54.97 57.81 1u6s s GLU 168 Cb -0.02 -3.16 -0.05 0.00 0.26 0.00 0.00 34.13 31.16 1u6s s GLU 168 CO 0.04 -0.38 -0.16 0.95 -0.54 0.00 0.00 175.26 175.17 1u6s s THR 169 N 0.26 1.94 0.40 -1.70 -4.23 -0.96 -4.80 115.64 106.55 1u6s s THR 169 Ca 0.60 -2.23 0.11 0.00 -1.18 0.00 0.00 61.69 58.99 1u6s s THR 169 Cb -0.40 -2.09 0.32 0.00 1.34 0.00 0.00 72.50 71.67 1u6s s THR 169 CO 0.39 -0.51 1.96 -0.65 -0.54 0.00 0.00 174.62 175.27 1u6s h PRO 170 N 2.56 0.53 -4.87 3.99 0.11 -1.96 -3.42 132.00 128.94 1u6s h PRO 170 Ca -0.39 -0.03 -0.34 0.00 0.11 0.00 0.00 66.00 65.35 1u6s h PRO 170 Cb 1.23 -0.12 -0.22 0.00 0.11 0.00 0.00 31.00 32.00 1u6s h PRO 170 CO 0.60 0.35 -0.76 -0.06 -0.21 0.00 0.00 178.00 177.92 1u6s s PHE 171 N -5.50 0.88 -0.33 0.65 0.40 -1.26 -4.96 117.98 107.86 1u6s s PHE 171 Ca -0.09 -0.43 -0.36 0.00 -0.60 0.00 0.00 56.93 55.45 1u6s s PHE 171 Cb 0.20 -0.52 -0.12 0.00 0.51 0.00 0.00 43.02 43.09 1u6s s PHE 171 CO 0.76 -0.02 2.11 0.94 0.70 0.00 0.00 175.22 179.71 1u6s n GLN 172 N 1.62 1.08 -0.00 0.44 -0.06 -1.26 -4.60 117.38 114.60 1u6s n GLN 172 Ca -0.21 0.32 0.08 0.00 -2.00 0.00 0.00 57.00 55.20 1u6s n GLN 172 Cb 0.55 -2.37 -0.11 0.00 -4.06 0.00 0.00 30.24 24.25 1u6s n GLN 172 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1u6s n GLY 173 N 6.18 -0.68 2.86 1.69 0.00 0.06 -4.87 105.19 110.43 1u6s n GLY 173 Ca 0.39 -0.46 -0.28 0.00 0.00 0.00 0.00 46.02 45.67 1u6s n GLY 173 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u6s s ILE 174 N -2.85 1.02 1.14 -0.61 1.01 -0.78 -1.35 121.20 118.78 1u6s s ILE 174 Ca 0.01 -0.69 -0.14 0.00 0.00 0.00 0.00 60.65 59.84 1u6s s ILE 174 Cb 0.12 -1.29 0.27 0.00 0.01 0.00 0.00 42.46 41.57 1u6s s ILE 174 CO 0.71 0.02 1.04 -0.83 0.00 0.00 0.00 174.94 175.88 1u6s s GLY 175 N 1.66 1.54 0.39 6.18 0.00 0.19 -4.94 107.32 112.33 1u6s s GLY 175 Ca -0.01 -0.31 -0.26 0.00 0.00 0.00 0.00 44.72 44.14 1u6s s GLY 175 CO -0.07 0.41 1.30 -4.14 0.00 0.00 0.00 173.10 170.60 1u6s s PRO 176 N -4.69 4.03 0.19 2.90 0.02 -1.26 -4.71 135.00 131.48 1u6s s PRO 176 Ca 0.68 2.16 -0.30 0.00 0.02 0.00 0.00 61.00 63.56 1u6s s PRO 176 Cb -0.22 -2.80 -0.08 0.00 0.02 0.00 0.00 34.50 31.42 1u6s s PRO 176 CO 0.62 -0.45 1.28 0.99 -0.33 0.00 0.00 177.00 179.11 1u6s s THR 177 N -1.25 3.32 -0.17 0.99 2.01 -1.26 -4.61 115.64 114.67 1u6s s THR 177 Ca 0.56 1.09 0.00 0.00 0.31 0.00 0.00 61.69 63.65 1u6s s THR 177 Cb -0.38 -3.70 0.01 0.00 0.01 0.00 0.00 72.50 68.44 1u6s s THR 177 CO 0.49 0.16 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.74 1u6s s VAL 178 N 0.10 2.51 0.12 3.82 1.01 -0.13 -4.99 120.40 122.83 1u6s s VAL 178 Ca 0.56 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 61.61 1u6s s VAL 178 Cb -0.35 -2.07 0.01 0.00 0.00 0.00 0.00 36.38 33.97 1u6s s VAL 178 CO 0.38 0.51 0.30 0.00 0.00 0.00 0.00 175.10 176.29 1u6s s ALA 179 N 1.08 -0.50 0.00 5.51 0.00 -1.26 -0.44 121.76 126.15 1u6s s ALA 179 Ca -0.00 -0.42 0.00 0.00 0.00 0.00 0.00 51.96 51.54 1u6s s ALA 179 Cb -0.14 0.63 0.00 0.00 0.00 0.00 0.00 23.12 23.60 1u6s s ALA 179 CO -0.05 -0.59 0.00 0.41 0.00 0.00 0.00 175.76 175.53 1u6s n GLY 180 N -0.16 0.88 1.96 0.00 0.00 -0.68 -5.01 105.19 102.19 1u6s n GLY 180 Ca -0.14 -0.65 -0.04 0.00 0.00 0.00 0.00 46.02 45.20 1u6s n GLY 180 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1u6s n SER 181 N -0.02 -1.09 -3.13 1.61 3.41 -1.26 -1.29 113.62 111.85 1u6s n SER 181 Ca 0.00 -1.70 -0.17 0.00 -0.26 0.00 0.00 58.87 56.74 1u6s n SER 181 Cb 0.00 1.80 -0.05 0.00 -0.26 0.00 0.00 64.21 65.70 1u6s n SER 181 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1u6s s ASP 182 N -2.14 0.21 0.38 4.04 3.68 0.91 -4.94 116.67 118.81 1u6s s ASP 182 Ca 0.10 -2.42 0.26 0.00 2.13 0.00 0.00 52.55 52.62 1u6s s ASP 182 Cb -0.02 0.60 1.40 0.00 -1.45 0.00 0.00 42.92 43.44 1u6s s ASP 182 CO 0.05 -0.13 1.80 1.23 0.13 0.00 0.00 175.17 178.25 1u6s h GLY 183 N 5.48 0.00 2.00 2.66 0.00 -1.75 -1.99 103.07 109.47 1u6s h GLY 183 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.50 1u6s h GLY 183 CO 0.21 0.00 0.00 0.83 0.00 0.00 0.00 176.54 177.58 1u6s h GLU 184 N 0.00 0.00 -0.39 4.80 4.39 -1.95 -3.08 114.58 118.34 1u6s h GLU 184 Ca 0.00 0.00 -0.25 0.00 0.34 0.00 0.00 59.36 59.45 1u6s h GLU 184 Cb 0.02 0.00 -0.16 0.00 -0.10 0.00 0.00 28.75 28.51 1u6s h GLU 184 CO 0.00 0.00 -0.27 1.04 -1.16 0.00 0.00 179.01 178.62 1u6s n GLN 185 N -2.54 2.19 0.29 2.33 6.02 -0.75 -4.73 117.38 120.20 1u6s n GLN 185 Ca 0.02 -3.43 0.15 0.00 -0.01 0.00 0.00 57.00 53.73 1u6s n GLN 185 Cb 0.31 -1.90 0.89 0.00 1.02 0.00 0.00 30.24 30.56 1u6s n GLN 185 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1u6s h ALA 186 N 1.31 1.51 0.00 -1.58 0.00 -1.66 -1.69 119.26 117.15 1u6s h ALA 186 Ca 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1u6s h ALA 186 Cb 1.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1u6s h ALA 186 CO 0.46 0.02 0.00 -0.40 0.00 0.00 0.00 179.25 179.32 1u6s n ASP 187 N -3.85 0.27 -0.23 0.00 5.75 -1.26 -4.08 116.55 113.15 1u6s n ASP 187 Ca -0.03 0.53 -0.04 0.00 -0.01 0.00 0.00 54.79 55.25 1u6s n ASP 187 Cb 0.10 -0.60 0.07 0.00 -1.03 0.00 0.00 41.12 39.66 1u6s n ASP 187 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1u6s h ALA 188 N 2.75 0.85 -3.26 2.12 0.00 -1.68 -3.40 119.26 116.64 1u6s h ALA 188 Ca 0.00 -0.02 -0.46 0.00 0.00 0.00 0.00 54.91 54.43 1u6s h ALA 188 Cb 0.52 -0.20 -0.37 0.00 0.00 0.00 0.00 17.79 17.74 1u6s h ALA 188 CO 0.00 0.15 -0.78 0.42 0.00 0.00 0.00 179.25 179.04 1u6s s ILE 189 N -6.12 0.59 0.13 0.00 1.01 -1.26 0.09 121.20 115.64 1u6s s ILE 189 Ca -0.13 -0.03 -0.25 0.00 0.00 0.00 0.00 60.65 60.25 1u6s s ILE 189 Cb 0.15 -0.68 0.07 0.00 0.01 0.00 0.00 42.46 42.00 1u6s s ILE 189 CO 0.76 0.29 0.75 0.00 0.00 0.00 0.00 174.94 176.73 1u6s s ARG 190 N 1.75 1.21 -0.20 2.79 1.70 -0.52 -4.29 118.95 121.39 1u6s s ARG 190 Ca 0.03 -0.52 -0.23 0.00 -0.47 0.00 0.00 55.73 54.54 1u6s s ARG 190 Cb -0.13 0.51 -0.02 0.00 -0.57 0.00 0.00 34.95 34.74 1u6s s ARG 190 CO -0.05 -0.54 0.73 -1.14 -1.08 0.00 0.00 175.30 173.22 1u6s s GLN 191 N -3.53 4.22 0.12 3.89 0.74 -1.26 -0.42 119.66 123.42 1u6s s GLN 191 Ca 0.05 0.80 -0.12 0.00 0.05 0.00 0.00 55.36 56.14 1u6s s GLN 191 Cb -0.02 -3.60 -0.09 0.00 1.10 0.00 0.00 33.01 30.40 1u6s s GLN 191 CO -0.07 -0.34 1.40 0.38 -0.55 0.00 0.00 175.29 176.11 1u6s h ASP 192 N 7.52 0.97 -3.29 6.67 2.03 -1.89 -3.42 116.42 125.01 1u6s h ASP 192 Ca -0.29 -0.53 -0.66 0.00 -0.73 0.00 0.00 57.03 54.82 1u6s h ASP 192 Cb 1.13 -0.28 -0.30 0.00 -0.83 0.00 0.00 39.33 39.05 1u6s h ASP 192 CO 0.81 1.32 -0.78 -0.63 -1.03 0.00 0.00 179.24 178.93 1u6s s ILE 193 N -4.14 2.86 0.65 4.15 1.01 -1.26 -5.05 121.20 119.42 1u6s s ILE 193 Ca -0.11 -0.69 -0.15 0.00 0.00 0.00 0.00 60.65 59.69 1u6s s ILE 193 Cb 0.10 -2.24 -0.00 0.00 0.01 0.00 0.00 42.46 40.33 1u6s s ILE 193 CO 0.89 0.49 1.12 1.51 0.00 0.00 0.00 174.94 178.96 1u6s s ASP 194 N 0.98 5.07 0.23 3.58 1.47 -1.26 -4.63 116.67 122.12 1u6s s ASP 194 Ca -0.02 2.06 -0.07 0.00 1.18 0.00 0.00 52.55 55.70 1u6s s ASP 194 Cb -0.15 -2.56 0.21 0.00 -0.34 0.00 0.00 42.92 40.08 1u6s s ASP 194 CO -0.02 -1.66 1.87 -0.50 0.68 0.00 0.00 175.17 175.55 1u6s h TRP 195 N 0.12 1.20 -0.26 2.11 -0.00 -1.98 -1.69 115.95 115.45 1u6s h TRP 195 Ca -0.47 -0.01 -0.06 0.00 -0.00 0.00 0.00 58.89 58.35 1u6s h TRP 195 Cb 1.25 -0.39 -0.01 0.00 -0.00 0.00 0.00 29.16 30.01 1u6s h TRP 195 CO 0.53 0.81 -0.07 0.82 -0.00 0.00 0.00 178.44 180.53 1u6s h ILE 196 N 1.24 1.29 -0.43 1.49 1.08 -1.98 0.40 117.51 120.60 1u6s h ILE 196 Ca 0.32 -1.10 0.06 0.00 -0.39 0.00 0.00 64.86 63.75 1u6s h ILE 196 Cb -0.03 1.47 -0.05 0.00 -3.07 0.00 0.00 36.82 35.14 1u6s h ILE 196 CO -0.06 0.34 0.13 0.74 -0.69 0.00 0.00 178.15 178.62 1u6s h THR 197 N 0.25 0.83 -0.46 -0.27 2.02 -1.91 -2.02 112.91 111.35 1u6s h THR 197 Ca 0.06 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.16 1u6s h THR 197 Cb 0.55 0.52 -0.02 0.00 -1.74 0.00 0.00 68.15 67.46 1u6s h THR 197 CO 0.03 0.05 0.30 0.15 0.37 0.00 0.00 175.52 176.42 1u6s h PHE 198 N 0.28 0.56 -0.08 3.16 3.57 -1.01 -2.51 116.94 120.91 1u6s h PHE 198 Ca 0.21 0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.74 1u6s h PHE 198 Cb 0.22 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 38.77 1u6s h PHE 198 CO -0.17 0.35 0.08 0.00 -2.23 0.00 0.00 178.31 176.33 1u6s h ALA 199 N 1.18 1.78 -0.01 2.41 0.00 0.38 -0.72 119.26 124.28 1u6s h ALA 199 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1u6s h ALA 199 Cb -0.05 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1u6s h ALA 199 CO -0.05 -0.12 -0.05 1.04 0.00 0.00 0.00 179.25 180.07 1u6s n GLN 200 N -4.04 1.51 -2.91 0.00 6.02 -0.81 -4.17 117.38 112.97 1u6s n GLN 200 Ca -0.01 -0.89 -0.13 0.00 -0.01 0.00 0.00 57.00 55.96 1u6s n GLN 200 Cb 0.18 -1.48 0.04 0.00 1.02 0.00 0.00 30.24 30.00 1u6s n GLN 200 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1u6s n ASN 201 N 0.03 -1.14 -0.30 1.08 5.15 -0.38 -5.04 115.26 114.66 1u6s n ASN 201 Ca 0.17 -3.41 0.01 0.00 -0.60 0.00 0.00 54.58 50.75 1u6s n ASN 201 Cb 0.36 0.93 0.14 0.00 -0.53 0.00 0.00 39.78 40.68 1u6s n ASN 201 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1u6s h PRO 202 N 3.06 0.91 0.00 1.20 0.11 -1.44 -2.30 132.00 133.53 1u6s h PRO 202 Ca -0.02 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1u6s h PRO 202 Cb 1.04 -0.20 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1u6s h PRO 202 CO 0.28 0.60 0.00 0.77 -0.21 0.00 0.00 178.00 179.44 1u6s h SER 202 N 0.93 0.00 -1.58 -2.05 0.02 -1.96 -3.44 113.55 105.47 1u6s h SER 202 Ca 0.37 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1u6s h SER 202 Cb 0.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.72 1u6s h SER 202 CO -0.18 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.12 1u6s n GLY 202 N 0.03 -2.01 3.66 -3.77 0.00 -0.87 -4.96 105.19 97.28 1u6s n GLY 202 Ca 0.01 -1.52 -0.44 0.00 0.00 0.00 0.00 46.02 44.07 1u6s n GLY 202 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1u6s n PRO 202 N -1.28 1.85 -3.79 1.61 -0.02 -1.26 -5.01 135.00 127.10 1u6s n PRO 202 Ca 0.00 0.65 -0.21 0.00 -2.02 0.00 0.00 63.50 61.92 1u6s n PRO 202 Cb 0.00 -2.17 -0.02 0.00 -0.02 0.00 0.00 33.50 31.29 1u6s n PRO 202 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1u6s s ARG 202 N -1.59 3.40 0.44 -0.52 1.70 -1.26 -4.96 118.95 116.17 1u6s s ARG 202 Ca 0.58 -0.71 -0.23 0.00 -0.47 0.00 0.00 55.73 54.91 1u6s s ARG 202 Cb -0.63 -2.84 -0.08 0.00 -0.57 0.00 0.00 34.95 30.84 1u6s s ARG 202 CO 0.60 0.32 1.10 -2.14 -1.08 0.00 0.00 175.30 174.10 1u6s s PRO 203 N -4.07 3.90 0.08 3.89 0.02 -1.26 -4.90 135.00 132.65 1u6s s PRO 203 Ca 0.37 1.60 -0.04 0.00 0.02 0.00 0.00 61.00 62.95 1u6s s PRO 203 Cb -0.09 -2.39 -0.03 0.00 0.02 0.00 0.00 34.50 32.01 1u6s s PRO 203 CO 0.31 -0.39 0.06 -0.06 -0.33 0.00 0.00 177.00 176.58 1u6s s PHE 204 N -1.66 0.44 0.05 6.54 0.08 -1.26 -4.98 117.98 117.18 1u6s s PHE 204 Ca 0.62 -0.93 -0.31 0.00 0.12 0.00 0.00 56.93 56.44 1u6s s PHE 204 Cb -0.24 -0.28 -0.06 0.00 -0.57 0.00 0.00 43.02 41.87 1u6s s PHE 204 CO 0.29 -0.46 1.24 0.54 -0.10 0.00 0.00 175.22 176.73 1u6s s VAL 205 N -3.92 3.93 0.13 -0.44 0.11 0.09 -2.71 120.40 117.59 1u6s s VAL 205 Ca 0.09 1.37 0.10 0.00 -2.93 0.00 0.00 61.98 60.61 1u6s s VAL 205 Cb 0.07 -3.88 -0.04 0.00 -1.53 0.00 0.00 36.38 31.00 1u6s s VAL 205 CO -0.09 0.09 -0.24 -0.13 -3.33 0.00 0.00 175.10 171.40 1u6s s ARG 206 N 1.27 1.30 -0.18 1.54 1.81 0.44 -4.64 118.95 120.50 1u6s s ARG 206 Ca 0.60 -1.30 -0.07 0.00 -1.72 0.00 0.00 55.73 53.23 1u6s s ARG 206 Cb -0.30 -1.68 0.08 0.00 -0.45 0.00 0.00 34.95 32.60 1u6s s ARG 206 CO 0.28 0.39 0.39 -1.17 -0.68 0.00 0.00 175.30 174.51 1u6s s LEU 207 N -2.09 -0.44 -1.23 2.53 2.96 -1.26 -1.44 118.68 117.71 1u6s s LEU 207 Ca 0.12 0.90 -0.10 0.00 -0.22 0.00 0.00 54.13 54.83 1u6s s LEU 207 Cb -0.10 1.23 0.19 0.00 0.50 0.00 0.00 46.19 48.01 1u6s s LEU 207 CO 0.06 -0.22 1.68 -1.84 -1.32 0.00 0.00 176.35 174.70 1u6s n GLU 208 N 5.10 3.63 -0.30 1.98 0.28 0.11 -4.92 120.64 126.53 1u6s n GLU 208 Ca -0.12 -3.76 -0.03 0.00 -0.16 0.00 0.00 57.16 53.09 1u6s n GLU 208 Cb 0.51 -2.90 0.02 0.00 1.43 0.00 0.00 31.44 30.50 1u6s n GLU 208 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 1u6s h GLY 209 N 8.11 -0.02 0.65 -1.84 0.00 -1.90 -1.74 103.07 106.34 1u6s h GLY 209 Ca 0.35 0.48 0.11 0.00 0.00 0.00 0.00 47.33 48.26 1u6s h GLY 209 CO 1.46 -0.20 0.58 -2.55 0.00 0.00 0.00 176.54 175.83 1u6s h PRO 210 N -0.08 0.83 -0.20 4.80 0.11 -1.98 0.13 132.00 135.61 1u6s h PRO 210 Ca 0.29 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 66.33 1u6s h PRO 210 Cb 0.57 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 1u6s h PRO 210 CO -0.84 0.55 0.06 0.00 -0.21 0.00 0.00 178.00 177.56 1u6s h ALA 211 N 1.56 0.27 -0.02 -0.75 0.00 -1.74 -0.45 119.26 118.13 1u6s h ALA 211 Ca 0.43 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 1u6s h ALA 211 Cb 0.48 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1u6s h ALA 211 CO -0.19 -0.10 0.01 0.28 0.00 0.00 0.00 179.25 179.25 1u6s h VAL 212 N 0.15 1.10 -0.46 0.00 2.07 -1.22 0.11 116.25 118.01 1u6s h VAL 212 Ca 0.07 -0.30 0.09 0.00 0.82 0.00 0.00 66.70 67.38 1u6s h VAL 212 Cb 0.24 1.26 -0.10 0.00 -1.52 0.00 0.00 31.29 31.17 1u6s h VAL 212 CO -0.00 0.08 -0.32 0.15 0.02 0.00 0.00 177.57 177.50 1u6s h PHE 213 N -0.08 -0.87 0.11 1.57 3.57 -0.71 0.12 116.94 120.65 1u6s h PHE 213 Ca 0.01 0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.58 1u6s h PHE 213 Cb 0.12 0.45 -0.02 0.00 2.79 0.00 0.00 35.95 39.29 1u6s h PHE 213 CO -0.04 -0.37 -0.17 -0.09 -2.23 0.00 0.00 178.31 175.41 1u6s h ARG 214 N -0.22 -0.33 -0.23 1.11 2.43 -0.81 -1.29 114.38 115.04 1u6s h ARG 214 Ca 0.19 0.02 0.03 0.00 -0.81 0.00 0.00 59.98 59.42 1u6s h ARG 214 Cb 0.53 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.13 1u6s h ARG 214 CO -0.58 -0.22 0.03 2.35 -1.51 0.00 0.00 179.97 180.05 1u6s h TRP 215 N -0.34 0.05 -0.03 2.20 7.01 -0.29 -1.75 115.95 122.79 1u6s h TRP 215 Ca 0.02 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.03 1u6s h TRP 215 Cb 0.35 0.01 -0.00 0.00 -2.10 0.00 0.00 29.16 27.42 1u6s h TRP 215 CO -0.17 0.00 0.00 0.00 -2.79 0.00 0.00 178.44 175.49 1u6s h ALA 216 N 1.18 0.04 0.00 2.65 0.00 -0.66 -1.07 119.26 121.41 1u6s h ALA 216 Ca 0.11 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1u6s h ALA 216 Cb 0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1u6s h ALA 216 CO -0.16 -0.30 -0.27 0.00 0.00 0.00 0.00 179.25 178.52 1u6s h ALA 217 N 0.73 1.45 0.00 0.00 0.00 -1.19 -1.22 119.26 119.03 1u6s h ALA 217 Ca 0.01 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.50 1u6s h ALA 217 Cb 0.30 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1u6s h ALA 217 CO 0.00 0.34 -1.28 0.35 0.00 0.00 0.00 179.25 178.66 1u6s h PHE 218 N 0.00 0.00 0.00 0.00 3.57 -1.24 -3.42 116.94 115.86 1u6s h PHE 218 Ca -0.00 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 1u6s h PHE 218 Cb 0.51 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 1u6s h PHE 218 CO 0.00 0.63 -1.41 1.63 -2.23 0.00 0.00 178.31 176.93 1u6s n LYS 219 N -2.98 1.30 0.12 1.11 4.76 -0.41 -4.67 118.16 117.39 1u6s n LYS 219 Ca -0.08 -0.04 0.13 0.00 -2.87 0.00 0.00 58.31 55.44 1u6s n LYS 219 Cb 0.85 -1.18 0.43 0.00 -1.84 0.00 0.00 35.03 33.29 1u6s n LYS 219 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1u6s n MET 220 N -1.97 0.25 -0.14 1.97 2.81 -0.47 -2.92 117.12 116.64 1u6s n MET 220 Ca -0.06 0.29 -0.11 0.00 -1.81 0.00 0.00 57.70 56.02 1u6s n MET 220 Cb 0.42 -1.84 -0.01 0.00 -0.71 0.00 0.00 33.22 31.07 1u6s n MET 220 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1u6s h GLY 221 N 3.74 0.82 1.66 3.03 0.00 -1.83 -1.66 103.07 108.83 1u6s h GLY 221 Ca 0.00 -0.63 -0.15 0.00 0.00 0.00 0.00 47.33 46.55 1u6s h GLY 221 CO 0.00 0.58 -0.59 -0.55 0.00 0.00 0.00 176.54 175.98 1u6s h ASP 222 N 0.58 0.40 0.15 0.19 3.45 -1.84 -1.72 116.42 117.63 1u6s h ASP 222 Ca 0.11 -0.22 -0.00 0.00 0.43 0.00 0.00 57.03 57.34 1u6s h ASP 222 Cb 0.54 -0.12 -0.00 0.00 -0.56 0.00 0.00 39.33 39.19 1u6s h ASP 222 CO 0.03 0.90 -0.09 0.58 -1.57 0.00 0.00 179.24 179.09 1u6s h VAL 223 N 0.27 0.82 -0.37 -1.35 2.07 -1.50 -0.34 116.25 115.83 1u6s h VAL 223 Ca -0.00 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.57 1u6s h VAL 223 Cb 1.11 0.82 -0.05 0.00 -1.52 0.00 0.00 31.29 31.64 1u6s h VAL 223 CO 0.10 0.00 0.09 1.23 0.02 0.00 0.00 177.57 179.01 1u6s h GLY 224 N -0.23 0.45 0.87 2.17 0.00 -1.19 -1.05 103.07 104.10 1u6s h GLY 224 Ca -0.02 -0.04 0.04 0.00 0.00 0.00 0.00 47.33 47.32 1u6s h GLY 224 CO 0.02 -0.02 0.65 3.21 0.00 0.00 0.00 176.54 180.40 1u6s h ARG 225 N 0.22 1.22 -0.60 4.80 3.08 -1.12 -0.55 114.38 121.43 1u6s h ARG 225 Ca 0.18 -0.07 -0.08 0.00 0.07 0.00 0.00 59.98 60.08 1u6s h ARG 225 Cb 0.20 -0.28 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1u6s h ARG 225 CO -0.22 0.81 0.07 0.00 -1.07 0.00 0.00 179.97 179.56 1u6s h ARG 226 N 1.26 1.01 -0.65 0.04 3.08 -0.40 -0.81 114.38 117.91 1u6s h ARG 226 Ca 0.40 -0.28 -0.06 0.00 0.07 0.00 0.00 59.98 60.10 1u6s h ARG 226 Cb 0.01 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 1u6s h ARG 226 CO -0.13 0.96 0.16 0.00 -1.07 0.00 0.00 179.97 179.90 1u6s h ALA 227 N 1.01 1.05 -0.18 0.04 0.00 -0.43 0.18 119.26 120.94 1u6s h ALA 227 Ca 0.18 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1u6s h ALA 227 Cb 0.46 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1u6s h ALA 227 CO 0.02 0.63 -0.29 0.52 0.00 0.00 0.00 179.25 180.12 1u6s h MET 228 N 0.98 0.51 -0.92 0.00 2.86 -1.03 -1.41 114.93 115.92 1u6s h MET 228 Ca 0.21 -0.31 0.01 0.00 -2.06 0.00 0.00 59.70 57.54 1u6s h MET 228 Cb 0.34 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 31.99 1u6s h MET 228 CO -0.00 0.91 0.61 -0.44 1.06 0.00 0.00 176.91 179.05 1u6s h ASP 229 N 0.17 1.07 -0.21 1.22 5.19 -1.04 -0.29 116.42 122.53 1u6s h ASP 229 Ca 0.01 -0.03 -0.00 0.00 -0.62 0.00 0.00 57.03 56.39 1u6s h ASP 229 Cb 0.87 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 40.10 1u6s h ASP 229 CO 0.07 0.78 0.12 0.00 -3.12 0.00 0.00 179.24 177.09 1u6s h ALA 230 N 1.33 0.26 0.00 3.45 0.00 -0.90 -2.20 119.26 121.21 1u6s h ALA 230 Ca 0.34 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1u6s h ALA 230 Cb -0.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1u6s h ALA 230 CO -0.07 -0.23 0.00 0.00 0.00 0.00 0.00 179.25 178.95 1u6s n ALA 231 N -2.17 1.68 -2.56 0.00 0.00 -0.54 -4.75 120.51 112.16 1u6s n ALA 231 Ca -0.03 -0.05 -0.15 0.00 0.00 0.00 0.00 53.44 53.21 1u6s n ALA 231 Cb 0.05 -1.22 0.01 0.00 0.00 0.00 0.00 19.45 18.29 1u6s n ALA 231 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u6s n GLY 232 N -0.09 -0.16 3.45 0.00 0.00 -0.28 -5.03 105.19 103.08 1u6s n GLY 232 Ca 0.04 -0.22 -0.28 0.00 0.00 0.00 0.00 46.02 45.56 1u6s n GLY 232 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1u6s s VAL 233 N -2.86 2.56 0.30 1.61 -7.23 -0.28 -5.02 120.40 109.49 1u6s s VAL 233 Ca 0.12 -1.76 -0.06 0.00 -1.81 0.00 0.00 61.98 58.47 1u6s s VAL 233 Cb -0.05 -2.19 -0.05 0.00 0.56 0.00 0.00 36.38 34.64 1u6s s VAL 233 CO 0.15 0.01 0.58 -0.13 -0.31 0.00 0.00 175.10 175.40 1u6s s ARG 234 N -2.36 3.67 0.40 4.82 0.52 -1.26 -4.20 118.95 120.54 1u6s s ARG 234 Ca 0.18 0.09 0.13 0.00 -0.52 0.00 0.00 55.73 55.61 1u6s s ARG 234 Cb -0.09 -2.61 0.96 0.00 0.52 0.00 0.00 34.95 33.73 1u6s s ARG 234 CO 0.09 0.19 1.92 -1.35 0.02 0.00 0.00 175.30 176.17 1u6s h PRO 235 N 1.69 0.50 0.00 3.54 0.11 -1.91 -0.80 132.00 135.13 1u6s h PRO 235 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1u6s h PRO 235 Cb 1.19 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1u6s h PRO 235 CO 0.66 0.33 0.00 -0.40 -0.21 0.00 0.00 178.00 178.38 1u6s n ASP 236 N -4.49 0.00 -0.00 -2.05 5.75 -1.26 -2.73 116.55 111.76 1u6s n ASP 236 Ca 0.14 0.10 0.10 0.00 -0.01 0.00 0.00 54.79 55.12 1u6s n ASP 236 Cb 0.45 -0.31 -0.11 0.00 -1.03 0.00 0.00 41.12 40.13 1u6s n ASP 236 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1u6s n GLN 237 N -1.31 0.13 -2.21 0.11 6.02 -0.31 -4.74 117.38 115.09 1u6s n GLN 237 Ca 0.07 -0.04 -0.42 0.00 -0.01 0.00 0.00 57.00 56.60 1u6s n GLN 237 Cb 0.13 -1.51 -0.03 0.00 1.02 0.00 0.00 30.24 29.86 1u6s n GLN 237 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1u6s s ILE 238 N -3.10 3.67 -0.28 5.09 -1.09 -1.11 -4.75 121.20 119.62 1u6s s ILE 238 Ca 0.05 1.06 0.22 0.00 -2.23 0.00 0.00 60.65 59.75 1u6s s ILE 238 Cb 0.16 -3.68 -0.24 0.00 -1.58 0.00 0.00 42.46 37.11 1u6s s ILE 238 CO 0.87 0.00 0.70 0.47 -1.23 0.00 0.00 174.94 175.75 1u6s n ASP 239 N 5.33 0.35 -3.70 3.58 8.00 0.25 -4.72 116.55 125.64 1u6s n ASP 239 Ca 0.13 -0.13 -0.14 0.00 0.71 0.00 0.00 54.79 55.36 1u6s n ASP 239 Cb 0.43 1.46 -0.14 0.00 -0.02 0.00 0.00 41.12 42.86 1u6s n ASP 239 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1u6s s VAL 240 N -3.38 -0.21 -0.24 2.53 1.01 -0.95 -0.95 120.40 118.21 1u6s s VAL 240 Ca -0.03 0.25 -0.06 0.00 0.00 0.00 0.00 61.98 62.14 1u6s s VAL 240 Cb 0.14 -0.35 -0.03 0.00 0.00 0.00 0.00 36.38 36.14 1u6s s VAL 240 CO 0.87 0.10 0.04 0.12 0.00 0.00 0.00 175.10 176.24 1u6s s PHE 241 N 1.87 3.06 -0.65 5.22 5.99 0.15 -1.15 117.98 132.47 1u6s s PHE 241 Ca -0.03 -0.49 0.05 0.00 0.00 0.00 0.00 56.93 56.46 1u6s s PHE 241 Cb -0.12 -2.19 0.17 0.00 0.00 0.00 0.00 43.02 40.88 1u6s s PHE 241 CO -0.07 -0.35 0.47 0.28 -0.00 0.00 0.00 175.22 175.55 1u6s n VAL 242 N 4.76 1.10 -2.06 3.12 0.31 0.06 -1.12 118.33 124.51 1u6s n VAL 242 Ca -0.17 -4.60 -0.31 0.00 -0.01 0.00 0.00 64.34 59.25 1u6s n VAL 242 Cb 0.51 -2.08 -0.00 0.00 -0.91 0.00 0.00 33.84 31.35 1u6s n VAL 242 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1u6s s PRO 243 N -1.20 3.69 0.15 5.55 0.04 -1.26 -2.63 135.00 139.35 1u6s s PRO 243 Ca 0.27 0.84 -0.34 0.00 0.04 0.00 0.00 61.00 61.81 1u6s s PRO 243 Cb -0.02 -2.10 -0.15 0.00 0.04 0.00 0.00 34.50 32.28 1u6s s PRO 243 CO -0.17 -0.49 1.49 1.58 0.04 0.00 0.00 177.00 179.45 1u6s n HIS 244 N -2.32 2.05 -2.08 0.56 -0.00 0.14 -4.79 115.22 108.79 1u6s n HIS 244 Ca 0.06 0.39 -0.42 0.00 -0.00 0.00 0.00 57.72 57.75 1u6s n HIS 244 Cb 0.54 -2.48 -0.00 0.00 -0.00 0.00 0.00 29.99 28.05 1u6s n HIS 244 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 1u6s n GLN 245 N 3.01 2.93 -0.03 1.57 1.13 -1.26 -4.57 117.38 120.16 1u6s n GLN 245 Ca 0.17 -2.86 -0.16 0.00 -1.94 0.00 0.00 57.00 52.20 1u6s n GLN 245 Cb 0.27 -3.38 -0.14 0.00 0.11 0.00 0.00 30.24 27.10 1u6s n GLN 245 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1u6s n ALA 246 N 7.27 1.19 -3.61 -1.58 0.00 -1.26 -3.97 120.51 118.54 1u6s n ALA 246 Ca 0.51 -0.79 -0.00 0.00 0.00 0.00 0.00 53.44 53.15 1u6s n ALA 246 Cb 0.42 -0.58 -0.06 0.00 0.00 0.00 0.00 19.45 19.23 1u6s n ALA 246 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1u6s s ASN 247 N -6.57 -0.37 0.45 0.00 3.84 -1.26 -4.84 114.94 106.19 1u6s s ASN 247 Ca -0.19 0.58 0.24 0.00 0.21 0.00 0.00 52.86 53.70 1u6s s ASN 247 Cb 0.07 1.19 1.01 0.00 -0.55 0.00 0.00 41.25 42.97 1u6s s ASN 247 CO 0.76 -0.09 1.87 0.77 -2.79 0.00 0.00 177.10 177.63 1u6s h SER 248 N 5.94 0.00 -0.37 -4.21 4.64 -0.59 -2.52 113.55 116.44 1u6s h SER 248 Ca -0.26 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.92 1u6s h SER 248 Cb 1.17 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 1u6s h SER 248 CO 0.20 0.23 -0.31 0.03 -0.87 0.00 0.00 176.83 176.10 1u6s h ARG 249 N 0.00 0.86 -0.08 4.77 2.47 -1.85 -2.33 114.38 118.22 1u6s h ARG 249 Ca -0.00 -0.43 -0.01 0.00 -1.26 0.00 0.00 59.98 58.28 1u6s h ARG 249 Cb 0.66 0.01 -0.00 0.00 -1.65 0.00 0.00 29.97 28.99 1u6s h ARG 249 CO 0.03 1.08 0.01 0.82 0.56 0.00 0.00 179.97 182.46 1u6s h ILE 250 N 0.66 1.22 -0.89 2.04 2.04 -1.92 -2.78 117.51 117.88 1u6s h ILE 250 Ca 0.06 -0.68 -0.02 0.00 1.00 0.00 0.00 64.86 65.23 1u6s h ILE 250 Cb 0.89 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 38.46 1u6s h ILE 250 CO 0.08 0.19 0.48 0.78 0.00 0.00 0.00 178.15 179.68 1u6s h ASN 251 N -0.12 1.11 0.22 1.72 2.35 -1.47 -0.91 115.58 118.48 1u6s h ASN 251 Ca 0.02 -0.10 -0.13 0.00 -0.55 0.00 0.00 56.30 55.54 1u6s h ASN 251 Cb 0.29 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 1u6s h ASN 251 CO 0.00 0.90 -0.50 1.05 -1.65 0.00 0.00 177.43 177.23 1u6s h GLU 252 N 1.24 0.32 -0.77 0.81 4.11 -1.47 -1.52 114.58 117.30 1u6s h GLU 252 Ca 0.31 -0.18 -0.04 0.00 0.07 0.00 0.00 59.36 59.52 1u6s h GLU 252 Cb 0.03 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 1u6s h GLU 252 CO -0.05 0.74 0.31 -0.07 0.07 0.00 0.00 179.01 180.01 1u6s h LEU 253 N 0.25 1.05 -1.19 3.06 3.38 -1.13 -2.76 115.31 117.97 1u6s h LEU 253 Ca 0.01 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.74 1u6s h LEU 253 Cb 0.96 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1u6s h LEU 253 CO 0.08 0.94 -0.18 -0.07 0.09 0.00 0.00 178.44 179.30 1u6s h LEU 254 N 1.11 0.33 0.61 1.67 3.38 -0.72 -0.83 115.31 120.85 1u6s h LEU 254 Ca 0.26 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.12 1u6s h LEU 254 Cb 0.21 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 1u6s h LEU 254 CO -0.02 0.53 -0.44 0.58 0.09 0.00 0.00 178.44 179.18 1u6s h VAL 255 N 0.31 0.11 -0.85 1.22 2.07 -1.07 0.10 116.25 118.15 1u6s h VAL 255 Ca 0.06 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.65 1u6s h VAL 255 Cb 0.50 0.11 -0.06 0.00 -1.52 0.00 0.00 31.29 30.32 1u6s h VAL 255 CO 0.03 0.00 0.52 0.11 0.02 0.00 0.00 177.57 178.25 1u6s h LYS 256 N -1.01 0.90 -0.33 1.57 1.79 -1.34 -1.39 116.57 116.76 1u6s h LYS 256 Ca -0.07 -0.05 -0.02 0.00 -2.18 0.00 0.00 60.65 58.32 1u6s h LYS 256 Cb 0.84 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 31.28 1u6s h LYS 256 CO 0.03 0.60 0.11 -0.97 -1.08 0.00 0.00 179.45 178.14 1u6s h ASN 257 N 0.93 0.47 1.19 0.86 -0.73 -0.94 -2.55 115.58 114.81 1u6s h ASN 257 Ca 0.38 -0.19 0.00 0.00 1.87 0.00 0.00 56.30 58.36 1u6s h ASN 257 Cb 0.21 -0.12 0.00 0.00 0.27 0.00 0.00 38.32 38.68 1u6s h ASN 257 CO -0.19 0.53 0.00 -0.07 -0.37 0.00 0.00 177.43 177.34 1u6s h LEU 258 N 0.38 0.00 -1.56 0.34 3.38 -0.50 -3.47 115.31 113.88 1u6s h LEU 258 Ca 0.11 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.72 1u6s h LEU 258 Cb 0.22 0.00 0.14 0.00 0.09 0.00 0.00 40.66 41.11 1u6s h LEU 258 CO -0.01 0.00 -0.77 0.00 0.09 0.00 0.00 178.44 177.75 1u6s n GLN 259 N -2.63 -6.44 -1.03 1.13 6.02 -0.55 -4.87 117.38 109.01 1u6s n GLN 259 Ca 0.03 0.80 -0.31 0.00 -0.01 0.00 0.00 57.00 57.51 1u6s n GLN 259 Cb 0.34 -5.73 0.13 0.00 1.02 0.00 0.00 30.24 26.01 1u6s n GLN 259 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1u6s s LEU 260 N -6.56 2.68 0.63 1.08 1.43 -1.23 -4.61 118.68 112.10 1u6s s LEU 260 Ca 0.09 1.84 -0.17 0.00 -1.03 0.00 0.00 54.13 54.87 1u6s s LEU 260 Cb -0.04 -4.34 -0.01 0.00 0.03 0.00 0.00 46.19 41.82 1u6s s LEU 260 CO 0.75 -2.62 1.17 0.00 0.23 0.00 0.00 176.35 175.88 1u6s s ARG 261 N -4.81 2.81 0.34 1.70 1.70 -1.26 -4.92 118.95 114.53 1u6s s ARG 261 Ca 0.64 1.65 0.15 0.00 -0.47 0.00 0.00 55.73 57.70 1u6s s ARG 261 Cb -0.19 -1.93 1.12 0.00 -0.57 0.00 0.00 34.95 33.38 1u6s s ARG 261 CO 0.57 -1.29 1.64 -1.35 -1.08 0.00 0.00 175.30 173.79 1u6s h PRO 262 N 0.45 0.22 -0.02 3.89 0.11 -1.99 -2.05 132.00 132.61 1u6s h PRO 262 Ca -0.49 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1u6s h PRO 262 Cb 1.28 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1u6s h PRO 262 CO 0.54 0.14 -0.02 -0.40 -0.21 0.00 0.00 178.00 178.06 1u6s n ASP 263 N -5.13 1.94 -4.74 -2.05 5.75 -1.26 -4.95 116.55 106.11 1u6s n ASP 263 Ca 0.33 -1.63 -0.42 0.00 -0.01 0.00 0.00 54.79 53.06 1u6s n ASP 263 Cb 1.04 0.01 -0.01 0.00 -1.03 0.00 0.00 41.12 41.13 1u6s n ASP 263 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1u6s n ALA 263 N 0.50 2.32 -2.69 2.12 0.00 -0.77 -4.93 120.51 117.05 1u6s n ALA 263 Ca 0.17 0.37 -0.42 0.00 0.00 0.00 0.00 53.44 53.56 1u6s n ALA 263 Cb 0.43 -2.43 -0.03 0.00 0.00 0.00 0.00 19.45 17.42 1u6s n ALA 263 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1u6s s VAL 264 N -0.36 4.83 -0.19 0.00 1.01 -0.13 -4.91 120.40 120.65 1u6s s VAL 264 Ca 0.61 1.93 -0.02 0.00 0.00 0.00 0.00 61.98 64.50 1u6s s VAL 264 Cb -0.51 -4.26 -0.01 0.00 0.00 0.00 0.00 36.38 31.60 1u6s s VAL 264 CO 0.53 0.04 -0.08 -0.69 0.00 0.00 0.00 175.10 174.90 1u6s s VAL 265 N 1.88 3.19 0.22 2.92 1.01 -1.26 0.29 120.40 128.64 1u6s s VAL 265 Ca 0.46 -0.57 -0.31 0.00 0.00 0.00 0.00 61.98 61.55 1u6s s VAL 265 Cb -0.18 -2.41 -0.11 0.00 0.00 0.00 0.00 36.38 33.67 1u6s s VAL 265 CO 0.18 0.47 1.66 0.00 0.00 0.00 0.00 175.10 177.41 1u6s s ALA 266 N 1.10 3.87 -0.03 5.51 0.00 -0.27 -4.90 121.76 127.04 1u6s s ALA 266 Ca 0.01 1.54 0.17 0.00 0.00 0.00 0.00 51.96 53.68 1u6s s ALA 266 Cb -0.15 -3.67 0.30 0.00 0.00 0.00 0.00 23.12 19.60 1u6s s ALA 266 CO -0.02 -0.91 1.13 -1.71 0.00 0.00 0.00 175.76 174.25 1u6s n ASN 267 N 3.56 0.86 -0.07 0.00 5.15 -1.26 -4.86 115.26 118.64 1u6s n ASN 267 Ca 0.14 -2.26 0.25 0.00 -0.60 0.00 0.00 54.58 52.11 1u6s n ASN 267 Cb 0.36 -0.30 0.69 0.00 -0.53 0.00 0.00 39.78 40.00 1u6s n ASN 267 CO 0.00 0.00 0.00 -0.78 1.40 0.00 0.00 177.26 177.88 1u6s h ASP 268 N 0.66 0.00 -0.79 1.20 3.58 -1.90 -1.33 116.42 117.83 1u6s h ASP 268 Ca -0.13 0.00 0.23 0.00 0.42 0.00 0.00 57.03 57.55 1u6s h ASP 268 Cb 1.61 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.63 1u6s h ASP 268 CO 0.06 0.00 0.63 -0.29 -2.88 0.00 0.00 179.24 176.76 1u6s h ILE 269 N 0.00 0.47 -0.56 2.25 2.10 -1.89 -1.68 117.51 118.19 1u6s h ILE 269 Ca 0.34 0.00 0.11 0.00 1.08 0.00 0.00 64.86 66.39 1u6s h ILE 269 Cb 1.70 0.54 -0.10 0.00 -1.09 0.00 0.00 36.82 37.87 1u6s h ILE 269 CO -0.00 0.00 -0.08 -0.08 -1.08 0.00 0.00 178.15 176.90 1u6s h GLU 270 N 0.00 0.04 0.00 2.19 4.81 -1.34 -1.15 114.58 119.13 1u6s h GLU 270 Ca 0.38 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.60 1u6s h GLU 270 Cb 1.64 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 31.01 1u6s h GLU 270 CO -0.00 0.03 -0.06 0.72 -0.73 0.00 0.00 179.01 178.96 1u6s n HIS 271 N -5.34 0.00 -0.01 0.92 8.25 -0.96 -0.00 115.22 118.08 1u6s n HIS 271 Ca 0.06 -0.57 -0.00 0.00 -0.26 0.00 0.00 57.72 56.95 1u6s n HIS 271 Cb 0.30 -0.08 -0.01 0.00 1.12 0.00 0.00 29.99 31.32 1u6s n HIS 271 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1u6s n THR 272 N -0.74 0.09 -4.28 1.59 -1.04 -0.67 -4.23 114.28 105.00 1u6s n THR 272 Ca 0.06 -0.07 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1u6s n THR 272 Cb 0.49 -0.68 0.00 0.00 -1.82 0.00 0.00 70.33 68.32 1u6s n THR 272 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1u6s n GLY 273 N 2.80 -1.27 3.55 3.41 0.00 -0.44 -4.22 105.19 109.02 1u6s n GLY 273 Ca -0.02 -1.24 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 1u6s n GLY 273 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1u6s s ASN 274 N -4.00 6.39 -0.34 1.61 3.84 0.35 -4.49 114.94 118.30 1u6s s ASN 274 Ca 0.00 -0.07 0.07 0.00 0.21 0.00 0.00 52.86 53.07 1u6s s ASN 274 Cb 0.00 -2.33 0.55 0.00 -0.55 0.00 0.00 41.25 38.92 1u6s s ASN 274 CO 0.00 -0.71 1.59 0.35 -2.79 0.00 0.00 177.10 175.54 1u6s n THR 275 N 5.77 2.75 0.00 -5.21 -2.24 -1.26 -0.49 114.28 113.60 1u6s n THR 275 Ca -0.01 -2.56 0.00 0.00 -2.27 0.00 0.00 64.05 59.21 1u6s n THR 275 Cb 0.48 -0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 1u6s n THR 275 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1u6s n SER 276 N -1.13 0.00 -0.20 3.42 7.64 -1.26 -1.13 113.62 120.97 1u6s n SER 276 Ca 0.41 0.00 0.29 0.00 1.01 0.00 0.00 58.87 60.58 1u6s n SER 276 Cb 1.21 0.00 0.72 0.00 -1.01 0.00 0.00 64.21 65.13 1u6s n SER 276 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1u6s h ALA 277 N -0.01 2.85 0.00 -0.43 0.00 -1.77 -0.19 119.26 119.71 1u6s h ALA 277 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1u6s h ALA 277 Cb 0.00 0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1u6s h ALA 277 CO 0.00 -1.12 -0.50 0.00 0.00 0.00 0.00 179.25 177.63 1u6s n ALA 278 N -2.71 3.12 -0.24 0.00 0.00 -0.28 -4.22 120.51 116.17 1u6s n ALA 278 Ca 0.19 -0.27 -0.05 0.00 0.00 0.00 0.00 53.44 53.31 1u6s n ALA 278 Cb 0.99 -1.18 0.06 0.00 0.00 0.00 0.00 19.45 19.31 1u6s n ALA 278 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1u6s h SER 279 N 0.00 0.75 0.39 0.00 4.64 -0.95 -1.46 113.55 116.92 1u6s h SER 279 Ca 0.00 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 1u6s h SER 279 Cb 0.62 -0.18 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1u6s h SER 279 CO 0.00 0.54 -0.19 0.40 -0.87 0.00 0.00 176.83 176.71 1u6s h ILE 280 N 0.89 0.58 -0.92 0.95 2.04 -1.79 0.79 117.51 120.06 1u6s h ILE 280 Ca 0.26 -0.45 0.05 0.00 1.00 0.00 0.00 64.86 65.72 1u6s h ILE 280 Cb -0.06 0.79 -0.06 0.00 -0.74 0.00 0.00 36.82 36.75 1u6s h ILE 280 CO -0.07 0.08 0.60 1.55 0.00 0.00 0.00 178.15 180.31 1u6s h PRO 281 N -0.79 1.08 -0.45 2.37 0.13 -1.85 0.18 132.00 132.66 1u6s h PRO 281 Ca -0.05 -0.06 -0.01 0.00 -0.87 0.00 0.00 66.00 65.00 1u6s h PRO 281 Cb 0.53 -0.24 -0.02 0.00 0.13 0.00 0.00 31.00 31.39 1u6s h PRO 281 CO 0.09 0.71 0.25 -0.07 -0.23 0.00 0.00 178.00 178.75 1u6s h LEU 282 N 1.11 0.56 -0.86 1.56 3.38 -1.13 -1.59 115.31 118.34 1u6s h LEU 282 Ca 0.38 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 58.16 1u6s h LEU 282 Cb 0.09 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1u6s h LEU 282 CO -0.13 0.48 -0.23 0.00 0.09 0.00 0.00 178.44 178.65 1u6s h ALA 283 N 1.10 1.03 -0.18 1.53 0.00 -0.30 -1.37 119.26 121.07 1u6s h ALA 283 Ca 0.16 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1u6s h ALA 283 Cb 0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1u6s h ALA 283 CO -0.03 0.58 0.08 0.52 0.00 0.00 0.00 179.25 180.41 1u6s h MET 284 N 0.52 0.17 -0.90 0.00 2.86 -0.48 -2.27 114.93 114.83 1u6s h MET 284 Ca 0.08 -0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.71 1u6s h MET 284 Cb 0.68 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 32.26 1u6s h MET 284 CO 0.05 0.11 0.58 0.00 1.06 0.00 0.00 176.91 178.71 1u6s h ALA 285 N 1.10 1.34 -0.60 6.32 0.00 -1.03 -2.58 119.26 123.81 1u6s h ALA 285 Ca 0.07 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1u6s h ALA 285 Cb 0.03 -0.36 -0.03 0.00 0.00 0.00 0.00 17.79 17.43 1u6s h ALA 285 CO -0.06 0.60 0.21 1.49 0.00 0.00 0.00 179.25 181.50 1u6s h GLU 286 N 1.22 0.92 -0.47 0.00 4.22 -0.95 -1.70 114.58 117.81 1u6s h GLU 286 Ca 0.33 -0.18 -0.09 0.00 0.08 0.00 0.00 59.36 59.50 1u6s h GLU 286 Cb -0.12 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 28.97 1u6s h GLU 286 CO -0.07 0.80 -0.05 -0.07 -2.18 0.00 0.00 179.01 177.44 1u6s h LEU 287 N 0.85 0.79 -0.19 1.64 3.38 -1.12 -2.86 115.31 117.80 1u6s h LEU 287 Ca 0.20 -0.22 -0.22 0.00 0.09 0.00 0.00 57.88 57.73 1u6s h LEU 287 Cb 0.25 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 40.80 1u6s h LEU 287 CO -0.01 0.89 -0.76 -0.07 0.09 0.00 0.00 178.44 178.58 1u6s h LEU 288 N 0.75 0.91 -1.41 1.67 3.38 -1.25 -1.84 115.31 117.52 1u6s h LEU 288 Ca 0.14 -0.59 -0.02 0.00 0.09 0.00 0.00 57.88 57.49 1u6s h LEU 288 Cb 0.53 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1u6s h LEU 288 CO 0.03 1.39 -0.12 0.71 0.09 0.00 0.00 178.44 180.54 1u6s h THR 289 N 0.53 0.32 -0.01 0.22 1.35 -1.27 -2.48 112.91 111.57 1u6s h THR 289 Ca -0.05 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 65.04 1u6s h THR 289 Cb 1.38 1.59 0.00 0.00 -1.73 0.00 0.00 68.15 69.39 1u6s h THR 289 CO 0.16 0.11 -0.43 0.35 -0.25 0.00 0.00 175.52 175.46 1u6s n THR 290 N -3.30 0.00 0.00 6.82 -2.24 -1.09 -4.96 114.28 109.52 1u6s n THR 290 Ca -0.00 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1u6s n THR 290 Cb 0.35 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.37 1u6s n THR 290 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u6s n GLY 291 N 1.40 2.83 0.38 3.38 0.00 -0.94 -4.86 105.19 107.38 1u6s n GLY 291 Ca 0.10 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.25 1u6s n GLY 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u6s h ALA 292 N 0.00 1.90 -3.20 4.61 0.00 -1.72 -3.39 119.26 117.46 1u6s h ALA 292 Ca 0.00 0.02 -0.63 0.00 0.00 0.00 0.00 54.91 54.30 1u6s h ALA 292 Cb 0.00 -0.10 -0.12 0.00 0.00 0.00 0.00 17.79 17.57 1u6s h ALA 292 CO 0.00 -0.17 -0.68 0.00 0.00 0.00 0.00 179.25 178.40 1u6s s ALA 293 N -5.64 3.17 0.15 0.00 0.00 -0.74 -4.93 121.76 113.78 1u6s s ALA 293 Ca -0.10 -1.26 0.10 0.00 0.00 0.00 0.00 51.96 50.70 1u6s s ALA 293 Cb 0.22 -1.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 1u6s s ALA 293 CO 0.79 0.59 -0.18 0.15 0.00 0.00 0.00 175.76 177.11 1u6s s LYS 294 N -2.56 1.76 0.26 0.00 -0.14 -1.26 -4.39 119.74 113.41 1u6s s LYS 294 Ca 0.25 -1.29 -0.30 0.00 -1.36 0.00 0.00 55.97 53.27 1u6s s LYS 294 Cb -0.10 -2.05 -0.11 0.00 -1.68 0.00 0.00 37.83 33.89 1u6s s LYS 294 CO 0.17 0.45 1.56 -2.14 -0.76 0.00 0.00 175.35 174.63 1u6s s PRO 295 N -2.43 4.17 0.00 -1.68 0.02 -1.26 -2.55 135.00 131.27 1u6s s PRO 295 Ca 0.20 2.48 0.00 0.00 0.02 0.00 0.00 61.00 63.70 1u6s s PRO 295 Cb -0.09 -3.07 0.00 0.00 0.02 0.00 0.00 34.50 31.36 1u6s s PRO 295 CO 0.11 -0.58 0.00 0.41 -0.33 0.00 0.00 177.00 176.61 1u6s n GLY 296 N 2.47 1.75 3.76 0.52 0.00 -0.40 -4.92 105.19 108.37 1u6s n GLY 296 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 1u6s n GLY 296 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1u6s s ASP 297 N -1.58 5.71 -0.41 1.61 1.01 -1.06 -4.55 116.67 117.41 1u6s s ASP 297 Ca 0.00 2.76 -0.29 0.00 0.71 0.00 0.00 52.55 55.74 1u6s s ASP 297 Cb 0.00 -2.64 0.02 0.00 1.01 0.00 0.00 42.92 41.31 1u6s s ASP 297 CO 0.00 -1.27 1.10 -0.22 0.21 0.00 0.00 175.17 174.99 1u6s s LEU 298 N -3.04 3.78 -0.01 1.23 2.96 -1.26 -1.18 118.68 121.16 1u6s s LEU 298 Ca 0.65 0.70 0.05 0.00 -0.22 0.00 0.00 54.13 55.31 1u6s s LEU 298 Cb -0.40 -3.53 -0.03 0.00 0.50 0.00 0.00 46.19 42.73 1u6s s LEU 298 CO 0.50 -1.08 -0.15 0.00 -1.32 0.00 0.00 176.35 174.29 1u6s s ALA 299 N 4.08 2.66 -0.23 5.97 0.00 0.12 -0.59 121.76 133.77 1u6s s ALA 299 Ca 0.46 -1.07 -0.07 0.00 0.00 0.00 0.00 51.96 51.28 1u6s s ALA 299 Cb -0.09 -0.88 -0.03 0.00 0.00 0.00 0.00 23.12 22.12 1u6s s ALA 299 CO 0.25 0.57 0.06 -1.17 0.00 0.00 0.00 175.76 175.46 1u6s s LEU 300 N -1.08 3.49 -0.15 0.00 2.96 -0.30 -0.48 118.68 123.12 1u6s s LEU 300 Ca 0.13 -0.15 -0.05 0.00 -0.22 0.00 0.00 54.13 53.85 1u6s s LEU 300 Cb -0.11 -1.92 -0.03 0.00 0.50 0.00 0.00 46.19 44.63 1u6s s LEU 300 CO 0.03 0.02 0.00 -0.76 -1.32 0.00 0.00 176.35 174.32 1u6s s LEU 301 N 1.30 3.50 -0.15 -0.68 1.43 -0.00 -0.76 118.68 123.32 1u6s s LEU 301 Ca 0.05 -0.00 -0.02 0.00 -1.03 0.00 0.00 54.13 53.13 1u6s s LEU 301 Cb -0.15 -1.85 0.05 0.00 0.03 0.00 0.00 46.19 44.27 1u6s s LEU 301 CO 0.03 0.21 0.00 -0.63 0.23 0.00 0.00 176.35 176.20 1u6s s ILE 302 N 0.10 0.63 -0.12 -0.59 1.01 -1.08 -1.57 121.20 119.57 1u6s s ILE 302 Ca 0.02 -0.36 -0.04 0.00 0.00 0.00 0.00 60.65 60.27 1u6s s ILE 302 Cb -0.13 -0.94 -0.03 0.00 0.01 0.00 0.00 42.46 41.37 1u6s s ILE 302 CO 0.02 0.02 0.01 -0.83 0.00 0.00 0.00 174.94 174.16 1u6s s GLY 303 N 1.84 1.85 -0.08 6.18 0.00 0.14 0.28 107.32 117.51 1u6s s GLY 303 Ca 0.01 -0.79 -0.12 0.00 0.00 0.00 0.00 44.72 43.82 1u6s s GLY 303 CO -0.07 -0.31 0.31 -2.52 0.00 0.00 0.00 173.10 170.52 1u6s s TYR 304 N -0.32 -0.28 -0.55 1.90 -0.85 -1.26 -0.51 117.35 115.48 1u6s s TYR 304 Ca 0.07 0.63 0.00 0.00 -0.52 0.00 0.00 57.07 57.25 1u6s s TYR 304 Cb -0.12 0.11 0.00 0.00 0.38 0.00 0.00 41.96 42.32 1u6s s TYR 304 CO 0.02 -0.25 0.00 0.41 -1.52 0.00 0.00 175.55 174.21 1u6s n GLY 305 N 2.31 -0.75 3.46 5.49 0.00 -0.52 -4.48 105.19 110.70 1u6s n GLY 305 Ca -0.16 -0.25 -0.34 0.00 0.00 0.00 0.00 46.02 45.27 1u6s n GLY 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u6s n ALA 306 N 0.00 -2.10 0.00 4.61 0.00 -1.26 -1.43 120.51 120.34 1u6s n ALA 306 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 53.44 52.94 1u6s n ALA 306 Cb 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 17.59 1u6s n ALA 306 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u6s n GLY 307 N 1.42 2.70 2.31 0.00 0.00 -1.26 -2.12 105.19 108.25 1u6s n GLY 307 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.08 1u6s n GLY 307 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1u6s n LEU 308 N 0.00 -5.85 -4.29 0.99 7.99 -0.63 -3.94 117.00 111.27 1u6s n LEU 308 Ca 0.00 0.69 -0.20 0.00 -0.01 0.00 0.00 56.01 56.49 1u6s n LEU 308 Cb 0.00 -2.52 -0.11 0.00 -0.11 0.00 0.00 43.42 40.67 1u6s n LEU 308 CO 0.00 -1.85 -0.46 -0.44 -1.51 0.00 0.00 177.39 173.13 1u6s s SER 309 N -1.45 2.32 -0.12 -1.43 0.01 -0.51 -0.06 113.70 112.46 1u6s s SER 309 Ca 0.07 -0.85 -0.16 0.00 1.31 0.00 0.00 55.95 56.32 1u6s s SER 309 Cb -0.02 -0.11 0.04 0.00 0.21 0.00 0.00 66.02 66.14 1u6s s SER 309 CO 0.50 -0.10 0.42 -0.72 0.41 0.00 0.00 173.24 173.75 1u6s s TYR 310 N -2.16 -0.42 -0.10 2.43 -0.85 -0.41 -1.44 117.35 114.39 1u6s s TYR 310 Ca 0.13 0.96 -0.07 0.00 -0.52 0.00 0.00 57.07 57.57 1u6s s TYR 310 Cb -0.05 0.17 0.04 0.00 0.38 0.00 0.00 41.96 42.50 1u6s s TYR 310 CO 0.05 -0.29 0.26 0.00 -1.52 0.00 0.00 175.55 174.04 1u6s s ALA 311 N -0.22 -0.61 0.01 9.51 0.00 0.33 -1.68 121.76 129.11 1u6s s ALA 311 Ca -0.04 0.91 -0.05 0.00 0.00 0.00 0.00 51.96 52.78 1u6s s ALA 311 Cb -0.03 -0.56 -0.00 0.00 0.00 0.00 0.00 23.12 22.52 1u6s s ALA 311 CO 0.02 -0.17 0.10 0.00 0.00 0.00 0.00 175.76 175.71 1u6s s ALA 312 N 0.81 -0.20 -0.04 0.00 0.00 0.42 0.23 121.76 122.98 1u6s s ALA 312 Ca -0.06 -0.28 -0.29 0.00 0.00 0.00 0.00 51.96 51.33 1u6s s ALA 312 Cb -0.07 0.13 0.09 0.00 0.00 0.00 0.00 23.12 23.28 1u6s s ALA 312 CO -0.05 -0.21 0.81 1.14 0.00 0.00 0.00 175.76 177.45 1u6s s GLN 313 N -1.52 0.90 0.16 0.00 0.00 -0.61 -0.96 119.66 117.62 1u6s s GLN 313 Ca -0.14 -0.01 -0.18 0.00 -0.00 0.00 0.00 55.36 55.03 1u6s s GLN 313 Cb -0.08 0.42 -0.07 0.00 0.00 0.00 0.00 33.01 33.28 1u6s s GLN 313 CO 0.00 -0.33 0.62 0.08 0.00 0.00 0.00 175.29 175.67 1u6s s VAL 314 N -1.98 4.72 0.25 3.63 1.01 -1.26 -0.82 120.40 125.95 1u6s s VAL 314 Ca -0.03 1.09 -0.10 0.00 0.00 0.00 0.00 61.98 62.95 1u6s s VAL 314 Cb -0.01 -3.83 -0.01 0.00 0.00 0.00 0.00 36.38 32.54 1u6s s VAL 314 CO -0.00 0.31 0.42 0.68 0.00 0.00 0.00 175.10 176.51 1u6s s VAL 315 N -1.39 0.00 -0.15 2.92 -7.23 0.37 0.54 120.40 115.46 1u6s s VAL 315 Ca 0.37 -1.53 -0.06 0.00 -1.81 0.00 0.00 61.98 58.95 1u6s s VAL 315 Cb -0.17 -2.30 -0.04 0.00 0.56 0.00 0.00 36.38 34.43 1u6s s VAL 315 CO 0.20 0.00 0.08 -0.13 -0.31 0.00 0.00 175.10 174.94 1u6s s ARG 316 N -3.94 3.64 0.34 4.82 0.52 -0.45 0.13 118.95 124.01 1u6s s ARG 316 Ca 0.26 -0.28 -0.29 0.00 -0.52 0.00 0.00 55.73 54.91 1u6s s ARG 316 Cb 0.01 -3.15 -0.11 0.00 0.52 0.00 0.00 34.95 32.22 1u6s s ARG 316 CO 0.11 0.51 1.48 -1.64 0.02 0.00 0.00 175.30 175.78 1u6s s MET 317 N -0.30 4.16 0.00 3.54 -1.94 -0.32 -4.49 119.30 119.94 1u6s s MET 317 Ca 0.09 2.51 0.00 0.00 -1.71 0.00 0.00 55.69 56.58 1u6s s MET 317 Cb -0.12 -3.00 0.00 0.00 2.01 0.00 0.00 34.83 33.72 1u6s s MET 317 CO 0.01 -0.50 0.00 -0.35 -0.01 0.00 0.00 175.02 174.18 1u6s n PRO 317 N 1.00 1.62 -0.97 2.03 -0.04 -1.26 -1.28 135.00 136.10 1u6s n PRO 317 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 1u6s n PRO 317 Cb 0.39 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.85 1u6s n PRO 317 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09