#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n74 h SER 2 N 0.00 0.00 -0.23 3.17 0.87 -1.93 -2.98 113.55 112.45 3n74 h SER 2 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3n74 h SER 2 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 3n74 h SER 2 CO 0.00 0.21 0.00 0.18 -0.53 0.00 0.00 176.83 176.69 3n74 n LEU 3 N -3.57 3.68 -4.77 2.23 4.77 -0.83 -4.68 117.00 113.84 3n74 n LEU 3 Ca -0.01 -3.01 -0.41 0.00 -0.03 0.00 0.00 56.01 52.55 3n74 n LEU 3 Cb 0.35 -0.53 -0.01 0.00 -2.33 0.00 0.00 43.42 40.91 3n74 n LEU 3 CO 0.33 0.68 1.12 -1.61 -1.33 0.00 0.00 177.39 176.57 3n74 s GLU 4 N -2.80 4.17 0.00 3.23 0.41 -1.10 -1.64 118.70 120.96 3n74 s GLU 4 Ca 0.41 2.49 0.00 0.00 -0.41 0.00 0.00 54.97 57.46 3n74 s GLU 4 Cb 0.33 -3.00 0.00 0.00 -1.78 0.00 0.00 34.13 29.68 3n74 s GLU 4 CO 0.08 -0.47 0.00 0.41 -0.49 0.00 0.00 175.26 174.79 3n74 n GLY 5 N 0.79 1.42 3.92 -1.39 0.00 -1.22 -4.93 105.19 103.77 3n74 n GLY 5 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 3n74 n GLY 5 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n74 s LYS 6 N -0.09 3.57 -0.15 1.61 -0.14 -0.65 -4.95 119.74 118.93 3n74 s LYS 6 Ca 0.00 -0.20 0.02 0.00 -1.36 0.00 0.00 55.97 54.43 3n74 s LYS 6 Cb 0.00 -2.78 0.01 0.00 -1.68 0.00 0.00 37.83 33.39 3n74 s LYS 6 CO 0.00 0.35 -0.21 0.08 -0.76 0.00 0.00 175.35 174.81 3n74 s VAL 7 N -1.92 2.03 -0.13 3.17 1.01 -1.26 -0.99 120.40 122.32 3n74 s VAL 7 Ca 0.41 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.44 3n74 s VAL 7 Cb -0.11 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.45 3n74 s VAL 7 CO 0.29 0.54 -0.16 0.00 0.00 0.00 0.00 175.10 175.77 3n74 s ALA 8 N 0.99 2.48 -0.17 5.51 0.00 -0.37 -0.38 121.76 129.82 3n74 s ALA 8 Ca -0.03 -0.96 -0.07 0.00 0.00 0.00 0.00 51.96 50.90 3n74 s ALA 8 Cb -0.15 -1.13 -0.04 0.00 0.00 0.00 0.00 23.12 21.80 3n74 s ALA 8 CO -0.06 0.15 0.05 -1.17 0.00 0.00 0.00 175.76 174.74 3n74 s LEU 9 N 0.52 3.77 -0.10 0.00 0.20 0.11 -0.67 118.68 122.50 3n74 s LEU 9 Ca -0.10 0.08 0.02 0.00 0.69 0.00 0.00 54.13 54.81 3n74 s LEU 9 Cb -0.16 -1.94 0.01 0.00 -0.43 0.00 0.00 46.19 43.67 3n74 s LEU 9 CO 0.04 0.19 -0.15 -0.63 -0.29 0.00 0.00 176.35 175.52 3n74 s ILE 10 N 0.25 1.43 0.43 6.68 1.01 -0.69 0.20 121.20 130.51 3n74 s ILE 10 Ca 0.03 -0.61 -0.04 0.00 0.00 0.00 0.00 60.65 60.02 3n74 s ILE 10 Cb -0.12 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 41.00 3n74 s ILE 10 CO 0.01 0.43 0.71 0.42 0.00 0.00 0.00 174.94 176.51 3n74 s THR 11 N 0.92 4.95 -1.44 2.92 -4.23 -0.67 -1.44 115.64 116.65 3n74 s THR 11 Ca -0.08 0.09 -0.10 0.00 -1.18 0.00 0.00 61.69 60.41 3n74 s THR 11 Cb -0.15 -3.84 0.07 0.00 1.34 0.00 0.00 72.50 69.92 3n74 s THR 11 CO -0.00 -0.71 0.70 0.61 -0.54 0.00 0.00 174.62 174.68 3n74 n GLY 12 N -1.95 -0.50 0.64 3.99 0.00 -0.22 -3.20 105.19 103.96 3n74 n GLY 12 Ca -0.01 0.14 0.11 0.00 0.00 0.00 0.00 46.02 46.26 3n74 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n74 n ALA 13 N -3.98 2.51 0.79 4.61 0.00 -0.95 -3.90 120.51 119.59 3n74 n ALA 13 Ca -0.01 -0.58 0.11 0.00 0.00 0.00 0.00 53.44 52.96 3n74 n ALA 13 Cb 0.55 -1.06 0.49 0.00 0.00 0.00 0.00 19.45 19.43 3n74 n ALA 13 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n74 n GLY 14 N 1.19 -1.28 3.81 0.00 0.00 -1.26 -3.33 105.19 104.31 3n74 n GLY 14 Ca 0.17 -0.08 -0.05 0.00 0.00 0.00 0.00 46.02 46.06 3n74 n GLY 14 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3n74 s SER 15 N -2.99 -0.14 0.93 1.61 1.04 -1.25 -4.61 113.70 108.28 3n74 s SER 15 Ca 0.11 -0.60 0.00 0.00 0.48 0.00 0.00 55.95 55.94 3n74 s SER 15 Cb 0.15 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.87 3n74 s SER 15 CO 0.42 -1.14 0.00 0.61 0.98 0.00 0.00 173.24 174.11 3n74 n GLY 16 N -0.51 2.27 0.29 7.32 0.00 -1.26 -1.84 105.19 111.46 3n74 n GLY 16 Ca -0.05 -0.44 0.06 0.00 0.00 0.00 0.00 46.02 45.58 3n74 n GLY 16 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3n74 h PHE 17 N 0.00 0.69 -0.39 1.61 0.04 -1.16 -0.52 116.94 117.21 3n74 h PHE 17 Ca 0.00 0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.74 3n74 h PHE 17 Cb 0.00 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 37.95 3n74 h PHE 17 CO 0.00 0.17 -0.02 0.78 -0.60 0.00 0.00 178.31 178.65 3n74 h GLY 18 N 0.59 0.76 1.00 -1.45 0.00 -1.64 0.27 103.07 102.60 3n74 h GLY 18 Ca 0.43 -0.57 -0.04 0.00 0.00 0.00 0.00 47.33 47.15 3n74 h GLY 18 CO -0.35 0.52 0.23 -2.09 0.00 0.00 0.00 176.54 174.85 3n74 h GLU 19 N 0.52 0.93 -0.37 4.80 4.81 -1.03 -0.44 114.58 123.80 3n74 h GLU 19 Ca 0.11 -0.18 0.03 0.00 -0.13 0.00 0.00 59.36 59.19 3n74 h GLU 19 Cb 0.50 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.70 3n74 h GLU 19 CO 0.02 0.81 0.16 0.78 -0.73 0.00 0.00 179.01 180.05 3n74 h GLY 20 N 0.86 0.49 1.14 1.92 0.00 -0.58 -2.04 103.07 104.87 3n74 h GLY 20 Ca 0.20 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 3n74 h GLY 20 CO -0.01 0.07 0.36 -0.33 0.00 0.00 0.00 176.54 176.62 3n74 h MET 21 N 0.34 1.11 -0.37 4.80 2.86 -0.12 -2.08 114.93 121.47 3n74 h MET 21 Ca 0.16 -0.16 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 3n74 h MET 21 Cb 0.10 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.55 3n74 h MET 21 CO -0.13 0.86 -0.00 0.00 1.06 0.00 0.00 176.91 178.70 3n74 h ALA 22 N 1.29 0.51 -0.49 6.32 0.00 -0.80 -0.05 119.26 126.04 3n74 h ALA 22 Ca 0.26 -0.25 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 3n74 h ALA 22 Cb 0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3n74 h ALA 22 CO -0.03 0.28 -0.13 0.87 0.00 0.00 0.00 179.25 180.23 3n74 h LYS 23 N 0.48 0.92 -0.24 0.00 1.57 -1.31 -1.97 116.57 116.01 3n74 h LYS 23 Ca 0.11 -0.34 -0.05 0.00 -1.87 0.00 0.00 60.65 58.50 3n74 h LYS 23 Cb 0.47 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 3n74 h LYS 23 CO 0.02 0.99 -0.03 -0.09 -0.57 0.00 0.00 179.45 179.77 3n74 h ARG 24 N 0.81 0.45 -0.85 3.15 9.65 -1.16 -1.25 114.38 125.20 3n74 h ARG 24 Ca 0.13 -0.16 -0.02 0.00 -1.10 0.00 0.00 59.98 58.83 3n74 h ARG 24 Cb 0.67 -0.03 -0.04 0.00 -1.39 0.00 0.00 29.97 29.18 3n74 h ARG 24 CO 0.05 0.65 0.46 0.74 2.80 0.00 0.00 179.97 184.67 3n74 h PHE 25 N 0.21 1.16 -0.51 2.20 -1.00 -1.00 -1.42 116.94 116.58 3n74 h PHE 25 Ca 0.07 -0.03 -0.09 0.00 2.81 0.00 0.00 57.97 60.72 3n74 h PHE 25 Cb 0.47 -0.37 -0.02 0.00 3.61 0.00 0.00 35.95 39.64 3n74 h PHE 25 CO 0.04 0.81 -0.06 0.00 -1.61 0.00 0.00 178.31 177.50 3n74 h ALA 26 N 1.25 0.94 -0.01 2.45 0.00 -1.26 -1.53 119.26 121.09 3n74 h ALA 26 Ca 0.30 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3n74 h ALA 26 Cb 0.03 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 3n74 h ALA 26 CO -0.05 0.63 -0.09 1.57 0.00 0.00 0.00 179.25 181.31 3n74 h LYS 27 N 0.82 0.02 -0.05 0.00 2.10 -0.80 -1.86 116.57 116.80 3n74 h LYS 27 Ca 0.14 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.79 3n74 h LYS 27 Cb 0.57 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.89 3n74 h LYS 27 CO 0.03 0.11 0.00 0.41 -2.00 0.00 0.00 179.45 178.01 3n74 n GLY 28 N -1.25 -0.71 0.00 0.07 0.00 -0.57 -4.67 105.19 98.06 3n74 n GLY 28 Ca -0.03 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.85 3n74 n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n74 n GLY 29 N 0.78 0.43 3.80 -0.02 0.00 -0.70 -1.96 105.19 107.52 3n74 n GLY 29 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 3n74 n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n74 s ALA 30 N -2.00 3.13 0.43 4.61 0.00 -0.64 -3.39 121.76 123.90 3n74 s ALA 30 Ca 0.00 0.49 -0.22 0.00 0.00 0.00 0.00 51.96 52.23 3n74 s ALA 30 Cb 0.00 -3.18 -0.09 0.00 0.00 0.00 0.00 23.12 19.85 3n74 s ALA 30 CO 0.00 0.12 1.02 0.15 0.00 0.00 0.00 175.76 177.06 3n74 s LYS 31 N -2.52 4.09 -0.04 0.00 -0.14 -0.16 -4.12 119.74 116.86 3n74 s LYS 31 Ca 0.55 1.38 0.02 0.00 -1.36 0.00 0.00 55.97 56.56 3n74 s LYS 31 Cb -0.15 -2.36 0.01 0.00 -1.68 0.00 0.00 37.83 33.65 3n74 s LYS 31 CO 0.20 -0.18 -0.06 0.14 -0.76 0.00 0.00 175.35 174.69 3n74 s VAL 32 N -1.84 0.62 -0.29 3.17 -7.23 -0.14 -1.24 120.40 113.45 3n74 s VAL 32 Ca 0.61 -0.21 -0.11 0.00 -1.81 0.00 0.00 61.98 60.46 3n74 s VAL 32 Cb -0.18 -0.60 -0.04 0.00 0.56 0.00 0.00 36.38 36.13 3n74 s VAL 32 CO 0.22 0.23 0.19 -0.69 -0.31 0.00 0.00 175.10 174.74 3n74 s VAL 33 N 0.62 5.15 -0.56 1.32 1.01 0.15 -0.80 120.40 127.29 3n74 s VAL 33 Ca -0.09 0.00 -0.18 0.00 0.00 0.00 0.00 61.98 61.72 3n74 s VAL 33 Cb -0.12 -3.50 0.11 0.00 0.00 0.00 0.00 36.38 32.87 3n74 s VAL 33 CO 0.01 0.19 0.61 -0.63 0.00 0.00 0.00 175.10 175.27 3n74 s ILE 34 N 1.73 4.98 -0.20 2.22 -1.09 0.24 -1.70 121.20 127.38 3n74 s ILE 34 Ca 0.07 -1.16 -0.07 0.00 -2.23 0.00 0.00 60.65 57.26 3n74 s ILE 34 Cb -0.16 -4.41 -0.04 0.00 -1.58 0.00 0.00 42.46 36.27 3n74 s ILE 34 CO 0.10 -0.99 0.06 -0.69 -1.23 0.00 0.00 174.94 172.18 3n74 s VAL 35 N 2.24 4.64 -0.01 2.92 1.01 -0.52 -0.30 120.40 130.38 3n74 s VAL 35 Ca 0.08 -0.08 -0.24 0.00 0.00 0.00 0.00 61.98 61.74 3n74 s VAL 35 Cb -0.26 -3.11 0.05 0.00 0.00 0.00 0.00 36.38 33.07 3n74 s VAL 35 CO 0.05 0.43 0.53 -0.62 0.00 0.00 0.00 175.10 175.49 3n74 s ASP 36 N 0.67 -0.46 0.25 3.32 2.15 -0.74 -1.05 116.67 120.81 3n74 s ASP 36 Ca 0.03 0.37 0.04 0.00 0.43 0.00 0.00 52.55 53.41 3n74 s ASP 36 Cb -0.13 0.46 0.31 0.00 -0.30 0.00 0.00 42.92 43.27 3n74 s ASP 36 CO 0.02 -0.61 1.62 -0.09 -0.17 0.00 0.00 175.17 175.94 3n74 h ARG 37 N 3.14 0.32 -6.34 4.34 9.65 -1.72 -1.21 114.38 122.57 3n74 h ARG 37 Ca -0.29 -0.18 -0.55 0.00 -1.10 0.00 0.00 59.98 57.86 3n74 h ARG 37 Cb 1.17 0.01 -0.08 0.00 -1.39 0.00 0.00 29.97 29.68 3n74 h ARG 37 CO 0.40 0.74 1.03 0.34 2.80 0.00 0.00 179.97 185.28 3n74 s ASP 38 N -6.88 6.19 0.14 -3.80 2.15 -1.26 -4.66 116.67 108.54 3n74 s ASP 38 Ca -0.05 -0.42 -0.18 0.00 0.43 0.00 0.00 52.55 52.33 3n74 s ASP 38 Cb 0.13 -2.55 -0.02 0.00 -0.30 0.00 0.00 42.92 40.17 3n74 s ASP 38 CO 0.80 -1.78 1.79 0.50 -0.17 0.00 0.00 175.17 176.30 3n74 h LYS 39 N 9.96 0.37 -0.93 4.34 3.64 -1.93 -2.09 116.57 129.93 3n74 h LYS 39 Ca -0.28 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.07 3n74 h LYS 39 Cb 1.05 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.74 3n74 h LYS 39 CO 1.27 0.24 0.55 0.00 -2.27 0.00 0.00 179.45 179.24 3n74 h ALA 40 N 1.12 1.19 -0.33 5.00 0.00 -1.96 -1.43 119.26 122.85 3n74 h ALA 40 Ca 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3n74 h ALA 40 Cb -0.02 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.38 3n74 h ALA 40 CO -0.04 0.65 0.22 0.78 0.00 0.00 0.00 179.25 180.86 3n74 h GLY 41 N 1.28 0.47 0.88 0.00 0.00 -1.81 -0.25 103.07 103.64 3n74 h GLY 41 Ca 0.33 -0.18 0.02 0.00 0.00 0.00 0.00 47.33 47.51 3n74 h GLY 41 CO -0.06 0.17 0.27 0.00 0.00 0.00 0.00 176.54 176.93 3n74 h ALA 42 N 1.12 0.59 -0.40 3.60 0.00 -1.12 -1.53 119.26 121.53 3n74 h ALA 42 Ca 0.12 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 3n74 h ALA 42 Cb -0.05 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3n74 h ALA 42 CO -0.03 -0.04 -0.16 0.93 0.00 0.00 0.00 179.25 179.96 3n74 h GLU 43 N 0.55 0.75 0.02 0.00 5.08 -1.15 -0.91 114.58 118.92 3n74 h GLU 43 Ca 0.19 -0.27 -0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3n74 h GLU 43 Cb 0.02 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.22 3n74 h GLU 43 CO -0.09 0.86 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.69 3n74 h ARG 44 N 0.67 -0.02 -0.75 2.33 2.43 -0.82 -1.93 114.38 116.28 3n74 h ARG 44 Ca 0.11 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.22 3n74 h ARG 44 Cb 0.64 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.16 3n74 h ARG 44 CO 0.04 0.14 0.25 0.28 -1.51 0.00 0.00 179.97 179.18 3n74 h VAL 45 N -0.17 1.26 -0.74 0.20 2.07 -1.08 -0.90 116.25 116.88 3n74 h VAL 45 Ca -0.00 -0.88 -0.05 0.00 0.82 0.00 0.00 66.70 66.59 3n74 h VAL 45 Cb 0.17 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 3n74 h VAL 45 CO 0.00 0.35 0.29 0.00 0.02 0.00 0.00 177.57 178.23 3n74 h ALA 46 N 1.16 0.97 0.00 1.67 0.00 -1.20 -2.58 119.26 119.27 3n74 h ALA 46 Ca 0.25 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 3n74 h ALA 46 Cb 0.28 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3n74 h ALA 46 CO -0.01 0.60 -0.32 0.78 0.00 0.00 0.00 179.25 180.30 3n74 h GLY 47 N 1.08 0.00 1.91 0.00 0.00 -0.91 -1.26 103.07 103.88 3n74 h GLY 47 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.58 3n74 h GLY 47 CO -0.02 0.00 -0.08 0.83 0.00 0.00 0.00 176.54 177.27 3n74 h GLU 48 N 0.00 0.00 0.06 4.80 5.08 -0.86 -3.31 114.58 120.35 3n74 h GLU 48 Ca -0.00 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 57.98 3n74 h GLU 48 Cb 0.70 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.91 3n74 h GLU 48 CO 0.04 0.00 -2.17 -0.89 -1.00 0.00 0.00 179.01 174.99 3n74 n ILE 49 N -2.83 1.65 0.00 3.13 5.41 -1.00 -5.10 119.36 120.62 3n74 n ILE 49 Ca 0.04 -0.57 0.00 0.00 1.00 0.00 0.00 62.75 63.22 3n74 n ILE 49 Cb 0.50 -1.64 0.00 0.00 -0.71 0.00 0.00 39.64 37.79 3n74 n ILE 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3n74 n GLY 50 N 2.03 -0.02 0.31 7.39 0.00 -0.50 -4.69 105.19 109.71 3n74 n GLY 50 Ca -0.38 -1.90 0.19 0.00 0.00 0.00 0.00 46.02 43.92 3n74 n GLY 50 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3n74 h ASP 51 N 0.00 0.00 0.75 1.61 3.32 -1.95 -1.04 116.42 119.12 3n74 h ASP 51 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3n74 h ASP 51 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3n74 h ASP 51 CO 0.00 0.02 0.00 0.00 -1.72 0.00 0.00 179.24 177.54 3n74 n ALA 52 N -2.17 1.90 -2.48 3.45 0.00 -1.26 -4.84 120.51 115.11 3n74 n ALA 52 Ca -0.02 -0.04 -0.33 0.00 0.00 0.00 0.00 53.44 53.05 3n74 n ALA 52 Cb 0.14 -1.34 -0.13 0.00 0.00 0.00 0.00 19.45 18.12 3n74 n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3n74 s ALA 53 N -3.05 2.68 -0.09 0.00 0.00 -0.40 -0.96 121.76 119.94 3n74 s ALA 53 Ca 0.09 -1.00 0.03 0.00 0.00 0.00 0.00 51.96 51.08 3n74 s ALA 53 Cb 0.12 -0.96 0.01 0.00 0.00 0.00 0.00 23.12 22.29 3n74 s ALA 53 CO 0.38 0.56 -0.20 -1.17 0.00 0.00 0.00 175.76 175.34 3n74 s LEU 54 N -0.83 1.93 0.09 0.00 2.96 0.02 -4.89 118.68 117.96 3n74 s LEU 54 Ca 0.12 -0.47 -0.24 0.00 -0.22 0.00 0.00 54.13 53.32 3n74 s LEU 54 Cb -0.11 -1.21 -0.06 0.00 0.50 0.00 0.00 46.19 45.31 3n74 s LEU 54 CO 0.01 0.11 0.74 0.00 -1.32 0.00 0.00 176.35 175.90 3n74 s ALA 55 N 0.49 3.42 -0.06 5.97 0.00 -1.26 0.82 121.76 131.14 3n74 s ALA 55 Ca -0.17 0.28 -0.01 0.00 0.00 0.00 0.00 51.96 52.06 3n74 s ALA 55 Cb -0.17 -2.94 0.03 0.00 0.00 0.00 0.00 23.12 20.04 3n74 s ALA 55 CO 0.06 0.17 0.02 0.08 0.00 0.00 0.00 175.76 176.09 3n74 s VAL 56 N -0.52 0.23 -0.09 0.00 1.01 0.59 -4.89 120.40 116.74 3n74 s VAL 56 Ca 0.36 0.19 -0.25 0.00 0.00 0.00 0.00 61.98 62.28 3n74 s VAL 56 Cb -0.21 -0.41 -0.03 0.00 0.00 0.00 0.00 36.38 35.73 3n74 s VAL 56 CO 0.23 0.23 0.81 0.00 0.00 0.00 0.00 175.10 176.37 3n74 s ALA 57 N 1.89 3.36 -0.27 5.51 0.00 -1.26 -1.79 121.76 129.19 3n74 s ALA 57 Ca 0.03 0.19 -0.24 0.00 0.00 0.00 0.00 51.96 51.94 3n74 s ALA 57 Cb -0.12 -3.13 0.08 0.00 0.00 0.00 0.00 23.12 19.94 3n74 s ALA 57 CO -0.04 -0.32 0.74 0.00 0.00 0.00 0.00 175.76 176.14 3n74 s ALA 58 N 1.31 -1.81 -0.58 0.00 0.00 -0.46 -4.87 121.76 115.36 3n74 s ALA 58 Ca 0.41 2.05 -0.17 0.00 0.00 0.00 0.00 51.96 54.25 3n74 s ALA 58 Cb -0.18 -1.22 0.12 0.00 0.00 0.00 0.00 23.12 21.84 3n74 s ALA 58 CO 0.18 -0.34 0.60 0.34 0.00 0.00 0.00 175.76 176.55 3n74 s ASP 59 N 0.48 6.21 0.01 0.00 -1.08 -1.26 -2.04 116.67 119.00 3n74 s ASP 59 Ca -0.01 -1.69 0.06 0.00 -0.52 0.00 0.00 52.55 50.39 3n74 s ASP 59 Cb -0.05 -2.25 0.25 0.00 -1.46 0.00 0.00 42.92 39.41 3n74 s ASP 59 CO -0.01 -0.95 1.18 2.30 0.52 0.00 0.00 175.17 178.20 3n74 n ILE 60 N 5.32 1.63 0.37 4.11 -5.35 -1.26 -1.28 119.36 122.90 3n74 n ILE 60 Ca -0.11 0.42 0.10 0.00 -0.27 0.00 0.00 62.75 62.90 3n74 n ILE 60 Cb 0.41 -1.34 0.43 0.00 -1.74 0.00 0.00 39.64 37.40 3n74 n ILE 60 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3n74 n SER 61 N -1.54 0.45 -4.42 7.28 3.41 -1.26 -4.22 113.62 113.33 3n74 n SER 61 Ca 0.01 0.63 -0.35 0.00 -0.26 0.00 0.00 58.87 58.89 3n74 n SER 61 Cb 0.06 -0.72 -0.13 0.00 -0.26 0.00 0.00 64.21 63.16 3n74 n SER 61 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3n74 s LYS 62 N -3.25 3.59 0.26 4.33 -0.14 -0.41 -4.82 119.74 119.30 3n74 s LYS 62 Ca 0.04 -0.52 -0.02 0.00 -1.36 0.00 0.00 55.97 54.11 3n74 s LYS 62 Cb 0.08 -3.15 0.52 0.00 -1.68 0.00 0.00 37.83 33.60 3n74 s LYS 62 CO 0.31 -0.09 1.74 1.49 -0.76 0.00 0.00 175.35 178.04 3n74 h GLU 63 N 7.86 0.51 -0.65 1.68 4.81 -1.86 -1.17 114.58 125.75 3n74 h GLU 63 Ca -0.38 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.81 3n74 h GLU 63 Cb 1.17 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.41 3n74 h GLU 63 CO 0.60 0.33 0.38 0.00 -0.73 0.00 0.00 179.01 179.59 3n74 h ALA 64 N 1.57 0.83 -0.48 2.92 0.00 -1.94 0.51 119.26 122.67 3n74 h ALA 64 Ca 0.45 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.18 3n74 h ALA 64 Cb 0.68 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 3n74 h ALA 64 CO -0.40 0.32 -0.06 -0.44 0.00 0.00 0.00 179.25 178.67 3n74 h ASP 65 N 0.88 0.82 -0.27 0.00 5.19 -1.51 -2.21 116.42 119.32 3n74 h ASP 65 Ca 0.23 -0.23 -0.07 0.00 -0.62 0.00 0.00 57.03 56.34 3n74 h ASP 65 Cb 0.00 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.29 3n74 h ASP 65 CO -0.04 0.92 -0.12 0.58 -3.12 0.00 0.00 179.24 177.45 3n74 h VAL 66 N 0.76 1.30 -0.11 -1.35 2.07 -0.82 -0.91 116.25 117.19 3n74 h VAL 66 Ca 0.14 -1.20 0.04 0.00 0.82 0.00 0.00 66.70 66.49 3n74 h VAL 66 Cb 0.55 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.79 3n74 h VAL 66 CO 0.03 0.38 -0.20 0.44 0.02 0.00 0.00 177.57 178.24 3n74 h ASP 67 N 0.29 -0.61 -0.75 0.57 3.32 -0.75 -0.93 116.42 117.57 3n74 h ASP 67 Ca 0.06 0.10 0.03 0.00 0.02 0.00 0.00 57.03 57.24 3n74 h ASP 67 Cb 0.63 0.27 -0.05 0.00 0.22 0.00 0.00 39.33 40.41 3n74 h ASP 67 CO 0.04 -0.25 0.47 0.00 -1.72 0.00 0.00 179.24 177.78 3n74 h ALA 68 N 0.73 0.98 -0.19 3.45 0.00 -1.37 -1.62 119.26 121.25 3n74 h ALA 68 Ca 0.09 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.00 3n74 h ALA 68 Cb 0.40 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3n74 h ALA 68 CO -0.26 0.26 0.06 0.00 0.00 0.00 0.00 179.25 179.31 3n74 h ALA 69 N 1.32 0.20 -0.13 0.00 0.00 -0.75 -0.37 119.26 119.53 3n74 h ALA 69 Ca 0.30 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 3n74 h ALA 69 Cb 0.02 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3n74 h ALA 69 CO -0.11 -0.37 0.04 0.28 0.00 0.00 0.00 179.25 179.09 3n74 h VAL 70 N 0.15 1.17 -0.96 0.00 2.07 -1.03 -1.98 116.25 115.66 3n74 h VAL 70 Ca 0.08 -0.52 0.07 0.00 0.82 0.00 0.00 66.70 67.16 3n74 h VAL 70 Cb 0.05 1.28 -0.07 0.00 -1.52 0.00 0.00 31.29 31.03 3n74 h VAL 70 CO -0.09 0.15 0.61 -0.08 0.02 0.00 0.00 177.57 178.19 3n74 h GLU 71 N 0.03 1.06 -0.46 1.57 4.81 -1.15 -1.67 114.58 118.78 3n74 h GLU 71 Ca 0.04 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.17 3n74 h GLU 71 Cb 0.20 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.32 3n74 h GLU 71 CO -0.00 0.70 0.14 0.00 -0.73 0.00 0.00 179.01 179.12 3n74 h ALA 72 N 1.45 0.60 -0.59 2.92 0.00 -0.81 -0.92 119.26 121.92 3n74 h ALA 72 Ca 0.43 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 55.19 3n74 h ALA 72 Cb 0.21 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3n74 h ALA 72 CO -0.19 0.25 0.34 0.00 0.00 0.00 0.00 179.25 179.65 3n74 h ALA 73 N 0.99 0.76 -0.20 0.00 0.00 -0.85 -1.49 119.26 118.49 3n74 h ALA 73 Ca 0.15 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.85 3n74 h ALA 73 Cb 0.27 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.93 3n74 h ALA 73 CO -0.00 0.03 -0.71 -0.07 0.00 0.00 0.00 179.25 178.50 3n74 h LEU 74 N 0.65 0.97 -1.06 0.00 3.38 -1.18 -0.97 115.31 117.09 3n74 h LEU 74 Ca 0.25 -0.60 -0.09 0.00 0.09 0.00 0.00 57.88 57.53 3n74 h LEU 74 Cb 0.09 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3n74 h LEU 74 CO -0.13 1.40 -0.27 -1.28 0.09 0.00 0.00 178.44 178.25 3n74 h SER 75 N 0.59 0.34 0.01 -0.43 0.87 -1.11 0.20 113.55 114.02 3n74 h SER 75 Ca -0.03 -0.11 -0.00 0.00 -1.23 0.00 0.00 61.79 60.42 3n74 h SER 75 Cb 1.34 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 3n74 h SER 75 CO 0.15 0.61 -0.01 0.50 -0.53 0.00 0.00 176.83 177.55 3n74 h LYS 76 N 0.30 -0.01 -0.01 2.24 1.63 -1.23 -3.40 116.57 116.08 3n74 h LYS 76 Ca 0.04 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.84 3n74 h LYS 76 Cb 0.64 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.28 3n74 h LYS 76 CO 0.05 0.74 -0.58 1.19 -3.45 0.00 0.00 179.45 177.40 3n74 n PHE 77 N -4.67 0.00 0.00 1.91 0.99 -0.38 -4.99 117.46 110.32 3n74 n PHE 77 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.37 3n74 n PHE 77 Cb 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.85 3n74 n PHE 77 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3n74 n GLY 78 N 1.31 2.99 3.67 1.37 0.00 0.69 -4.93 105.19 110.29 3n74 n GLY 78 Ca 0.06 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 3n74 n GLY 78 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n74 s LYS 79 N -0.12 1.33 -0.04 1.61 -2.85 -1.26 -4.94 119.74 113.47 3n74 s LYS 79 Ca 0.00 -0.66 0.02 0.00 -1.00 0.00 0.00 55.97 54.34 3n74 s LYS 79 Cb 0.00 0.51 0.01 0.00 -2.06 0.00 0.00 37.83 36.28 3n74 s LYS 79 CO 0.00 -0.60 -0.09 0.08 0.10 0.00 0.00 175.35 174.83 3n74 s VAL 80 N -3.55 0.85 -0.07 1.79 1.01 -1.26 -4.76 120.40 114.40 3n74 s VAL 80 Ca 0.08 -0.37 0.09 0.00 0.00 0.00 0.00 61.98 61.79 3n74 s VAL 80 Cb -0.03 -0.78 -0.13 0.00 0.00 0.00 0.00 36.38 35.44 3n74 s VAL 80 CO -0.02 0.28 0.09 0.47 0.00 0.00 0.00 175.10 175.91 3n74 n ASP 81 N 3.52 2.60 -3.90 3.32 8.00 0.49 -4.78 116.55 125.79 3n74 n ASP 81 Ca -0.20 0.00 -0.20 0.00 0.71 0.00 0.00 54.79 55.09 3n74 n ASP 81 Cb 0.53 0.93 -0.16 0.00 -0.02 0.00 0.00 41.12 42.40 3n74 n ASP 81 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3n74 s ILE 82 N -2.37 0.57 -0.16 0.53 1.01 -0.54 -0.84 121.20 119.40 3n74 s ILE 82 Ca -0.05 -0.14 -0.01 0.00 0.00 0.00 0.00 60.65 60.46 3n74 s ILE 82 Cb 0.04 -0.59 -0.01 0.00 0.01 0.00 0.00 42.46 41.91 3n74 s ILE 82 CO 0.41 0.23 -0.12 -0.22 0.00 0.00 0.00 174.94 175.24 3n74 s LEU 83 N 0.92 2.65 -0.33 2.97 2.96 0.59 -0.72 118.68 127.73 3n74 s LEU 83 Ca -0.11 -0.40 -0.06 0.00 -0.22 0.00 0.00 54.13 53.34 3n74 s LEU 83 Cb -0.14 -1.62 0.04 0.00 0.50 0.00 0.00 46.19 44.97 3n74 s LEU 83 CO 0.00 0.10 0.10 -0.69 -1.32 0.00 0.00 176.35 174.54 3n74 s VAL 84 N 0.76 3.75 -0.87 1.68 1.01 0.13 -0.09 120.40 126.78 3n74 s VAL 84 Ca -0.05 -1.12 -0.23 0.00 0.00 0.00 0.00 61.98 60.58 3n74 s VAL 84 Cb -0.15 -3.12 0.07 0.00 0.00 0.00 0.00 36.38 33.18 3n74 s VAL 84 CO 0.01 -0.16 1.23 0.20 0.00 0.00 0.00 175.10 176.38 3n74 s ASN 85 N 1.40 6.40 -0.04 3.32 0.01 0.37 -1.67 114.94 124.74 3n74 s ASN 85 Ca -0.02 -1.31 0.04 0.00 -0.71 0.00 0.00 52.86 50.86 3n74 s ASN 85 Cb -0.19 -2.49 -0.06 0.00 0.41 0.00 0.00 41.25 38.92 3n74 s ASN 85 CO 0.03 -1.45 0.03 -3.20 -1.51 0.00 0.00 177.10 171.00 3n74 n ASN 86 N 8.14 3.94 -4.67 -1.22 5.15 -1.25 -0.37 115.26 124.97 3n74 n ASN 86 Ca 0.17 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.73 3n74 n ASN 86 Cb 0.49 0.72 -0.00 0.00 -0.53 0.00 0.00 39.78 40.45 3n74 n ASN 86 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3n74 n ALA 87 N -2.07 0.96 -3.61 5.20 0.00 -1.20 -4.82 120.51 114.97 3n74 n ALA 87 Ca -0.06 0.34 -0.11 0.00 0.00 0.00 0.00 53.44 53.61 3n74 n ALA 87 Cb 0.55 -2.20 -0.06 0.00 0.00 0.00 0.00 19.45 17.73 3n74 n ALA 87 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3n74 s GLY 88 N -0.42 -0.26 0.12 0.00 0.00 -1.26 -4.72 107.32 100.78 3n74 s GLY 88 Ca 0.57 2.33 0.08 0.00 0.00 0.00 0.00 44.72 47.70 3n74 s GLY 88 CO 0.61 1.53 -0.18 -0.26 0.00 0.00 0.00 173.10 174.80 3n74 s ILE 89 N -0.24 1.64 0.00 0.90 -4.36 -1.26 -4.67 121.20 113.21 3n74 s ILE 89 Ca 0.00 -1.67 0.00 0.00 -0.26 0.00 0.00 60.65 58.72 3n74 s ILE 89 Cb -0.03 -1.61 0.00 0.00 1.25 0.00 0.00 42.46 42.07 3n74 s ILE 89 CO -0.02 -0.21 0.00 0.61 0.24 0.00 0.00 174.94 175.56 3n74 n GLY 90 N 0.76 6.84 3.22 6.27 0.00 -1.26 -4.88 105.19 116.14 3n74 n GLY 90 Ca -0.17 -1.87 -0.17 0.00 0.00 0.00 0.00 46.02 43.81 3n74 n GLY 90 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3n74 s HIS 91 N 0.94 1.30 0.41 1.61 -3.43 -1.26 -4.95 115.29 109.91 3n74 s HIS 91 Ca 0.00 -0.57 -0.25 0.00 -0.80 0.00 0.00 55.06 53.44 3n74 s HIS 91 Cb 0.00 -0.69 -0.10 0.00 -1.43 0.00 0.00 32.58 30.36 3n74 s HIS 91 CO 0.00 0.10 1.17 0.36 -2.00 0.00 0.00 174.74 174.37 3n74 n LYS 92 N 0.63 1.70 -1.70 -0.38 0.00 -1.26 -4.86 118.16 112.29 3n74 n LYS 92 Ca -0.16 0.61 -0.43 0.00 -0.00 0.00 0.00 58.31 58.32 3n74 n LYS 92 Cb 0.57 -2.24 -0.03 0.00 -0.00 0.00 0.00 35.03 33.32 3n74 n LYS 92 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 3n74 n PRO 93 N 0.10 2.61 -3.56 -1.58 -0.02 -1.26 -4.93 135.00 126.36 3n74 n PRO 93 Ca 0.08 0.95 -0.08 0.00 -2.02 0.00 0.00 63.50 62.42 3n74 n PRO 93 Cb 0.39 -2.79 -0.02 0.00 -0.02 0.00 0.00 33.50 31.06 3n74 n PRO 93 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 3n74 s GLN 94 N 1.72 1.13 0.08 -0.52 -2.07 -0.78 -5.04 119.66 114.18 3n74 s GLN 94 Ca 0.79 -0.49 -0.37 0.00 -1.82 0.00 0.00 55.36 53.47 3n74 s GLN 94 Cb -0.55 0.47 -0.17 0.00 -1.09 0.00 0.00 33.01 31.67 3n74 s GLN 94 CO 0.36 -0.50 1.20 0.09 -1.32 0.00 0.00 175.29 175.12 3n74 n ASN 95 N -0.35 1.02 -0.26 12.60 3.02 -1.26 -4.41 115.26 125.62 3n74 n ASN 95 Ca -0.10 1.13 0.12 0.00 -0.03 0.00 0.00 54.58 55.70 3n74 n ASN 95 Cb 0.62 -1.11 0.39 0.00 -0.61 0.00 0.00 39.78 39.07 3n74 n ASN 95 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3n74 h ALA 96 N 3.76 1.85 0.00 5.41 0.00 -1.99 -1.12 119.26 127.18 3n74 h ALA 96 Ca -0.47 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3n74 h ALA 96 Cb 1.37 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3n74 h ALA 96 CO 0.72 -0.09 0.00 -0.85 0.00 0.00 0.00 179.25 179.03 3n74 n GLU 97 N -4.55 0.17 0.00 0.00 0.00 -1.26 -2.70 120.64 112.29 3n74 n GLU 97 Ca 0.17 0.11 0.12 0.00 0.00 0.00 0.00 57.16 57.56 3n74 n GLU 97 Cb 0.47 -1.50 0.22 0.00 0.00 0.00 0.00 31.44 30.63 3n74 n GLU 97 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3n74 n LEU 98 N -1.38 1.03 -4.68 -1.84 4.77 -0.42 -4.81 117.00 109.67 3n74 n LEU 98 Ca 0.08 -0.29 -0.42 0.00 -0.03 0.00 0.00 56.01 55.34 3n74 n LEU 98 Cb 0.20 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.14 3n74 n LEU 98 CO 0.17 0.21 0.79 -0.69 -1.33 0.00 0.00 177.39 176.55 3n74 s VAL 99 N -2.70 4.77 0.47 4.08 1.01 -1.10 -5.02 120.40 121.92 3n74 s VAL 99 Ca 0.18 1.97 -0.04 0.00 0.00 0.00 0.00 61.98 64.09 3n74 s VAL 99 Cb 0.18 -4.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 3n74 s VAL 99 CO 0.62 -0.04 0.75 -1.61 0.00 0.00 0.00 175.10 174.82 3n74 s GLU 100 N 2.36 3.38 0.28 2.72 2.02 -1.26 -4.83 118.70 123.37 3n74 s GLU 100 Ca 0.45 -0.00 0.00 0.00 0.02 0.00 0.00 54.97 55.45 3n74 s GLU 100 Cb -0.17 -2.43 0.53 0.00 0.10 0.00 0.00 34.13 32.16 3n74 s GLU 100 CO 0.14 -0.23 1.83 -1.35 0.02 0.00 0.00 175.26 175.67 3n74 h PRO 101 N 0.27 0.94 -0.83 0.39 0.11 -1.98 -0.58 132.00 130.32 3n74 h PRO 101 Ca -0.47 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 65.55 3n74 h PRO 101 Cb 1.22 -0.21 -0.04 0.00 0.11 0.00 0.00 31.00 32.08 3n74 h PRO 101 CO 0.61 0.62 0.39 0.93 -0.21 0.00 0.00 178.00 180.34 3n74 h GLU 102 N 0.97 1.20 -0.10 1.05 3.07 -1.99 0.18 114.58 118.96 3n74 h GLU 102 Ca 0.48 -0.18 -0.05 0.00 -0.50 0.00 0.00 59.36 59.11 3n74 h GLU 102 Cb 0.47 -0.21 -0.00 0.00 -0.84 0.00 0.00 28.75 28.17 3n74 h GLU 102 CO -0.26 0.93 -0.13 1.49 -1.40 0.00 0.00 179.01 179.64 3n74 h GLU 103 N 1.18 0.26 -0.72 2.33 4.81 -1.76 -2.54 114.58 118.13 3n74 h GLU 103 Ca 0.28 -0.15 0.14 0.00 -0.13 0.00 0.00 59.36 59.50 3n74 h GLU 103 Cb 0.13 0.01 -0.10 0.00 0.63 0.00 0.00 28.75 29.43 3n74 h GLU 103 CO -0.03 0.70 0.25 0.35 -0.73 0.00 0.00 179.01 179.55 3n74 h PHE 104 N -0.17 0.41 -0.63 0.92 3.57 -0.64 -1.45 116.94 118.95 3n74 h PHE 104 Ca 0.01 0.04 -0.08 0.00 3.53 0.00 0.00 57.97 61.47 3n74 h PHE 104 Cb 0.67 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.31 3n74 h PHE 104 CO 0.10 0.02 0.09 -0.44 -2.23 0.00 0.00 178.31 175.84 3n74 h ASP 105 N 0.38 0.99 -0.17 0.41 3.32 -0.56 -1.99 116.42 118.80 3n74 h ASP 105 Ca 0.40 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 3n74 h ASP 105 Cb 0.61 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 3n74 h ASP 105 CO -0.42 1.00 0.09 -0.09 -1.72 0.00 0.00 179.24 178.10 3n74 h ARG 106 N 0.97 0.24 0.11 3.56 2.43 -1.00 0.51 114.38 121.21 3n74 h ARG 106 Ca 0.19 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 3n74 h ARG 106 Cb 0.44 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 3n74 h ARG 106 CO 0.01 0.25 -0.10 0.82 -1.51 0.00 0.00 179.97 179.44 3n74 h ILE 107 N 0.17 0.77 -0.82 1.20 2.04 -0.92 -1.98 117.51 117.98 3n74 h ILE 107 Ca 0.06 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.00 3n74 h ILE 107 Cb 0.08 0.77 -0.06 0.00 -0.74 0.00 0.00 36.82 36.87 3n74 h ILE 107 CO -0.01 0.00 0.53 0.58 0.00 0.00 0.00 178.15 179.26 3n74 h VAL 108 N -0.23 0.99 -0.46 1.67 2.07 -1.33 -0.64 116.25 118.32 3n74 h VAL 108 Ca 0.00 -0.28 0.03 0.00 0.82 0.00 0.00 66.70 67.27 3n74 h VAL 108 Cb 0.22 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.05 3n74 h VAL 108 CO -0.02 0.15 0.26 1.23 0.02 0.00 0.00 177.57 179.20 3n74 h GLY 109 N 0.82 0.64 0.00 2.17 0.00 -0.14 0.15 103.07 106.71 3n74 h GLY 109 Ca 0.37 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.49 3n74 h GLY 109 CO -0.14 0.15 -0.10 -2.08 0.00 0.00 0.00 176.54 174.36 3n74 h VAL 110 N 0.51 1.44 0.00 4.60 2.07 -1.24 0.95 116.25 124.58 3n74 h VAL 110 Ca 0.19 -2.12 -0.11 0.00 0.82 0.00 0.00 66.70 65.49 3n74 h VAL 110 Cb 0.05 2.75 -0.02 0.00 -1.52 0.00 0.00 31.29 32.56 3n74 h VAL 110 CO -0.11 0.49 -0.51 0.78 0.02 0.00 0.00 177.57 178.24 3n74 h ASN 111 N -1.00 0.00 0.00 0.57 4.21 -1.15 -2.77 115.58 115.44 3n74 h ASN 111 Ca -0.03 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.48 3n74 h ASN 111 Cb 0.87 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.07 3n74 h ASN 111 CO -0.02 0.51 -0.15 0.52 -1.29 0.00 0.00 177.43 177.01 3n74 n VAL 112 N -3.37 0.78 -0.25 2.81 0.31 -0.42 -4.42 118.33 113.77 3n74 n VAL 112 Ca 0.01 0.26 -0.00 0.00 -0.01 0.00 0.00 64.34 64.59 3n74 n VAL 112 Cb 0.67 -1.52 0.21 0.00 -0.91 0.00 0.00 33.84 32.29 3n74 n VAL 112 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 3n74 h ARG 113 N -0.15 1.07 -0.90 5.55 2.43 -0.76 -1.79 114.38 119.84 3n74 h ARG 113 Ca 0.00 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.09 3n74 h ARG 113 Cb 0.15 -0.24 -0.04 0.00 -0.42 0.00 0.00 29.97 29.42 3n74 h ARG 113 CO 0.00 0.71 0.50 0.78 -1.51 0.00 0.00 179.97 180.46 3n74 h GLY 114 N 1.10 1.33 1.17 2.80 0.00 -0.50 0.13 103.07 109.11 3n74 h GLY 114 Ca 0.30 -0.59 -0.13 0.00 0.00 0.00 0.00 47.33 46.90 3n74 h GLY 114 CO -0.06 0.57 -0.24 -2.08 0.00 0.00 0.00 176.54 174.73 3n74 h VAL 115 N 1.25 1.27 -0.40 4.60 2.07 -1.56 -1.82 116.25 121.67 3n74 h VAL 115 Ca 0.32 -1.40 -0.02 0.00 0.82 0.00 0.00 66.70 66.41 3n74 h VAL 115 Cb 0.01 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.93 3n74 h VAL 115 CO -0.05 0.48 0.15 0.22 0.02 0.00 0.00 177.57 178.39 3n74 h TYR 116 N 0.81 0.61 0.10 1.57 3.20 -0.60 -1.94 116.97 120.72 3n74 h TYR 116 Ca 0.10 -0.05 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 3n74 h TYR 116 Cb 0.81 -0.18 0.00 0.00 1.54 0.00 0.00 36.73 38.90 3n74 h TYR 116 CO 0.05 0.55 -0.05 -0.07 -1.64 0.00 0.00 178.16 177.00 3n74 h LEU 117 N 0.50 -0.12 -0.73 2.82 3.38 -0.67 -0.74 115.31 119.74 3n74 h LEU 117 Ca 0.13 -0.23 -0.07 0.00 0.09 0.00 0.00 57.88 57.81 3n74 h LEU 117 Cb 0.20 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 40.95 3n74 h LEU 117 CO -0.01 0.16 0.18 -0.03 0.09 0.00 0.00 178.44 178.84 3n74 h MET 118 N -0.40 1.15 -0.07 1.13 4.05 -1.33 -1.58 114.93 117.88 3n74 h MET 118 Ca -0.01 -0.27 -0.15 0.00 -0.28 0.00 0.00 59.70 58.99 3n74 h MET 118 Cb 0.33 -0.15 0.01 0.00 -0.80 0.00 0.00 31.60 30.99 3n74 h MET 118 CO 0.02 1.00 -0.54 1.15 0.23 0.00 0.00 176.91 178.77 3n74 h THR 119 N 1.09 1.39 0.00 -0.77 2.02 -1.37 -2.72 112.91 112.55 3n74 h THR 119 Ca 0.23 -1.91 -0.08 0.00 0.77 0.00 0.00 66.41 65.41 3n74 h THR 119 Cb 0.36 2.33 -0.01 0.00 -1.74 0.00 0.00 68.15 69.09 3n74 h THR 119 CO 0.00 0.57 -0.40 0.77 0.37 0.00 0.00 175.52 176.83 3n74 h SER 120 N 0.05 0.00 1.65 4.18 4.64 -1.03 -1.55 113.55 121.48 3n74 h SER 120 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 3n74 h SER 120 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 3n74 h SER 120 CO 0.11 0.40 0.00 0.11 -0.87 0.00 0.00 176.83 176.58 3n74 h LYS 121 N 0.00 0.00 0.00 4.77 1.79 -1.29 -3.28 116.57 118.56 3n74 h LYS 121 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3n74 h LYS 121 Cb 0.77 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.42 3n74 h LYS 121 CO 0.05 0.00 -1.77 1.28 -1.08 0.00 0.00 179.45 177.93 3n74 n LEU 122 N -2.64 0.20 -0.26 2.94 4.77 -1.02 -4.62 117.00 116.38 3n74 n LEU 122 Ca 0.05 -0.10 -0.02 0.00 -0.03 0.00 0.00 56.01 55.90 3n74 n LEU 122 Cb 0.46 0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.64 3n74 n LEU 122 CO 0.31 0.05 1.14 0.40 -1.33 0.00 0.00 177.39 177.97 3n74 h ILE 123 N 0.00 1.06 -0.67 -0.08 2.04 -1.35 -0.42 117.51 118.08 3n74 h ILE 123 Ca 0.00 -0.29 -0.06 0.00 1.00 0.00 0.00 64.86 65.51 3n74 h ILE 123 Cb 0.87 0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 3n74 h ILE 123 CO 0.00 0.16 0.19 -0.65 0.00 0.00 0.00 178.15 177.84 3n74 h PRO 124 N 0.85 1.04 -0.61 2.37 0.11 -1.82 0.12 132.00 134.06 3n74 h PRO 124 Ca 0.31 -0.22 -0.07 0.00 0.11 0.00 0.00 66.00 66.12 3n74 h PRO 124 Cb 0.09 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.02 3n74 h PRO 124 CO -0.14 0.91 0.09 1.25 -0.21 0.00 0.00 178.00 179.90 3n74 h HIS 125 N 1.00 1.06 -0.56 0.65 -0.00 -1.70 -2.10 115.15 113.51 3n74 h HIS 125 Ca 0.22 -0.14 -0.07 0.00 -0.00 0.00 0.00 60.37 60.38 3n74 h HIS 125 Cb 0.32 -0.29 -0.02 0.00 -0.00 0.00 0.00 27.41 27.41 3n74 h HIS 125 CO 0.02 0.91 0.07 0.74 -0.00 0.00 0.00 177.93 179.67 3n74 h PHE 126 N 0.94 0.95 -0.31 5.26 0.05 -0.36 -1.61 116.94 121.86 3n74 h PHE 126 Ca 0.19 -0.12 -0.08 0.00 3.82 0.00 0.00 57.97 61.78 3n74 h PHE 126 Cb 0.43 -0.27 -0.02 0.00 2.00 0.00 0.00 35.95 38.09 3n74 h PHE 126 CO 0.03 0.83 -0.13 0.87 -0.18 0.00 0.00 178.31 179.73 3n74 h LYS 127 N 0.85 0.54 -0.15 1.51 1.57 -0.56 -0.92 116.57 119.40 3n74 h LYS 127 Ca 0.17 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3n74 h LYS 127 Cb 0.40 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3n74 h LYS 127 CO 0.01 0.66 0.08 0.93 -0.57 0.00 0.00 179.45 180.56 3n74 h GLU 128 N 0.49 0.22 -0.54 3.15 5.08 -0.74 -1.12 114.58 121.12 3n74 h GLU 128 Ca 0.09 -0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.45 3n74 h GLU 128 Cb 0.52 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.69 3n74 h GLU 128 CO 0.03 0.25 0.32 -0.91 -1.00 0.00 0.00 179.01 177.70 3n74 h ASN 129 N 0.14 0.51 -0.38 1.42 2.35 -1.17 -2.30 115.58 116.14 3n74 h ASN 129 Ca 0.05 0.01 0.06 0.00 -0.55 0.00 0.00 56.30 55.87 3n74 h ASN 129 Cb 0.10 -0.10 -0.05 0.00 0.05 0.00 0.00 38.32 38.31 3n74 h ASN 129 CO -0.01 0.36 0.06 1.23 -1.65 0.00 0.00 177.43 177.42 3n74 h GLY 130 N 0.63 0.43 2.00 2.83 0.00 -0.86 0.15 103.07 108.26 3n74 h GLY 130 Ca 0.22 -0.01 -0.02 0.00 0.00 0.00 0.00 47.33 47.53 3n74 h GLY 130 CO -0.11 -0.04 -0.08 0.00 0.00 0.00 0.00 176.54 176.31 3n74 h ALA 131 N 1.30 1.61 -0.04 3.60 0.00 -0.92 -0.27 119.26 124.55 3n74 h ALA 131 Ca 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3n74 h ALA 131 Cb 0.23 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3n74 h ALA 131 CO -0.26 0.10 0.00 1.63 0.00 0.00 0.00 179.25 180.72 3n74 n LYS 132 N -4.07 1.26 -0.64 0.00 5.02 -0.78 -4.90 118.16 114.04 3n74 n LYS 132 Ca -0.03 -0.39 0.00 0.00 -2.02 0.00 0.00 58.31 55.88 3n74 n LYS 132 Cb 0.16 -1.38 0.00 0.00 -0.02 0.00 0.00 35.03 33.79 3n74 n LYS 132 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3n74 n GLY 133 N 0.97 0.72 3.44 0.72 0.00 -0.11 -5.05 105.19 105.87 3n74 n GLY 133 Ca 0.17 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.76 3n74 n GLY 133 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3n74 s GLN 134 N -0.36 2.99 0.34 1.61 -1.52 0.46 -4.97 119.66 118.21 3n74 s GLN 134 Ca 0.00 -1.12 -0.28 0.00 -1.95 0.00 0.00 55.36 52.01 3n74 s GLN 134 Cb 0.00 -4.04 -0.10 0.00 -0.22 0.00 0.00 33.01 28.65 3n74 s GLN 134 CO 0.00 -0.87 1.27 -2.00 -0.25 0.00 0.00 175.29 173.45 3n74 s GLU 135 N 1.72 4.34 0.31 2.91 2.12 -1.26 -2.50 118.70 126.34 3n74 s GLU 135 Ca 0.05 2.14 0.10 0.00 0.36 0.00 0.00 54.97 57.63 3n74 s GLU 135 Cb -0.21 -3.03 -0.06 0.00 0.26 0.00 0.00 34.13 31.09 3n74 s GLU 135 CO 0.09 -0.18 -0.12 0.00 -0.54 0.00 0.00 175.26 174.51 3n74 s VAL 137 N -2.55 0.13 -0.20 0.00 1.01 -0.02 -1.45 120.40 117.32 3n74 s VAL 137 Ca 0.32 -0.02 -0.04 0.00 0.00 0.00 0.00 61.98 62.24 3n74 s VAL 137 Cb -0.01 -0.15 -0.01 0.00 0.00 0.00 0.00 36.38 36.21 3n74 s VAL 137 CO 0.16 0.06 -0.05 -0.63 0.00 0.00 0.00 175.10 174.65 3n74 s ILE 138 N 0.25 3.44 -0.16 2.22 1.01 0.08 -0.30 121.20 127.75 3n74 s ILE 138 Ca -0.02 -0.48 -0.00 0.00 0.00 0.00 0.00 60.65 60.14 3n74 s ILE 138 Cb -0.04 -2.55 -0.01 0.00 0.01 0.00 0.00 42.46 39.88 3n74 s ILE 138 CO -0.01 0.44 -0.13 -0.22 0.00 0.00 0.00 174.94 175.02 3n74 s LEU 139 N 1.22 2.59 -0.14 2.97 2.96 0.87 -1.37 118.68 127.78 3n74 s LEU 139 Ca 0.03 -0.43 -0.04 0.00 -0.22 0.00 0.00 54.13 53.47 3n74 s LEU 139 Cb -0.14 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 44.92 3n74 s LEU 139 CO -0.01 0.09 -0.02 0.20 -1.32 0.00 0.00 176.35 175.28 3n74 s ASN 140 N 0.81 4.93 -0.37 3.68 0.01 -0.15 -0.48 114.94 123.37 3n74 s ASN 140 Ca -0.05 -0.07 -0.18 0.00 -0.71 0.00 0.00 52.86 51.86 3n74 s ASN 140 Cb -0.15 -1.72 0.00 0.00 0.41 0.00 0.00 41.25 39.79 3n74 s ASN 140 CO 0.00 0.21 0.48 -0.69 -1.51 0.00 0.00 177.10 175.60 3n74 s VAL 141 N 0.13 5.04 0.00 1.60 1.01 0.50 -1.56 120.40 127.12 3n74 s VAL 141 Ca -0.00 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.09 3n74 s VAL 141 Cb -0.13 -3.98 0.00 0.00 0.00 0.00 0.00 36.38 32.26 3n74 s VAL 141 CO 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 175.10 174.84 3n74 n ALA 142 N 5.71 0.00 -3.60 5.51 0.00 0.15 -4.83 120.51 123.45 3n74 n ALA 142 Ca -0.06 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.32 3n74 n ALA 142 Cb 0.49 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.90 3n74 n ALA 142 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 3n74 s SER 143 N -0.51 -0.20 0.60 0.00 0.15 -1.26 -4.48 113.70 108.01 3n74 s SER 143 Ca 0.00 0.15 0.36 0.00 0.70 0.00 0.00 55.95 57.15 3n74 s SER 143 Cb 0.00 0.18 1.88 0.00 -1.71 0.00 0.00 66.02 66.37 3n74 s SER 143 CO 0.00 -0.23 2.21 0.71 1.20 0.00 0.00 173.24 177.13 3n74 h THR 144 N 2.21 0.25 0.00 6.45 1.35 -1.01 -2.40 112.91 119.75 3n74 h THR 144 Ca -0.13 -0.24 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 3n74 h THR 144 Cb 1.18 1.19 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 3n74 h THR 144 CO 0.26 0.03 0.00 1.23 -0.25 0.00 0.00 175.52 176.79 3n74 h GLY 145 N 0.59 0.00 0.89 5.82 0.00 -1.83 0.11 103.07 108.65 3n74 h GLY 145 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 3n74 h GLY 145 CO 0.00 0.00 0.04 0.00 0.00 0.00 0.00 176.54 176.59 3n74 h ALA 146 N 2.25 0.42 0.00 3.60 0.00 -1.61 -3.05 119.26 120.86 3n74 h ALA 146 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 3n74 h ALA 146 Cb 0.38 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3n74 h ALA 146 CO 0.00 0.12 -1.58 0.41 0.00 0.00 0.00 179.25 178.20 3n74 n GLY 147 N -0.45 -0.76 2.27 0.00 0.00 -1.20 -4.55 105.19 100.50 3n74 n GLY 147 Ca -0.02 -0.43 -0.25 0.00 0.00 0.00 0.00 46.02 45.32 3n74 n GLY 147 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n74 n ARG 148 N -1.96 1.37 -2.51 1.61 5.12 0.38 -5.11 116.66 115.55 3n74 n ARG 148 Ca -0.02 -3.74 -0.33 0.00 -1.93 0.00 0.00 57.85 51.82 3n74 n ARG 148 Cb 0.42 -1.59 -0.04 0.00 -1.16 0.00 0.00 32.46 30.09 3n74 n ARG 148 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 3n74 s PRO 149 N -1.66 3.84 0.24 5.56 0.04 -1.15 -4.18 135.00 137.69 3n74 s PRO 149 Ca 0.37 1.23 0.08 0.00 0.04 0.00 0.00 61.00 62.71 3n74 s PRO 149 Cb 0.17 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 3n74 s PRO 149 CO -0.07 -0.38 0.11 1.03 0.04 0.00 0.00 177.00 177.73 3n74 s ARG 150 N -3.46 2.69 0.70 4.56 0.52 -1.26 -5.07 118.95 117.64 3n74 s ARG 150 Ca 0.64 -1.14 -0.16 0.00 -0.52 0.00 0.00 55.73 54.55 3n74 s ARG 150 Cb -0.14 -2.44 0.01 0.00 0.52 0.00 0.00 34.95 32.90 3n74 s ARG 150 CO 0.22 0.41 1.11 -2.30 0.02 0.00 0.00 175.30 174.76 3n74 n PRO 151 N -0.88 0.68 -0.18 3.54 -0.02 -1.26 -4.05 135.00 132.83 3n74 n PRO 151 Ca -0.08 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 3n74 n PRO 151 Cb 0.57 -2.35 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 3n74 n PRO 151 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3n74 n ASN 152 N -1.93 0.00 -1.75 2.55 5.03 -1.26 -4.92 115.26 112.99 3n74 n ASN 152 Ca 0.14 0.00 -0.04 0.00 0.87 0.00 0.00 54.58 55.55 3n74 n ASN 152 Cb 0.49 0.00 0.08 0.00 -1.02 0.00 0.00 39.78 39.32 3n74 n ASN 152 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3n74 n LEU 153 N 0.00 2.67 -0.10 3.41 4.77 -1.26 -1.86 117.00 124.63 3n74 n LEU 153 Ca 0.00 -3.50 -0.06 0.00 -0.03 0.00 0.00 56.01 52.42 3n74 n LEU 153 Cb 0.00 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3n74 n LEU 153 CO 0.00 1.31 0.74 0.00 -1.33 0.00 0.00 177.39 178.11 3n74 h ALA 154 N 1.72 0.10 0.02 -1.18 0.00 -1.87 0.05 119.26 118.10 3n74 h ALA 154 Ca 0.02 0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.85 3n74 h ALA 154 Cb 1.42 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 19.60 3n74 h ALA 154 CO 0.28 -0.55 -0.95 -1.49 0.00 0.00 0.00 179.25 176.54 3n74 h TRP 155 N -0.11 0.15 0.09 0.00 4.06 -1.94 -0.79 115.95 117.42 3n74 h TRP 155 Ca 0.18 -0.10 -0.00 0.00 2.06 0.00 0.00 58.89 61.03 3n74 h TRP 155 Cb 0.38 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.53 3n74 h TRP 155 CO -0.39 0.99 -0.05 -0.92 -3.56 0.00 0.00 178.44 174.51 3n74 h TYR 156 N 0.04 -0.12 -0.70 0.49 3.20 -1.85 -2.72 116.97 115.31 3n74 h TYR 156 Ca -0.04 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.87 3n74 h TYR 156 Cb 1.64 0.04 -0.05 0.00 1.54 0.00 0.00 36.73 39.91 3n74 h TYR 156 CO 0.02 0.09 0.44 -0.91 -1.64 0.00 0.00 178.16 176.15 3n74 h ASN 157 N -0.31 0.71 -0.84 -2.11 2.35 -0.88 -2.03 115.58 112.48 3n74 h ASN 157 Ca -0.01 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 3n74 h ASN 157 Cb 0.26 -0.15 -0.04 0.00 0.05 0.00 0.00 38.32 38.44 3n74 h ASN 157 CO 0.02 0.48 0.46 0.00 -1.65 0.00 0.00 177.43 176.75 3n74 h ALA 158 N 1.31 1.23 -0.21 -0.83 0.00 -1.16 -0.11 119.26 119.50 3n74 h ALA 158 Ca 0.29 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3n74 h ALA 158 Cb 0.05 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3n74 h ALA 158 CO -0.12 0.63 0.11 1.79 0.00 0.00 0.00 179.25 181.65 3n74 h THR 159 N 1.18 1.07 0.00 0.00 1.35 -1.04 -1.91 112.91 113.55 3n74 h THR 159 Ca 0.30 -0.19 -0.15 0.00 -0.55 0.00 0.00 66.41 65.82 3n74 h THR 159 Cb 0.02 0.80 -0.02 0.00 -1.73 0.00 0.00 68.15 67.22 3n74 h THR 159 CO -0.05 0.08 -0.71 0.11 -0.25 0.00 0.00 175.52 174.70 3n74 h LYS 160 N 0.28 0.00 -0.96 4.72 1.79 -0.67 -1.96 116.57 119.77 3n74 h LYS 160 Ca 0.07 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.58 3n74 h LYS 160 Cb 0.02 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 30.61 3n74 h LYS 160 CO -0.01 0.71 0.63 0.78 -1.08 0.00 0.00 179.45 180.48 3n74 h GLY 161 N 2.27 1.40 0.89 3.86 0.00 -0.40 -1.99 103.07 109.09 3n74 h GLY 161 Ca -0.01 -0.48 -0.02 0.00 0.00 0.00 0.00 47.33 46.82 3n74 h GLY 161 CO 0.09 0.42 0.09 -0.25 0.00 0.00 0.00 176.54 176.89 3n74 h TRP 162 N 1.23 0.40 -0.24 5.60 7.01 -1.10 -0.52 115.95 128.33 3n74 h TRP 162 Ca 0.38 -0.04 0.05 0.00 2.11 0.00 0.00 58.89 61.39 3n74 h TRP 162 Cb -0.01 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 26.89 3n74 h TRP 162 CO -0.00 0.43 -0.05 0.28 -2.79 0.00 0.00 178.44 176.31 3n74 h VAL 163 N 0.25 0.78 -0.67 2.65 2.07 -1.19 0.17 116.25 120.30 3n74 h VAL 163 Ca 0.08 -0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.60 3n74 h VAL 163 Cb 0.21 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 3n74 h VAL 163 CO -0.00 0.00 0.45 0.58 0.02 0.00 0.00 177.57 178.61 3n74 h VAL 164 N 0.01 1.17 -0.39 2.57 2.07 -1.17 -1.48 116.25 119.04 3n74 h VAL 164 Ca 0.11 -0.32 -0.08 0.00 0.82 0.00 0.00 66.70 67.24 3n74 h VAL 164 Cb 0.17 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 3n74 h VAL 164 CO -0.23 0.17 -0.07 -1.28 0.02 0.00 0.00 177.57 176.17 3n74 h SER 165 N 0.91 0.73 0.11 0.57 0.87 -0.60 -2.81 113.55 113.33 3n74 h SER 165 Ca 0.25 -0.35 -0.05 0.00 -1.23 0.00 0.00 61.79 60.40 3n74 h SER 165 Cb -0.10 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.65 3n74 h SER 165 CO -0.05 0.91 -0.19 1.62 -0.53 0.00 0.00 176.83 178.59 3n74 h VAL 166 N 0.54 1.19 -0.49 2.23 3.04 -0.44 -1.20 116.25 121.13 3n74 h VAL 166 Ca 0.10 -0.86 -0.00 0.00 -1.01 0.00 0.00 66.70 64.93 3n74 h VAL 166 Cb 0.58 1.33 -0.02 0.00 -2.01 0.00 0.00 31.29 31.16 3n74 h VAL 166 CO 0.03 0.26 0.30 0.74 -1.01 0.00 0.00 177.57 177.90 3n74 h THR 167 N 0.15 1.14 -0.11 3.17 2.02 -1.05 0.15 112.91 118.37 3n74 h THR 167 Ca 0.03 -0.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.89 3n74 h THR 167 Cb 0.43 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 67.31 3n74 h THR 167 CO 0.03 0.14 0.03 0.11 0.37 0.00 0.00 175.52 176.20 3n74 h LYS 168 N 0.65 0.18 -0.48 6.66 1.57 -1.17 -0.99 116.57 122.99 3n74 h LYS 168 Ca 0.18 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 3n74 h LYS 168 Cb -0.03 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.24 3n74 h LYS 168 CO -0.03 0.35 0.25 0.00 -0.57 0.00 0.00 179.45 179.44 3n74 h ALA 169 N 0.82 0.62 -0.11 3.86 0.00 -1.00 -2.70 119.26 120.74 3n74 h ALA 169 Ca 0.03 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.67 3n74 h ALA 169 Cb 0.25 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 3n74 h ALA 169 CO 0.00 0.17 -0.62 -0.07 0.00 0.00 0.00 179.25 178.72 3n74 h LEU 170 N 0.64 0.47 -0.42 0.00 3.38 -0.73 -2.92 115.31 115.73 3n74 h LEU 170 Ca 0.17 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.89 3n74 h LEU 170 Cb 0.09 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 3n74 h LEU 170 CO -0.02 0.97 0.22 0.00 0.09 0.00 0.00 178.44 179.70 3n74 h ALA 171 N 1.03 0.53 -0.21 1.53 0.00 -0.98 0.19 119.26 121.34 3n74 h ALA 171 Ca -0.01 0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 3n74 h ALA 171 Cb 1.16 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 3n74 h ALA 171 CO 0.11 -0.13 -0.53 0.97 0.00 0.00 0.00 179.25 179.66 3n74 h ILE 172 N 0.44 1.31 -0.08 0.00 2.10 -1.49 -1.82 117.51 117.97 3n74 h ILE 172 Ca 0.18 -1.76 -0.22 0.00 1.08 0.00 0.00 64.86 64.14 3n74 h ILE 172 Cb 0.07 1.72 0.00 0.00 -1.09 0.00 0.00 36.82 37.52 3n74 h ILE 172 CO -0.12 0.55 -0.82 -0.08 -1.08 0.00 0.00 178.15 176.60 3n74 h GLU 173 N 0.48 0.58 0.00 2.19 4.81 -1.28 -3.33 114.58 118.03 3n74 h GLU 173 Ca 0.01 -0.52 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 3n74 h GLU 173 Cb 1.08 0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.58 3n74 h GLU 173 CO 0.10 1.14 -1.10 1.28 -0.73 0.00 0.00 179.01 179.70 3n74 n LEU 174 N -3.86 0.59 -0.21 1.64 4.77 0.62 -4.39 117.00 116.16 3n74 n LEU 174 Ca -0.07 0.02 0.01 0.00 -0.03 0.00 0.00 56.01 55.94 3n74 n LEU 174 Cb 0.77 -0.08 0.10 0.00 -2.33 0.00 0.00 43.42 41.87 3n74 n LEU 174 CO 0.51 0.01 0.80 0.00 -1.33 0.00 0.00 177.39 177.38 3n74 h ALA 175 N 2.43 0.56 0.00 -1.18 0.00 -1.38 0.09 119.26 119.79 3n74 h ALA 175 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3n74 h ALA 175 Cb 0.78 0.39 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3n74 h ALA 175 CO 0.00 -0.41 0.00 -0.35 0.00 0.00 0.00 179.25 178.49 3n74 n PRO 176 N -5.34 0.19 -0.05 0.00 -0.04 -1.26 -0.90 135.00 127.61 3n74 n PRO 176 Ca 0.09 0.47 0.10 0.00 -0.04 0.00 0.00 63.50 64.13 3n74 n PRO 176 Cb 0.36 -1.91 0.46 0.00 -0.04 0.00 0.00 33.50 32.37 3n74 n PRO 176 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3n74 n ALA 177 N -1.79 2.56 -2.73 0.55 0.00 0.01 -4.92 120.51 114.19 3n74 n ALA 177 Ca 0.01 -0.36 -0.10 0.00 0.00 0.00 0.00 53.44 52.99 3n74 n ALA 177 Cb 0.19 -1.18 0.02 0.00 0.00 0.00 0.00 19.45 18.49 3n74 n ALA 177 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3n74 n LYS 178 N -0.12 -2.65 -4.09 0.00 4.76 -0.07 -4.42 118.16 111.57 3n74 n LYS 178 Ca 0.16 0.39 -0.32 0.00 -2.87 0.00 0.00 58.31 55.66 3n74 n LYS 178 Cb 0.23 -4.12 -0.16 0.00 -1.84 0.00 0.00 35.03 29.14 3n74 n LYS 178 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3n74 s ILE 179 N -2.93 2.05 0.30 -0.18 1.01 -1.16 -2.05 121.20 118.24 3n74 s ILE 179 Ca 0.18 -1.19 -0.12 0.00 0.00 0.00 0.00 60.65 59.51 3n74 s ILE 179 Cb -0.08 -1.99 -0.08 0.00 0.01 0.00 0.00 42.46 40.32 3n74 s ILE 179 CO 0.22 0.30 0.67 -0.13 0.00 0.00 0.00 174.94 176.00 3n74 s ARG 180 N 1.23 3.90 -0.08 2.79 0.52 -0.53 -3.59 118.95 123.20 3n74 s ARG 180 Ca -0.01 0.50 -0.01 0.00 -0.52 0.00 0.00 55.73 55.69 3n74 s ARG 180 Cb -0.16 -2.50 0.03 0.00 0.52 0.00 0.00 34.95 32.84 3n74 s ARG 180 CO -0.10 0.19 -0.01 0.08 0.02 0.00 0.00 175.30 175.48 3n74 s VAL 181 N -1.98 0.47 0.17 3.52 1.01 -1.26 -0.74 120.40 121.59 3n74 s VAL 181 Ca 0.51 0.05 0.01 0.00 0.00 0.00 0.00 61.98 62.55 3n74 s VAL 181 Cb -0.11 -0.62 -0.05 0.00 0.00 0.00 0.00 36.38 35.61 3n74 s VAL 181 CO 0.20 0.26 0.02 0.68 0.00 0.00 0.00 175.10 176.26 3n74 s VAL 182 N 1.93 0.57 0.08 2.92 -7.23 -0.47 -0.63 120.40 117.57 3n74 s VAL 182 Ca 0.05 -1.97 0.04 0.00 -1.81 0.00 0.00 61.98 58.29 3n74 s VAL 182 Cb -0.12 -2.13 -0.03 0.00 0.56 0.00 0.00 36.38 34.66 3n74 s VAL 182 CO -0.06 -0.45 -0.10 0.00 -0.31 0.00 0.00 175.10 174.18 3n74 s ALA 183 N -3.73 0.97 -0.00 1.32 0.00 0.11 -0.98 121.76 119.45 3n74 s ALA 183 Ca 0.24 -1.03 0.07 0.00 0.00 0.00 0.00 51.96 51.24 3n74 s ALA 183 Cb 0.06 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.17 3n74 s ALA 183 CO 0.04 0.01 -0.21 -0.51 0.00 0.00 0.00 175.76 175.09 3n74 s LEU 184 N -2.06 2.37 -0.50 0.00 1.43 -0.60 -1.01 118.68 118.31 3n74 s LEU 184 Ca -0.00 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.71 3n74 s LEU 184 Cb -0.06 -1.43 0.13 0.00 0.03 0.00 0.00 46.19 44.86 3n74 s LEU 184 CO 0.00 0.30 0.25 0.20 0.23 0.00 0.00 176.35 177.34 3n74 s ASN 185 N -0.93 4.62 0.78 2.29 0.01 0.66 -0.67 114.94 121.70 3n74 s ASN 185 Ca 0.12 -2.77 -0.11 0.00 -0.71 0.00 0.00 52.86 49.39 3n74 s ASN 185 Cb -0.10 -1.69 0.06 0.00 0.41 0.00 0.00 41.25 39.93 3n74 s ASN 185 CO 0.01 -0.30 1.09 -2.16 -1.51 0.00 0.00 177.10 174.23 3n74 s PRO 186 N 0.06 2.24 0.00 -0.60 0.04 -1.26 -0.88 135.00 134.59 3n74 s PRO 186 Ca 0.15 0.68 0.00 0.00 0.04 0.00 0.00 61.00 61.88 3n74 s PRO 186 Cb -0.23 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.37 3n74 s PRO 186 CO -0.02 -1.52 0.00 1.55 0.04 0.00 0.00 177.00 177.04 3n74 n VAL 187 N -3.37 0.00 -1.59 -0.36 3.14 -1.26 -0.52 118.33 114.36 3n74 n VAL 187 Ca 0.07 0.01 0.00 0.00 -2.96 0.00 0.00 64.34 61.46 3n74 n VAL 187 Cb 0.56 -0.23 0.00 0.00 -1.06 0.00 0.00 33.84 33.11 3n74 n VAL 187 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 3n74 n THR 196 N 0.00 -1.82 0.00 1.55 5.66 -1.26 -4.88 114.28 113.53 3n74 n THR 196 Ca 0.00 0.55 0.00 0.00 -3.05 0.00 0.00 64.05 61.55 3n74 n THR 196 Cb 0.00 -1.06 0.00 0.00 -1.55 0.00 0.00 70.33 67.72 3n74 n THR 196 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 3n74 n PHE 197 N 1.14 0.00 -0.77 1.09 3.01 -1.26 -4.81 117.46 115.86 3n74 n PHE 197 Ca 0.00 0.00 0.07 0.00 1.01 0.00 0.00 57.45 58.53 3n74 n PHE 197 Cb 0.00 0.00 0.15 0.00 -0.01 0.00 0.00 39.48 39.62 3n74 n PHE 197 CO 0.00 0.00 0.00 -1.33 1.01 0.00 0.00 176.76 176.44 3n74 n MET 198 N -0.96 2.18 -1.04 -1.08 2.81 -1.26 -4.88 117.12 112.89 3n74 n MET 198 Ca 0.00 -2.40 -0.01 0.00 -1.81 0.00 0.00 57.70 53.47 3n74 n MET 198 Cb 0.00 -1.48 -0.01 0.00 -0.71 0.00 0.00 33.22 31.03 3n74 n MET 198 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3n74 n GLY 199 N -0.83 0.50 3.76 3.03 0.00 -1.26 -0.85 105.19 109.54 3n74 n GLY 199 Ca 0.14 -0.29 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 3n74 n GLY 199 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3n74 s GLU 200 N -1.07 3.21 0.00 1.61 1.03 -1.26 -4.19 118.70 118.02 3n74 s GLU 200 Ca 0.00 1.79 0.00 0.00 0.03 0.00 0.00 54.97 56.79 3n74 s GLU 200 Cb 0.00 -2.05 0.00 0.00 -0.80 0.00 0.00 34.13 31.28 3n74 s GLU 200 CO 0.00 -1.01 0.00 -0.40 -1.33 0.00 0.00 175.26 172.52 3n74 n ASP 201 N -1.30 0.00 0.30 0.83 5.68 -1.26 -4.99 116.55 115.81 3n74 n ASP 201 Ca 0.12 -0.81 0.18 0.00 -0.50 0.00 0.00 54.79 53.77 3n74 n ASP 201 Cb 0.49 0.00 0.96 0.00 -1.14 0.00 0.00 41.12 41.44 3n74 n ASP 201 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 3n74 h SER 202 N 0.00 0.00 0.00 -1.12 0.02 -2.07 -3.51 113.55 106.87 3n74 h SER 202 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3n74 h SER 202 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3n74 h SER 202 CO 0.00 0.03 0.00 -0.24 -1.14 0.00 0.00 176.83 175.48 3n74 n SER 212 N -3.45 0.00 -4.69 3.07 2.88 -1.26 -5.26 113.62 104.91 3n74 n SER 212 Ca -0.02 0.00 -0.41 0.00 -1.33 0.00 0.00 58.87 57.11 3n74 n SER 212 Cb 0.14 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.56 3n74 n SER 212 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 3n74 s ILE 213 N -0.21 4.92 0.24 2.46 -1.09 -1.26 -4.96 121.20 121.31 3n74 s ILE 213 Ca 0.00 1.69 -0.05 0.00 -2.23 0.00 0.00 60.65 60.06 3n74 s ILE 213 Cb 0.00 -4.16 0.20 0.00 -1.58 0.00 0.00 42.46 36.93 3n74 s ILE 213 CO 0.00 0.12 1.77 -0.65 -1.23 0.00 0.00 174.94 174.95 3n74 h PRO 214 N 7.03 0.58 0.00 2.79 0.11 -1.85 0.81 132.00 141.47 3n74 h PRO 214 Ca -0.35 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.72 3n74 h PRO 214 Cb 1.17 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.15 3n74 h PRO 214 CO 0.80 0.38 0.00 0.52 -0.21 0.00 0.00 178.00 179.49 3n74 h MET 215 N 0.60 0.00 0.00 1.05 2.86 -1.57 -3.47 114.93 114.39 3n74 h MET 215 Ca 0.39 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.03 3n74 h MET 215 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.13 3n74 h MET 215 CO -0.31 0.00 0.00 0.41 1.06 0.00 0.00 176.91 178.07 3n74 n GLY 216 N -0.41 0.75 3.62 8.32 0.00 0.28 -5.06 105.19 112.68 3n74 n GLY 216 Ca -0.00 -0.22 -0.09 0.00 0.00 0.00 0.00 46.02 45.70 3n74 n GLY 216 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3n74 s ARG 217 N -0.71 1.66 0.35 1.61 1.70 -1.26 -5.02 118.95 117.28 3n74 s ARG 217 Ca 0.00 -1.29 -0.05 0.00 -0.47 0.00 0.00 55.73 53.92 3n74 s ARG 217 Cb 0.00 0.49 -0.05 0.00 -0.57 0.00 0.00 34.95 34.82 3n74 s ARG 217 CO 0.00 -0.70 0.62 -0.51 -1.08 0.00 0.00 175.30 173.63 3n74 s LEU 218 N -3.04 3.95 0.16 -1.89 1.43 -1.26 -4.84 118.68 113.19 3n74 s LEU 218 Ca 0.22 0.77 -0.30 0.00 -1.03 0.00 0.00 54.13 53.78 3n74 s LEU 218 Cb -0.01 -3.63 -0.08 0.00 0.03 0.00 0.00 46.19 42.50 3n74 s LEU 218 CO 0.10 -0.30 1.33 -0.22 0.23 0.00 0.00 176.35 177.49 3n74 s LEU 219 N -3.91 4.40 0.15 1.79 2.96 -1.26 -5.05 118.68 117.75 3n74 s LEU 219 Ca 0.45 2.35 0.06 0.00 -0.22 0.00 0.00 54.13 56.77 3n74 s LEU 219 Cb -0.10 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.95 3n74 s LEU 219 CO 0.33 -0.57 0.02 -0.54 -1.32 0.00 0.00 176.35 174.28 3n74 s LYS 220 N 0.39 2.54 0.44 1.98 1.02 -1.26 -5.02 119.74 119.82 3n74 s LYS 220 Ca 0.60 -0.98 0.18 0.00 0.02 0.00 0.00 55.97 55.78 3n74 s LYS 220 Cb -0.36 -2.46 1.11 0.00 -0.52 0.00 0.00 37.83 35.60 3n74 s LYS 220 CO 0.35 0.49 1.92 -1.35 -0.92 0.00 0.00 175.35 175.83 3n74 h PRO 221 N 2.86 0.34 0.00 -1.68 0.11 -1.91 -1.52 132.00 130.20 3n74 h PRO 221 Ca -0.47 -0.02 -0.09 0.00 0.11 0.00 0.00 66.00 65.53 3n74 h PRO 221 Cb 1.19 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 3n74 h PRO 221 CO 0.59 0.23 -0.42 0.38 -0.21 0.00 0.00 178.00 178.57 3n74 h ASP 222 N 0.35 0.00 -0.06 -2.05 2.03 -1.95 0.79 116.42 115.53 3n74 h ASP 222 Ca 0.37 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.67 3n74 h ASP 222 Cb 0.94 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.44 3n74 h ASP 222 CO -0.11 0.42 0.03 0.44 -1.03 0.00 0.00 179.24 178.99 3n74 h ASP 223 N 0.00 0.08 -0.32 4.15 3.32 -1.69 -1.97 116.42 119.99 3n74 h ASP 223 Ca -0.00 -0.13 -0.03 0.00 0.02 0.00 0.00 57.03 56.88 3n74 h ASP 223 Cb 0.91 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.43 3n74 h ASP 223 CO 0.05 0.19 0.07 0.25 -1.72 0.00 0.00 179.24 178.09 3n74 h LEU 224 N -0.03 0.50 -1.10 1.55 5.85 -1.40 -2.98 115.31 117.69 3n74 h LEU 224 Ca 0.02 -0.24 0.09 0.00 0.84 0.00 0.00 57.88 58.60 3n74 h LEU 224 Cb 0.13 -0.13 -0.07 0.00 0.37 0.00 0.00 40.66 40.96 3n74 h LEU 224 CO -0.00 0.61 0.61 0.00 -0.34 0.00 0.00 178.44 179.32 3n74 h ALA 225 N 0.91 1.54 -0.56 1.25 0.00 -0.75 -1.49 119.26 120.15 3n74 h ALA 225 Ca 0.10 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3n74 h ALA 225 Cb 0.31 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 3n74 h ALA 225 CO 0.00 0.27 0.32 0.93 0.00 0.00 0.00 179.25 180.77 3n74 h GLU 226 N 1.00 0.78 -0.51 0.00 4.39 -1.24 0.21 114.58 119.22 3n74 h GLU 226 Ca 0.44 -0.09 -0.03 0.00 0.34 0.00 0.00 59.36 60.03 3n74 h GLU 226 Cb 0.37 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 3n74 h GLU 226 CO -0.20 0.59 0.20 0.00 -1.16 0.00 0.00 179.01 178.44 3n74 h ALA 227 N 1.15 0.66 -0.36 3.43 0.00 -1.28 -1.29 119.26 121.56 3n74 h ALA 227 Ca 0.20 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3n74 h ALA 227 Cb 0.03 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3n74 h ALA 227 CO -0.03 0.27 0.18 0.00 0.00 0.00 0.00 179.25 179.67 3n74 h ALA 228 N 1.04 0.47 -0.67 0.00 0.00 -1.01 0.57 119.26 119.66 3n74 h ALA 228 Ca 0.17 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.01 3n74 h ALA 228 Cb 0.21 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 3n74 h ALA 228 CO -0.01 0.02 0.41 0.00 0.00 0.00 0.00 179.25 179.67 3n74 h ALA 229 N 1.04 0.87 0.27 0.00 0.00 -0.47 -0.25 119.26 120.73 3n74 h ALA 229 Ca 0.13 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3n74 h ALA 229 Cb 0.10 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.68 3n74 h ALA 229 CO -0.02 0.18 -0.13 0.35 0.00 0.00 0.00 179.25 179.63 3n74 h PHE 230 N 0.81 -0.34 -0.11 0.00 3.57 -1.01 -2.86 116.94 117.00 3n74 h PHE 230 Ca 0.27 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.76 3n74 h PHE 230 Cb 0.02 0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 3n74 h PHE 230 CO -0.05 -0.15 0.07 -0.07 -2.23 0.00 0.00 178.31 175.88 3n74 h LEU 231 N -0.45 0.13 -0.91 0.59 3.38 -0.61 -2.01 115.31 115.43 3n74 h LEU 231 Ca -0.04 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3n74 h LEU 231 Cb 0.34 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3n74 h LEU 231 CO 0.06 0.09 0.00 0.00 0.09 0.00 0.00 178.44 178.69 3n74 s SER 233 N -1.75 5.77 0.54 0.00 1.04 -0.76 -4.95 113.70 113.60 3n74 s SER 233 Ca 0.35 -0.31 0.36 0.00 0.48 0.00 0.00 55.95 56.83 3n74 s SER 233 Cb 0.19 -0.90 1.74 0.00 0.10 0.00 0.00 66.02 67.15 3n74 s SER 233 CO 0.29 -0.64 2.07 -0.65 0.98 0.00 0.00 173.24 175.29 3n74 h PRO 234 N 0.72 0.00 0.00 4.02 0.11 -1.86 -1.88 132.00 133.11 3n74 h PRO 234 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 3n74 h PRO 234 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3n74 h PRO 234 CO 0.48 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.31 3n74 n GLN 235 N -2.88 0.02 -0.30 1.05 3.00 -1.26 -2.19 117.38 114.81 3n74 n GLN 235 Ca -0.01 0.34 0.08 0.00 -0.01 0.00 0.00 57.00 57.40 3n74 n GLN 235 Cb 0.16 -1.54 0.18 0.00 0.00 0.00 0.00 30.24 29.05 3n74 n GLN 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3n74 n ALA 236 N -1.53 2.83 0.25 -1.58 0.00 -0.71 -4.85 120.51 114.93 3n74 n ALA 236 Ca 0.02 -2.75 0.15 0.00 0.00 0.00 0.00 53.44 50.86 3n74 n ALA 236 Cb 0.12 -0.46 0.77 0.00 0.00 0.00 0.00 19.45 19.88 3n74 n ALA 236 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3n74 h SER 237 N 0.59 0.00 -0.48 0.00 4.64 -1.55 -0.30 113.55 116.45 3n74 h SER 237 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 3n74 h SER 237 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 3n74 h SER 237 CO 0.07 0.00 0.00 0.23 -0.87 0.00 0.00 176.83 176.26 3n74 n MET 238 N -2.55 3.06 -3.68 4.77 2.81 -1.26 -4.92 117.12 115.35 3n74 n MET 238 Ca -0.01 -2.48 -0.39 0.00 -1.81 0.00 0.00 57.70 53.01 3n74 n MET 238 Cb 0.08 -1.55 -0.12 0.00 -0.71 0.00 0.00 33.22 30.92 3n74 n MET 238 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3n74 s ILE 239 N -1.45 4.26 -0.09 2.02 1.01 -0.12 -5.07 121.20 121.75 3n74 s ILE 239 Ca 0.37 -0.79 -0.17 0.00 0.00 0.00 0.00 60.65 60.06 3n74 s ILE 239 Cb 0.23 -3.30 0.04 0.00 0.01 0.00 0.00 42.46 39.44 3n74 s ILE 239 CO 0.20 -0.09 0.42 0.28 0.00 0.00 0.00 174.94 175.76 3n74 s THR 240 N 1.52 0.02 0.00 2.92 -1.32 -1.26 -4.78 115.64 112.74 3n74 s THR 240 Ca 0.02 -0.18 0.00 0.00 -1.21 0.00 0.00 61.69 60.32 3n74 s THR 240 Cb -0.18 -0.66 0.00 0.00 -1.51 0.00 0.00 72.50 70.14 3n74 s THR 240 CO 0.05 -0.10 0.00 0.61 -2.21 0.00 0.00 174.62 172.97 3n74 n GLY 241 N 2.02 0.72 3.92 6.08 0.00 0.19 -4.98 105.19 113.14 3n74 n GLY 241 Ca -0.17 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.58 3n74 n GLY 241 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3n74 s VAL 242 N -2.81 5.01 -0.31 1.61 -7.23 -1.26 -4.54 120.40 110.86 3n74 s VAL 242 Ca 0.00 -0.04 0.02 0.00 -1.81 0.00 0.00 61.98 60.14 3n74 s VAL 242 Cb 0.00 -3.80 0.09 0.00 0.56 0.00 0.00 36.38 33.23 3n74 s VAL 242 CO 0.00 -0.53 0.05 0.00 -0.31 0.00 0.00 175.10 174.31 3n74 s ALA 243 N -2.33 2.25 -0.23 1.32 0.00 -1.26 -0.71 121.76 120.80 3n74 s ALA 243 Ca 0.44 -2.01 -0.17 0.00 0.00 0.00 0.00 51.96 50.21 3n74 s ALA 243 Cb -0.10 -1.75 -0.03 0.00 0.00 0.00 0.00 23.12 21.24 3n74 s ALA 243 CO 0.35 -1.59 0.48 -1.17 0.00 0.00 0.00 175.76 173.83 3n74 s LEU 244 N 1.24 4.10 0.03 0.00 2.96 -0.18 -4.86 118.68 121.98 3n74 s LEU 244 Ca 0.07 0.55 -0.29 0.00 -0.22 0.00 0.00 54.13 54.24 3n74 s LEU 244 Cb -0.18 -2.62 -0.04 0.00 0.50 0.00 0.00 46.19 43.84 3n74 s LEU 244 CO -0.14 -0.20 0.93 -1.81 -1.32 0.00 0.00 176.35 173.81 3n74 s ASP 245 N 1.32 7.36 -0.51 3.68 1.01 -1.26 -0.25 116.67 128.03 3n74 s ASP 245 Ca 0.21 1.64 0.03 0.00 0.71 0.00 0.00 52.55 55.14 3n74 s ASP 245 Cb -0.15 -2.55 0.15 0.00 1.01 0.00 0.00 42.92 41.38 3n74 s ASP 245 CO 0.09 -0.16 0.33 -0.69 0.21 0.00 0.00 175.17 174.95 3n74 s VAL 246 N 0.56 1.57 0.00 -1.27 1.01 -0.06 -4.90 120.40 117.31 3n74 s VAL 246 Ca 0.48 -3.05 0.00 0.00 0.00 0.00 0.00 61.98 59.40 3n74 s VAL 246 Cb -0.21 -2.07 0.00 0.00 0.00 0.00 0.00 36.38 34.10 3n74 s VAL 246 CO 0.27 -1.00 0.37 -0.90 0.00 0.00 0.00 175.10 173.83 3n74 n ASP 247 N 2.95 0.00 -1.73 3.32 3.85 -1.26 -4.04 116.55 119.63 3n74 n ASP 247 Ca 0.17 -1.03 -0.20 0.00 -0.71 0.00 0.00 54.79 53.01 3n74 n ASP 247 Cb 0.38 -0.01 -0.07 0.00 -1.35 0.00 0.00 41.12 40.07 3n74 n ASP 247 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3n74 n GLY 248 N 0.00 1.41 1.04 6.12 0.00 -1.26 -1.65 105.19 110.84 3n74 n GLY 248 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.99 3n74 n GLY 248 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n74 n GLY 249 N -0.59 0.73 0.31 -0.02 0.00 -1.26 -1.37 105.19 102.99 3n74 n GLY 249 Ca -0.21 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.91 3n74 n GLY 249 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3n74 h ARG 250 N 3.73 0.48 0.00 1.61 -0.00 -1.68 -2.86 114.38 115.65 3n74 h ARG 250 Ca 0.00 -0.03 -0.04 0.00 -0.00 0.00 0.00 59.98 59.91 3n74 h ARG 250 Cb 0.00 -0.11 -0.01 0.00 -0.00 0.00 0.00 29.97 29.86 3n74 h ARG 250 CO 0.00 0.32 -0.19 0.77 -0.00 0.00 0.00 179.97 180.87 3n74 h SER 251 N 0.49 0.00 0.00 0.08 0.02 -1.94 -3.50 113.55 108.71 3n74 h SER 251 Ca 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.46 3n74 h SER 251 Cb 0.86 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.40 3n74 h SER 251 CO -0.45 0.19 0.00 -0.38 -1.14 0.00 0.00 176.83 175.05