#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ub7 n GLY 3 N 0.00 2.73 3.56 5.00 0.00 0.42 -0.04 105.19 116.86 1ub7 n GLY 3 Ca 0.00 -1.59 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 1ub7 n GLY 3 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ub7 s ILE 4 N -2.69 5.13 0.02 -0.61 1.01 -1.26 -1.93 121.20 120.87 1ub7 s ILE 4 Ca 0.19 0.20 -0.03 0.00 0.00 0.00 0.00 60.65 61.00 1ub7 s ILE 4 Cb -0.00 -3.84 -0.28 0.00 0.01 0.00 0.00 42.46 38.36 1ub7 s ILE 4 CO 0.13 -0.08 0.92 -0.07 0.00 0.00 0.00 174.94 175.84 1ub7 h LEU 5 N 8.81 0.39 -7.80 2.97 3.38 -0.87 -3.42 115.31 118.77 1ub7 h LEU 5 Ca -0.30 -0.51 -0.09 0.00 0.09 0.00 0.00 57.88 57.07 1ub7 h LEU 5 Cb 1.14 -0.13 -0.15 0.00 0.09 0.00 0.00 40.66 41.62 1ub7 h LEU 5 CO 0.70 1.42 -0.39 0.00 0.09 0.00 0.00 178.44 180.27 1ub7 s ALA 6 N -2.63 -0.24 -0.08 1.53 0.00 -1.22 -4.94 121.76 114.19 1ub7 s ALA 6 Ca -0.08 -0.54 -0.10 0.00 0.00 0.00 0.00 51.96 51.24 1ub7 s ALA 6 Cb 0.07 0.42 0.02 0.00 0.00 0.00 0.00 23.12 23.63 1ub7 s ALA 6 CO 0.86 -0.46 0.27 -1.17 0.00 0.00 0.00 175.76 175.26 1ub7 s LEU 7 N -2.64 0.97 0.06 0.00 2.96 -1.26 -1.64 118.68 117.13 1ub7 s LEU 7 Ca 0.02 0.42 -0.23 0.00 -0.22 0.00 0.00 54.13 54.12 1ub7 s LEU 7 Cb 0.03 0.99 0.06 0.00 0.50 0.00 0.00 46.19 47.77 1ub7 s LEU 7 CO -0.09 -0.18 0.54 -0.83 -1.32 0.00 0.00 176.35 174.47 1ub7 s GLY 8 N -0.23 -0.47 0.27 7.98 0.00 -0.06 -4.34 107.32 110.46 1ub7 s GLY 8 Ca -0.04 0.63 -0.18 0.00 0.00 0.00 0.00 44.72 45.14 1ub7 s GLY 8 CO 0.01 0.33 0.63 0.00 0.00 0.00 0.00 173.10 174.07 1ub7 s ALA 9 N -2.55 -0.85 -0.11 3.20 0.00 -1.24 -0.15 121.76 120.06 1ub7 s ALA 9 Ca -0.05 -0.53 -0.30 0.00 0.00 0.00 0.00 51.96 51.09 1ub7 s ALA 9 Cb -0.01 0.93 0.09 0.00 0.00 0.00 0.00 23.12 24.14 1ub7 s ALA 9 CO -0.02 -0.97 0.80 -0.47 0.00 0.00 0.00 175.76 175.10 1ub7 s TYR 10 N -3.95 -0.57 0.00 0.00 5.04 0.06 -4.65 117.35 113.29 1ub7 s TYR 10 Ca 0.15 1.04 0.02 0.00 -2.44 0.00 0.00 57.07 55.84 1ub7 s TYR 10 Cb -0.04 0.41 -0.01 0.00 0.35 0.00 0.00 41.96 42.67 1ub7 s TYR 10 CO 0.08 -0.49 -0.07 0.14 -1.34 0.00 0.00 175.55 173.87 1ub7 s VAL 11 N -0.97 0.50 0.89 3.14 -7.23 -1.26 -0.79 120.40 114.69 1ub7 s VAL 11 Ca -0.06 -0.39 -0.12 0.00 -1.81 0.00 0.00 61.98 59.60 1ub7 s VAL 11 Cb -0.01 -0.45 0.10 0.00 0.56 0.00 0.00 36.38 36.59 1ub7 s VAL 11 CO 0.06 0.06 1.01 -2.65 -0.31 0.00 0.00 175.10 173.27 1ub7 n PRO 12 N 2.71 -0.22 -0.07 4.82 -0.02 -1.26 -4.96 135.00 135.99 1ub7 n PRO 12 Ca -0.14 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.21 1ub7 n PRO 12 Cb 0.57 -2.28 -0.06 0.00 -0.02 0.00 0.00 33.50 31.72 1ub7 n PRO 12 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1ub7 h GLU 13 N -1.50 0.45 -6.51 -0.52 4.81 -1.98 -3.43 114.58 105.91 1ub7 h GLU 13 Ca -0.44 -0.22 -0.53 0.00 -0.13 0.00 0.00 59.36 58.04 1ub7 h GLU 13 Cb 1.28 -0.00 0.04 0.00 0.63 0.00 0.00 28.75 30.70 1ub7 h GLU 13 CO 0.41 0.77 1.10 0.50 -0.73 0.00 0.00 179.01 181.07 1ub7 s ARG 14 N -4.45 4.14 -0.09 1.92 3.52 -1.26 -4.92 118.95 117.82 1ub7 s ARG 14 Ca -0.14 2.57 -0.05 0.00 -0.13 0.00 0.00 55.73 57.98 1ub7 s ARG 14 Cb 0.06 -3.59 -0.04 0.00 -1.56 0.00 0.00 34.95 29.82 1ub7 s ARG 14 CO 0.77 -0.83 0.12 0.08 -0.81 0.00 0.00 175.30 174.62 1ub7 s VAL 15 N 2.72 5.24 -0.20 7.11 1.01 -1.26 -1.34 120.40 133.68 1ub7 s VAL 15 Ca 0.80 0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.83 1ub7 s VAL 15 Cb -0.45 -3.30 0.05 0.00 0.00 0.00 0.00 36.38 32.67 1ub7 s VAL 15 CO 0.36 0.56 -0.08 -0.04 0.00 0.00 0.00 175.10 175.90 1ub7 s MET 16 N -1.17 1.82 0.52 2.72 -1.94 -0.45 -4.96 119.30 115.84 1ub7 s MET 16 Ca 0.17 -0.80 -0.04 0.00 -1.71 0.00 0.00 55.69 53.31 1ub7 s MET 16 Cb -0.12 -2.36 -0.01 0.00 2.01 0.00 0.00 34.83 34.35 1ub7 s MET 16 CO 0.06 -0.46 0.80 0.95 -0.01 0.00 0.00 175.02 176.36 1ub7 s THR 17 N 1.45 4.18 0.51 2.05 -4.23 -1.26 -2.46 115.64 115.88 1ub7 s THR 17 Ca -0.02 -0.07 0.17 0.00 -1.18 0.00 0.00 61.69 60.60 1ub7 s THR 17 Cb -0.16 -3.60 0.26 0.00 1.34 0.00 0.00 72.50 70.33 1ub7 s THR 17 CO -0.08 -0.56 2.13 0.78 -0.54 0.00 0.00 174.62 176.35 1ub7 h ASN 18 N 0.11 0.00 -0.03 3.99 2.35 -1.86 -0.88 115.58 119.27 1ub7 h ASN 18 Ca -0.46 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.22 1ub7 h ASN 18 Cb 1.24 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.59 1ub7 h ASN 18 CO 0.60 0.04 -0.16 0.00 -1.65 0.00 0.00 177.43 176.26 1ub7 h ALA 19 N 1.96 1.32 0.00 -0.83 0.00 -1.93 -0.91 119.26 118.88 1ub7 h ALA 19 Ca -0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 1ub7 h ALA 19 Cb 0.07 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 1ub7 h ALA 19 CO 0.00 0.46 -0.07 -0.44 0.00 0.00 0.00 179.25 179.20 1ub7 h ASP 20 N 0.34 0.00 0.64 0.00 3.32 -1.53 -0.61 116.42 118.58 1ub7 h ASP 20 Ca 0.06 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.84 1ub7 h ASP 20 Cb 0.49 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.01 1ub7 h ASP 20 CO 0.03 0.07 -1.44 -0.26 -1.72 0.00 0.00 179.24 175.92 1ub7 h PHE 21 N 0.00 0.12 -0.06 4.55 0.04 -1.15 -3.28 116.94 117.17 1ub7 h PHE 21 Ca -0.00 -0.09 -0.11 0.00 2.80 0.00 0.00 57.97 60.57 1ub7 h PHE 21 Cb 0.26 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 1ub7 h PHE 21 CO 0.00 1.12 -0.45 0.93 -0.60 0.00 0.00 178.31 179.30 1ub7 h GLU 22 N 0.02 0.13 0.00 1.51 5.08 -0.46 0.22 114.58 121.08 1ub7 h GLU 22 Ca -0.19 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 1ub7 h GLU 22 Cb 1.93 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.19 1ub7 h GLU 22 CO 0.12 0.57 0.00 0.00 -1.00 0.00 0.00 179.01 178.69 1ub7 n ALA 23 N -2.46 1.76 -0.88 3.43 0.00 -0.33 -3.39 120.51 118.63 1ub7 n ALA 23 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.41 1ub7 n ALA 23 Cb 0.50 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.90 1ub7 n ALA 23 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1ub7 n TYR 24 N -0.67 0.00 -4.13 0.00 0.18 -1.07 -5.09 117.16 106.38 1ub7 n TYR 24 Ca 0.02 0.00 -0.16 0.00 1.88 0.00 0.00 57.90 59.64 1ub7 n TYR 24 Cb 0.01 0.06 -0.12 0.00 -0.38 0.00 0.00 39.34 38.92 1ub7 n TYR 24 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1ub7 s LEU 25 N 0.00 2.28 -1.25 -3.48 1.43 0.76 -5.05 118.68 113.37 1ub7 s LEU 25 Ca 0.00 -0.60 -0.20 0.00 -1.03 0.00 0.00 54.13 52.30 1ub7 s LEU 25 Cb 0.00 -0.36 -0.01 0.00 0.03 0.00 0.00 46.19 45.85 1ub7 s LEU 25 CO 0.00 -0.14 1.84 -0.67 0.23 0.00 0.00 176.35 177.61 1ub7 n ASP 26 N 1.31 4.05 -3.75 2.29 2.03 -1.26 -4.58 116.55 116.64 1ub7 n ASP 26 Ca -0.22 -2.81 -0.05 0.00 0.52 0.00 0.00 54.79 52.23 1ub7 n ASP 26 Cb 0.55 -1.74 -0.02 0.00 -0.72 0.00 0.00 41.12 39.19 1ub7 n ASP 26 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1ub7 s THR 27 N 7.41 0.00 0.11 5.18 -1.32 -1.26 -4.98 115.64 120.78 1ub7 s THR 27 Ca 0.61 -0.68 0.04 0.00 -1.21 0.00 0.00 61.69 60.44 1ub7 s THR 27 Cb 0.02 -1.88 -0.04 0.00 -1.51 0.00 0.00 72.50 69.09 1ub7 s THR 27 CO 0.11 0.00 -0.10 -0.94 -2.21 0.00 0.00 174.62 171.48 1ub7 s SER 28 N -2.89 1.49 0.17 8.08 1.04 -1.26 -4.69 113.70 115.64 1ub7 s SER 28 Ca 0.11 -0.90 -0.15 0.00 0.48 0.00 0.00 55.95 55.49 1ub7 s SER 28 Cb -0.03 0.02 0.12 0.00 0.10 0.00 0.00 66.02 66.23 1ub7 s SER 28 CO 0.02 -0.31 1.73 -0.78 0.98 0.00 0.00 173.24 174.87 1ub7 h ASP 29 N 3.25 0.01 -0.95 7.02 3.58 -2.00 -2.26 116.42 125.07 1ub7 h ASP 29 Ca -0.37 0.07 0.12 0.00 0.42 0.00 0.00 57.03 57.27 1ub7 h ASP 29 Cb 1.19 0.09 -0.08 0.00 1.72 0.00 0.00 39.33 42.24 1ub7 h ASP 29 CO 0.58 0.04 0.58 -0.08 -2.88 0.00 0.00 179.24 177.48 1ub7 h GLU 30 N 0.22 0.88 -0.51 0.28 4.81 -1.99 0.91 114.58 119.18 1ub7 h GLU 30 Ca 0.20 -0.05 -0.10 0.00 -0.13 0.00 0.00 59.36 59.28 1ub7 h GLU 30 Cb 0.24 -0.20 -0.02 0.00 0.63 0.00 0.00 28.75 29.41 1ub7 h GLU 30 CO -0.26 0.58 -0.06 2.35 -0.73 0.00 0.00 179.01 180.89 1ub7 h TRP 31 N 0.91 1.04 0.12 0.92 7.01 -1.83 -1.68 115.95 122.44 1ub7 h TRP 31 Ca 0.48 -0.20 -0.01 0.00 2.11 0.00 0.00 58.89 61.27 1ub7 h TRP 31 Cb 0.50 -0.26 0.00 0.00 -2.10 0.00 0.00 29.16 27.30 1ub7 h TRP 31 CO -0.02 0.98 -0.06 0.82 -2.79 0.00 0.00 178.44 177.37 1ub7 h ILE 32 N 0.81 1.03 -0.61 2.65 2.04 -0.83 -1.81 117.51 120.78 1ub7 h ILE 32 Ca 0.14 -0.59 -0.09 0.00 1.00 0.00 0.00 64.86 65.32 1ub7 h ILE 32 Cb 0.61 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.06 1ub7 h ILE 32 CO 0.04 0.14 0.02 0.58 0.00 0.00 0.00 178.15 178.93 1ub7 h VAL 33 N -0.43 1.26 -0.23 1.67 2.07 -0.88 -1.13 116.25 118.58 1ub7 h VAL 33 Ca -0.02 -1.13 -0.19 0.00 0.82 0.00 0.00 66.70 66.19 1ub7 h VAL 33 Cb 0.35 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 30.89 1ub7 h VAL 33 CO 0.03 0.41 -0.60 0.71 0.02 0.00 0.00 177.57 178.14 1ub7 h THR 34 N 0.98 1.29 -0.06 2.57 1.35 -1.36 0.55 112.91 118.23 1ub7 h THR 34 Ca 0.18 -1.81 -0.19 0.00 -0.55 0.00 0.00 66.41 64.04 1ub7 h THR 34 Cb 0.54 1.75 -0.01 0.00 -1.73 0.00 0.00 68.15 68.70 1ub7 h THR 34 CO 0.03 0.58 -0.75 0.03 -0.25 0.00 0.00 175.52 175.16 1ub7 h ARG 35 N 0.57 0.37 0.00 4.72 2.47 -1.27 -3.42 114.38 117.82 1ub7 h ARG 35 Ca -0.00 -0.31 0.00 0.00 -1.26 0.00 0.00 59.98 58.41 1ub7 h ARG 35 Cb 1.19 0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.58 1ub7 h ARG 35 CO 0.12 0.96 -0.47 0.25 0.56 0.00 0.00 179.97 181.39 1ub7 n THR 36 N -3.82 0.00 0.00 2.04 -2.24 -0.43 -4.74 114.28 105.09 1ub7 n THR 36 Ca -0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1ub7 n THR 36 Cb 0.72 0.13 0.00 0.00 -2.10 0.00 0.00 70.33 69.08 1ub7 n THR 36 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ub7 n GLY 37 N 1.26 1.50 3.68 3.38 0.00 0.18 -0.82 105.19 114.37 1ub7 n GLY 37 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1ub7 n GLY 37 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ub7 s ILE 38 N -2.42 3.89 -0.11 -0.61 1.01 -1.26 -4.16 121.20 117.54 1ub7 s ILE 38 Ca 0.00 1.21 0.08 0.00 0.00 0.00 0.00 60.65 61.94 1ub7 s ILE 38 Cb 0.00 -3.78 -0.12 0.00 0.01 0.00 0.00 42.46 38.56 1ub7 s ILE 38 CO 0.00 -0.03 -0.00 0.29 0.00 0.00 0.00 174.94 175.20 1ub7 n LYS 39 N 5.76 1.78 -3.98 2.79 5.02 -0.03 -4.15 118.16 125.35 1ub7 n LYS 39 Ca 0.13 0.01 -0.10 0.00 -2.02 0.00 0.00 58.31 56.34 1ub7 n LYS 39 Cb 0.44 -1.28 -0.07 0.00 -0.02 0.00 0.00 35.03 34.11 1ub7 n LYS 39 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1ub7 s GLU 40 N -2.27 1.27 0.11 1.97 2.02 -0.25 -2.72 118.70 118.83 1ub7 s GLU 40 Ca -0.09 -1.22 -0.24 0.00 0.02 0.00 0.00 54.97 53.45 1ub7 s GLU 40 Cb 0.04 0.40 0.07 0.00 0.10 0.00 0.00 34.13 34.73 1ub7 s GLU 40 CO 0.42 -0.48 0.59 -0.98 0.02 0.00 0.00 175.26 174.83 1ub7 s ARG 41 N -3.99 1.20 0.04 1.61 3.03 -1.03 -2.78 118.95 117.02 1ub7 s ARG 41 Ca 0.20 -0.33 0.01 0.00 2.03 0.00 0.00 55.73 57.64 1ub7 s ARG 41 Cb 0.02 0.55 -0.04 0.00 -1.03 0.00 0.00 34.95 34.46 1ub7 s ARG 41 CO 0.03 -0.49 0.11 1.03 -1.13 0.00 0.00 175.30 174.86 1ub7 s ARG 42 N -3.14 3.10 -0.06 3.89 1.81 -1.26 -1.34 118.95 121.95 1ub7 s ARG 42 Ca -0.02 -0.54 0.04 0.00 -1.72 0.00 0.00 55.73 53.50 1ub7 s ARG 42 Cb -0.01 -2.87 -0.00 0.00 -0.45 0.00 0.00 34.95 31.63 1ub7 s ARG 42 CO -0.07 0.61 -0.20 0.08 -0.68 0.00 0.00 175.30 175.04 1ub7 s VAL 43 N -1.33 1.64 0.59 3.52 1.01 -0.45 -1.36 120.40 124.02 1ub7 s VAL 43 Ca 0.28 -0.82 -0.19 0.00 0.00 0.00 0.00 61.98 61.25 1ub7 s VAL 43 Cb -0.12 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 1ub7 s VAL 43 CO 0.20 0.47 1.21 0.00 0.00 0.00 0.00 175.10 176.98 1ub7 s ALA 44 N 0.12 2.57 0.79 5.51 0.00 -1.26 -4.02 121.76 125.47 1ub7 s ALA 44 Ca -0.08 1.03 -0.11 0.00 0.00 0.00 0.00 51.96 52.80 1ub7 s ALA 44 Cb -0.14 -3.46 0.07 0.00 0.00 0.00 0.00 23.12 19.60 1ub7 s ALA 44 CO 0.04 -1.16 1.12 0.00 0.00 0.00 0.00 175.76 175.76 1ub7 s ALA 45 N -1.57 2.06 0.59 0.00 0.00 -1.26 -4.86 121.76 116.72 1ub7 s ALA 45 Ca 0.77 0.45 0.29 0.00 0.00 0.00 0.00 51.96 53.46 1ub7 s ALA 45 Cb -0.31 -3.34 1.62 0.00 0.00 0.00 0.00 23.12 21.09 1ub7 s ALA 45 CO 0.34 -1.98 2.04 1.49 0.00 0.00 0.00 175.76 177.65 1ub7 h GLU 46 N -1.10 0.00 -0.39 0.00 4.81 -2.05 0.68 114.58 116.52 1ub7 h GLU 46 Ca -0.44 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 58.71 1ub7 h GLU 46 Cb 1.25 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 30.58 1ub7 h GLU 46 CO 0.49 0.00 0.04 -0.40 -0.73 0.00 0.00 179.01 178.41 1ub7 n ASP 47 N -3.73 3.86 -4.02 1.04 5.75 -1.26 -4.92 116.55 113.28 1ub7 n ASP 47 Ca 0.03 -3.22 -0.31 0.00 -0.01 0.00 0.00 54.79 51.29 1ub7 n ASP 47 Cb 0.41 -0.61 -0.16 0.00 -1.03 0.00 0.00 41.12 39.73 1ub7 n ASP 47 CO 0.00 0.00 0.00 -0.70 -0.11 0.00 0.00 177.20 176.39 1ub7 s GLU 48 N -2.95 2.27 0.26 0.11 2.12 0.23 -5.05 118.70 115.69 1ub7 s GLU 48 Ca 0.46 -0.70 0.01 0.00 0.36 0.00 0.00 54.97 55.10 1ub7 s GLU 48 Cb 0.38 -2.27 0.01 0.00 0.26 0.00 0.00 34.13 32.50 1ub7 s GLU 48 CO 0.08 -0.31 0.07 0.66 -0.54 0.00 0.00 175.26 175.22 1ub7 n TYR 49 N 4.72 0.04 -0.17 5.30 4.02 -1.26 -4.41 117.16 125.40 1ub7 n TYR 49 Ca -0.16 -1.21 -0.02 0.00 -0.01 0.00 0.00 57.90 56.50 1ub7 n TYR 49 Cb 0.49 -0.19 0.06 0.00 -0.02 0.00 0.00 39.34 39.68 1ub7 n TYR 49 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 176.86 177.00 1ub7 h THR 50 N 0.95 0.53 -0.76 -0.72 2.02 -1.91 -0.30 112.91 112.71 1ub7 h THR 50 Ca -0.20 -0.02 0.11 0.00 0.77 0.00 0.00 66.41 67.07 1ub7 h THR 50 Cb 0.63 0.46 -0.08 0.00 -1.74 0.00 0.00 68.15 67.42 1ub7 h THR 50 CO 0.32 0.01 0.38 0.77 0.37 0.00 0.00 175.52 177.38 1ub7 h SER 51 N 0.07 0.48 -0.40 4.18 4.64 -1.94 0.11 113.55 120.70 1ub7 h SER 51 Ca 0.27 0.07 -0.05 0.00 -0.47 0.00 0.00 61.79 61.60 1ub7 h SER 51 Cb 0.41 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.47 1ub7 h SER 51 CO -0.49 0.25 0.08 0.44 -0.87 0.00 0.00 176.83 176.24 1ub7 h ASP 52 N 0.62 0.68 -0.16 4.97 3.32 -1.48 0.27 116.42 124.64 1ub7 h ASP 52 Ca 0.39 -0.13 -0.12 0.00 0.02 0.00 0.00 57.03 57.19 1ub7 h ASP 52 Cb 0.45 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.81 1ub7 h ASP 52 CO -0.30 0.71 -0.32 -0.07 -1.72 0.00 0.00 179.24 177.54 1ub7 h LEU 53 N 0.70 0.68 -0.32 1.55 3.38 -0.03 -1.87 115.31 119.40 1ub7 h LEU 53 Ca 0.15 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.79 1ub7 h LEU 53 Cb 0.32 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1ub7 h LEU 53 CO 0.00 0.95 -0.06 0.00 0.09 0.00 0.00 178.44 179.42 1ub7 h ALA 54 N 1.10 0.44 -0.10 1.53 0.00 -0.30 -1.50 119.26 120.43 1ub7 h ALA 54 Ca 0.06 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.72 1ub7 h ALA 54 Cb 0.82 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1ub7 h ALA 54 CO 0.07 0.25 -0.05 0.74 0.00 0.00 0.00 179.25 180.26 1ub7 h PHE 55 N 0.38 -0.11 -0.99 0.00 0.04 -0.76 -0.52 116.94 114.97 1ub7 h PHE 55 Ca 0.08 0.01 0.09 0.00 2.80 0.00 0.00 57.97 60.95 1ub7 h PHE 55 Cb 0.54 0.07 -0.07 0.00 2.20 0.00 0.00 35.95 38.69 1ub7 h PHE 55 CO 0.05 -0.08 0.64 0.87 -0.60 0.00 0.00 178.31 179.19 1ub7 h LYS 56 N -0.04 1.06 -0.50 1.51 1.79 -1.26 0.41 116.57 119.54 1ub7 h LYS 56 Ca 0.06 -0.06 -0.09 0.00 -2.18 0.00 0.00 60.65 58.37 1ub7 h LYS 56 Cb 0.12 -0.24 -0.02 0.00 -1.58 0.00 0.00 32.23 30.52 1ub7 h LYS 56 CO -0.12 0.70 -0.04 0.00 -1.08 0.00 0.00 179.45 178.91 1ub7 h ALA 57 N 1.49 0.68 -0.45 3.86 0.00 -0.53 -0.59 119.26 123.71 1ub7 h ALA 57 Ca 0.45 -0.31 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 1ub7 h ALA 57 Cb 0.30 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1ub7 h ALA 57 CO -0.20 0.53 -0.17 0.28 0.00 0.00 0.00 179.25 179.69 1ub7 h VAL 58 N 0.77 1.27 -0.88 0.00 2.07 -0.43 -1.62 116.25 117.43 1ub7 h VAL 58 Ca 0.14 -1.31 0.00 0.00 0.82 0.00 0.00 66.70 66.35 1ub7 h VAL 58 Cb 0.58 1.16 -0.04 0.00 -1.52 0.00 0.00 31.29 31.46 1ub7 h VAL 58 CO 0.03 0.45 0.57 -0.33 0.02 0.00 0.00 177.57 178.31 1ub7 h GLU 59 N 0.75 1.17 -0.54 1.57 5.08 0.04 0.52 114.58 123.17 1ub7 h GLU 59 Ca 0.11 -0.08 -0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1ub7 h GLU 59 Cb 0.73 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.69 1ub7 h GLU 59 CO 0.06 0.79 0.23 0.22 -1.00 0.00 0.00 179.01 179.31 1ub7 h ASP 60 N 1.20 0.73 -0.93 1.42 3.58 -0.87 -1.78 116.42 119.77 1ub7 h ASP 60 Ca 0.32 -0.16 -0.00 0.00 0.42 0.00 0.00 57.03 57.61 1ub7 h ASP 60 Cb -0.11 -0.19 -0.05 0.00 1.72 0.00 0.00 39.33 40.71 1ub7 h ASP 60 CO -0.07 0.69 0.57 0.25 -2.88 0.00 0.00 179.24 177.80 1ub7 h LEU 61 N 0.73 1.10 -0.96 2.28 6.46 -0.51 -1.54 115.31 122.87 1ub7 h LEU 61 Ca 0.18 -0.06 -0.10 0.00 -0.12 0.00 0.00 57.88 57.78 1ub7 h LEU 61 Cb 0.17 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.81 1ub7 h LEU 61 CO -0.02 0.84 -0.37 -0.07 -0.62 0.00 0.00 178.44 178.20 1ub7 h LEU 62 N 1.28 0.29 -0.83 2.25 3.38 -0.57 0.19 115.31 121.29 1ub7 h LEU 62 Ca 0.33 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 58.08 1ub7 h LEU 62 Cb -0.07 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1ub7 h LEU 62 CO -0.06 0.64 -0.36 -0.09 0.09 0.00 0.00 178.44 178.66 1ub7 h ARG 63 N 0.24 0.45 0.04 1.13 2.43 -0.59 -0.91 114.38 117.17 1ub7 h ARG 63 Ca 0.03 -0.21 -0.27 0.00 -0.81 0.00 0.00 59.98 58.72 1ub7 h ARG 63 Cb 0.77 -0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.28 1ub7 h ARG 63 CO 0.06 0.75 -1.38 0.00 -1.51 0.00 0.00 179.97 177.89 1ub7 h ARG 64 N 0.38 0.09 -2.41 0.20 3.08 -0.97 -3.40 114.38 111.36 1ub7 h ARG 64 Ca 0.04 -0.15 -0.59 0.00 0.07 0.00 0.00 59.98 59.36 1ub7 h ARG 64 Cb 0.81 0.05 -0.39 0.00 0.08 0.00 0.00 29.97 30.52 1ub7 h ARG 64 CO 0.07 0.90 -0.90 0.72 -1.07 0.00 0.00 179.97 179.68 1ub7 n HIS 65 N -3.30 0.30 -1.72 3.04 8.25 0.62 -5.08 115.22 117.33 1ub7 n HIS 65 Ca -0.10 -3.61 -0.41 0.00 -0.26 0.00 0.00 57.72 53.34 1ub7 n HIS 65 Cb 1.01 -0.09 0.01 0.00 1.12 0.00 0.00 29.99 32.04 1ub7 n HIS 65 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1ub7 n PRO 66 N 2.23 2.12 -1.94 -0.41 -0.02 -0.36 -2.42 135.00 134.19 1ub7 n PRO 66 Ca 0.26 0.75 -0.09 0.00 -2.02 0.00 0.00 63.50 62.40 1ub7 n PRO 66 Cb 0.46 -2.45 -0.01 0.00 -0.02 0.00 0.00 33.50 31.47 1ub7 n PRO 66 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ub7 n GLY 67 N 0.72 0.27 0.13 -1.23 0.00 -1.26 -4.94 105.19 98.88 1ub7 n GLY 67 Ca 0.05 -0.54 0.07 0.00 0.00 0.00 0.00 46.02 45.61 1ub7 n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ub7 h ALA 68 N 0.32 0.67 0.00 4.61 0.00 -1.83 -3.25 119.26 119.78 1ub7 h ALA 68 Ca -0.21 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1ub7 h ALA 68 Cb 1.02 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ub7 h ALA 68 CO 0.26 0.34 0.00 1.28 0.00 0.00 0.00 179.25 181.13 1ub7 n LEU 69 N -2.91 0.00 -4.66 0.00 4.77 -1.26 -4.71 117.00 108.23 1ub7 n LEU 69 Ca -0.01 0.39 -0.42 0.00 -0.03 0.00 0.00 56.01 55.94 1ub7 n LEU 69 Cb 0.65 -0.39 -0.03 0.00 -2.33 0.00 0.00 43.42 41.32 1ub7 n LEU 69 CO 0.40 -0.05 1.44 -0.70 -1.33 0.00 0.00 177.39 177.15 1ub7 s GLU 70 N -2.79 4.17 0.00 3.23 2.12 -1.23 -1.18 118.70 123.02 1ub7 s GLU 70 Ca 0.19 2.32 0.00 0.00 0.36 0.00 0.00 54.97 57.84 1ub7 s GLU 70 Cb 0.17 -4.03 0.00 0.00 0.26 0.00 0.00 34.13 30.54 1ub7 s GLU 70 CO 0.44 -0.88 0.00 0.41 -0.54 0.00 0.00 175.26 174.69 1ub7 n GLY 71 N 4.25 0.63 3.63 -1.50 0.00 -1.26 -5.00 105.19 105.94 1ub7 n GLY 71 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 1ub7 n GLY 71 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ub7 s VAL 72 N -2.51 4.17 -1.29 1.61 1.01 -0.33 -2.21 120.40 120.86 1ub7 s VAL 72 Ca 0.00 1.32 0.21 0.00 0.00 0.00 0.00 61.98 63.50 1ub7 s VAL 72 Cb 0.00 -4.19 -0.15 0.00 0.00 0.00 0.00 36.38 32.04 1ub7 s VAL 72 CO 0.00 -0.50 0.92 0.47 0.00 0.00 0.00 175.10 175.99 1ub7 n ASP 73 N 7.60 1.29 -3.65 3.32 8.00 0.39 -4.50 116.55 129.01 1ub7 n ASP 73 Ca 0.14 -1.15 -0.16 0.00 0.71 0.00 0.00 54.79 54.34 1ub7 n ASP 73 Cb 0.47 0.82 -0.07 0.00 -0.02 0.00 0.00 41.12 42.32 1ub7 n ASP 73 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ub7 s ALA 74 N -2.73 -1.26 -0.12 2.24 0.00 -1.18 -2.00 121.76 116.70 1ub7 s ALA 74 Ca 0.11 0.83 0.01 0.00 0.00 0.00 0.00 51.96 52.91 1ub7 s ALA 74 Cb 0.16 0.01 0.02 0.00 0.00 0.00 0.00 23.12 23.30 1ub7 s ALA 74 CO 0.73 -0.31 -0.16 0.08 0.00 0.00 0.00 175.76 176.11 1ub7 s VAL 75 N -1.21 1.57 -0.15 0.00 1.01 -0.22 -0.28 120.40 121.13 1ub7 s VAL 75 Ca -0.12 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.21 1ub7 s VAL 75 Cb -0.03 -1.44 0.01 0.00 0.00 0.00 0.00 36.38 34.92 1ub7 s VAL 75 CO 0.07 0.46 -0.21 -0.63 0.00 0.00 0.00 175.10 174.79 1ub7 s ILE 76 N 1.11 1.99 -0.33 2.22 1.01 0.14 -2.04 121.20 125.31 1ub7 s ILE 76 Ca -0.03 -0.93 -0.03 0.00 0.00 0.00 0.00 60.65 59.66 1ub7 s ILE 76 Cb -0.14 -1.77 0.06 0.00 0.01 0.00 0.00 42.46 40.61 1ub7 s ILE 76 CO -0.04 0.54 0.06 -0.69 0.00 0.00 0.00 174.94 174.80 1ub7 s VAL 77 N 0.94 3.23 -0.31 2.92 1.01 -0.60 -0.47 120.40 127.12 1ub7 s VAL 77 Ca -0.04 -1.44 -0.27 0.00 0.00 0.00 0.00 61.98 60.24 1ub7 s VAL 77 Cb -0.15 -2.91 0.01 0.00 0.00 0.00 0.00 36.38 33.33 1ub7 s VAL 77 CO -0.04 -0.22 0.95 0.00 0.00 0.00 0.00 175.10 175.78 1ub7 s ALA 78 N 1.27 3.52 0.18 5.51 0.00 0.87 -0.37 121.76 132.73 1ub7 s ALA 78 Ca -0.02 -0.21 -0.23 0.00 0.00 0.00 0.00 51.96 51.49 1ub7 s ALA 78 Cb -0.20 -3.51 0.05 0.00 0.00 0.00 0.00 23.12 19.46 1ub7 s ALA 78 CO -0.01 -1.35 0.76 -0.08 0.00 0.00 0.00 175.76 175.08 1ub7 s THR 79 N 3.33 0.00 0.00 0.00 -1.32 -0.90 -2.48 115.64 114.28 1ub7 s THR 79 Ca 0.40 -0.51 0.00 0.00 -1.21 0.00 0.00 61.69 60.37 1ub7 s THR 79 Cb -0.13 -1.58 0.00 0.00 -1.51 0.00 0.00 72.50 69.28 1ub7 s THR 79 CO 0.14 0.00 0.59 0.59 -2.21 0.00 0.00 174.62 173.72 1ub7 n ASN 80 N -0.41 0.75 -3.14 8.08 3.02 -1.26 -4.31 115.26 117.99 1ub7 n ASN 80 Ca -0.09 -1.32 -0.20 0.00 -0.03 0.00 0.00 54.58 52.94 1ub7 n ASN 80 Cb 0.61 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.75 1ub7 n ASN 80 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1ub7 n THR 81 N -0.16 0.49 -2.28 3.41 -2.24 -1.26 -5.08 114.28 107.15 1ub7 n THR 81 Ca 0.00 -4.76 -0.35 0.00 -2.27 0.00 0.00 64.05 56.66 1ub7 n THR 81 Cb 0.33 -0.61 -0.00 0.00 -2.10 0.00 0.00 70.33 67.94 1ub7 n THR 81 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 1ub7 s PRO 82 N -2.57 3.48 0.28 -0.78 0.04 -1.26 -4.56 135.00 129.63 1ub7 s PRO 82 Ca 0.41 1.63 -0.00 0.00 0.04 0.00 0.00 61.00 63.08 1ub7 s PRO 82 Cb 0.32 -2.10 0.49 0.00 0.04 0.00 0.00 34.50 33.25 1ub7 s PRO 82 CO -0.09 -0.75 1.88 -0.44 0.04 0.00 0.00 177.00 177.64 1ub7 h ASP 83 N 1.42 0.97 -5.25 6.66 5.19 -1.98 -3.45 116.42 120.00 1ub7 h ASP 83 Ca -0.50 0.02 -0.10 0.00 -0.62 0.00 0.00 57.03 55.83 1ub7 h ASP 83 Cb 1.26 -0.18 -0.13 0.00 0.18 0.00 0.00 39.33 40.45 1ub7 h ASP 83 CO 0.58 0.59 -0.32 0.00 -3.12 0.00 0.00 179.24 176.97 1ub7 s ALA 84 N -5.97 -0.05 0.20 3.45 0.00 -1.26 -5.01 121.76 113.12 1ub7 s ALA 84 Ca -0.12 -0.84 0.15 0.00 0.00 0.00 0.00 51.96 51.15 1ub7 s ALA 84 Cb 0.21 0.82 0.51 0.00 0.00 0.00 0.00 23.12 24.65 1ub7 s ALA 84 CO 0.81 -0.63 1.66 -0.07 0.00 0.00 0.00 175.76 177.53 1ub7 h LEU 85 N 2.56 0.00 -7.00 0.00 3.38 -2.01 -3.44 115.31 108.80 1ub7 h LEU 85 Ca -0.32 0.00 0.11 0.00 0.09 0.00 0.00 57.88 57.76 1ub7 h LEU 85 Cb 1.23 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.70 1ub7 h LEU 85 CO 0.49 0.49 0.53 0.72 0.09 0.00 0.00 178.44 180.76 1ub7 s PHE 86 N -3.57 -0.40 0.80 1.13 -0.71 -1.26 -4.58 117.98 109.39 1ub7 s PHE 86 Ca -0.00 0.91 -0.13 0.00 -1.04 0.00 0.00 56.93 56.66 1ub7 s PHE 86 Cb 0.12 0.36 0.08 0.00 -1.21 0.00 0.00 43.02 42.37 1ub7 s PHE 86 CO 0.72 -0.19 1.20 -1.25 -1.34 0.00 0.00 175.22 174.35 1ub7 s PRO 87 N 0.51 1.70 0.48 1.99 0.04 -1.26 -5.12 135.00 133.33 1ub7 s PRO 87 Ca 0.00 1.71 -0.19 0.00 0.04 0.00 0.00 61.00 62.57 1ub7 s PRO 87 Cb -0.05 -1.79 -0.09 0.00 0.04 0.00 0.00 34.50 32.62 1ub7 s PRO 87 CO -0.10 -2.16 0.98 0.16 0.04 0.00 0.00 177.00 175.92 1ub7 s ASP 88 N -2.23 6.65 0.26 6.66 -4.77 -1.26 -4.38 116.67 117.60 1ub7 s ASP 88 Ca 0.72 1.71 -0.03 0.00 -3.30 0.00 0.00 52.55 51.64 1ub7 s ASP 88 Cb -0.28 -2.53 0.37 0.00 -1.09 0.00 0.00 42.92 39.39 1ub7 s ASP 88 CO 0.50 -0.56 1.90 0.74 0.70 0.00 0.00 175.17 178.45 1ub7 h THR 89 N 1.44 1.14 -0.29 2.11 2.02 -1.93 -2.14 112.91 115.26 1ub7 h THR 89 Ca -0.48 -0.42 0.08 0.00 0.77 0.00 0.00 66.41 66.36 1ub7 h THR 89 Cb 1.19 -0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 1ub7 h THR 89 CO 0.60 0.23 0.22 0.00 0.37 0.00 0.00 175.52 176.94 1ub7 h ALA 90 N 1.43 2.22 -0.05 6.16 0.00 -1.90 -0.71 119.26 126.42 1ub7 h ALA 90 Ca 0.41 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 55.09 1ub7 h ALA 90 Cb 0.06 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1ub7 h ALA 90 CO -0.14 -0.36 -0.87 0.00 0.00 0.00 0.00 179.25 177.87 1ub7 h ALA 91 N 1.84 0.38 -0.60 0.00 0.00 -1.68 -0.16 119.26 119.04 1ub7 h ALA 91 Ca 0.14 -0.66 -0.06 0.00 0.00 0.00 0.00 54.91 54.33 1ub7 h ALA 91 Cb 0.57 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1ub7 h ALA 91 CO -0.00 0.76 0.14 -0.07 0.00 0.00 0.00 179.25 180.08 1ub7 h LEU 92 N 0.32 0.89 -0.38 0.00 3.38 -1.13 -0.82 115.31 117.57 1ub7 h LEU 92 Ca -0.07 -0.17 -0.08 0.00 0.09 0.00 0.00 57.88 57.65 1ub7 h LEU 92 Cb 1.49 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 1ub7 h LEU 92 CO 0.16 0.86 -0.08 0.58 0.09 0.00 0.00 178.44 180.06 1ub7 h VAL 93 N 0.90 1.27 -0.76 1.22 2.07 -1.03 -0.99 116.25 118.93 1ub7 h VAL 93 Ca 0.19 -1.14 0.05 0.00 0.82 0.00 0.00 66.70 66.62 1ub7 h VAL 93 Cb 0.33 1.25 -0.06 0.00 -1.52 0.00 0.00 31.29 31.30 1ub7 h VAL 93 CO 0.00 0.38 0.46 -0.61 0.02 0.00 0.00 177.57 177.82 1ub7 h GLN 94 N 0.52 0.83 -0.05 1.57 -0.00 -0.53 -2.56 115.11 114.89 1ub7 h GLN 94 Ca 0.10 -0.05 -0.06 0.00 -0.00 0.00 0.00 58.65 58.64 1ub7 h GLN 94 Cb 0.58 -0.19 0.00 0.00 0.00 0.00 0.00 27.48 27.88 1ub7 h GLN 94 CO 0.03 0.55 -0.19 0.00 0.00 0.00 0.00 178.83 179.22 1ub7 h ALA 95 N 1.36 0.09 -1.01 3.38 0.00 -1.06 0.59 119.26 122.62 1ub7 h ALA 95 Ca 0.33 -0.39 0.24 0.00 0.00 0.00 0.00 54.91 55.09 1ub7 h ALA 95 Cb 0.14 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.83 1ub7 h ALA 95 CO -0.16 0.05 0.64 -0.09 0.00 0.00 0.00 179.25 179.70 1ub7 h ARG 96 N -0.31 0.45 -0.46 0.00 9.65 -0.99 0.29 114.38 123.01 1ub7 h ARG 96 Ca -0.01 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 1ub7 h ARG 96 Cb 0.83 -0.10 0.00 0.00 -1.39 0.00 0.00 29.97 29.31 1ub7 h ARG 96 CO 0.04 0.30 0.00 1.19 2.80 0.00 0.00 179.97 184.30 1ub7 n PHE 97 N -4.64 1.09 -3.94 2.20 3.72 -0.98 -4.96 117.46 109.95 1ub7 n PHE 97 Ca 0.24 -0.66 -0.30 0.00 -0.05 0.00 0.00 57.45 56.68 1ub7 n PHE 97 Cb 0.79 -0.22 0.02 0.00 -0.94 0.00 0.00 39.48 39.13 1ub7 n PHE 97 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ub7 n GLY 98 N 0.49 -0.45 3.83 1.37 0.00 0.09 -4.94 105.19 105.58 1ub7 n GLY 98 Ca 0.21 0.18 -0.33 0.00 0.00 0.00 0.00 46.02 46.07 1ub7 n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ub7 s LEU 99 N -7.20 4.05 -0.64 0.99 1.43 0.17 -5.00 118.68 112.47 1ub7 s LEU 99 Ca 0.57 1.50 -0.11 0.00 -1.03 0.00 0.00 54.13 55.05 1ub7 s LEU 99 Cb -0.29 -4.24 0.16 0.00 0.03 0.00 0.00 46.19 41.86 1ub7 s LEU 99 CO 0.84 -0.25 0.55 -0.75 0.23 0.00 0.00 176.35 176.98 1ub7 s LYS 100 N -2.94 3.01 0.07 1.70 2.20 -1.26 -4.78 119.74 117.73 1ub7 s LYS 100 Ca 0.56 -2.13 -0.27 0.00 -0.36 0.00 0.00 55.97 53.77 1ub7 s LYS 100 Cb -0.11 -4.16 0.08 0.00 -1.51 0.00 0.00 37.83 32.14 1ub7 s LYS 100 CO 0.16 -1.26 0.93 0.00 -0.36 0.00 0.00 175.35 174.82 1ub7 s ALA 101 N 0.75 -1.75 0.39 3.13 0.00 -1.26 -4.51 121.76 118.50 1ub7 s ALA 101 Ca 0.11 0.60 -0.07 0.00 0.00 0.00 0.00 51.96 52.60 1ub7 s ALA 101 Cb -0.20 0.52 -0.05 0.00 0.00 0.00 0.00 23.12 23.39 1ub7 s ALA 101 CO -0.03 -0.86 0.70 -0.59 0.00 0.00 0.00 175.76 174.98 1ub7 s PHE 102 N -3.19 3.50 -0.00 0.00 -0.71 -0.85 -4.90 117.98 111.83 1ub7 s PHE 102 Ca 0.08 0.82 -0.12 0.00 -1.04 0.00 0.00 56.93 56.67 1ub7 s PHE 102 Cb -0.01 -2.27 0.01 0.00 -1.21 0.00 0.00 43.02 39.54 1ub7 s PHE 102 CO -0.04 -0.06 0.25 0.00 -1.34 0.00 0.00 175.22 174.03 1ub7 s ALA 103 N -2.39 -0.61 -0.04 1.99 0.00 -1.26 -1.05 121.76 118.40 1ub7 s ALA 103 Ca 0.47 0.12 -0.29 0.00 0.00 0.00 0.00 51.96 52.27 1ub7 s ALA 103 Cb -0.10 0.12 0.09 0.00 0.00 0.00 0.00 23.12 23.22 1ub7 s ALA 103 CO 0.35 -0.26 0.79 1.52 0.00 0.00 0.00 175.76 178.16 1ub7 s TYR 104 N -1.51 -0.51 0.03 0.00 -0.85 -0.86 -4.76 117.35 108.89 1ub7 s TYR 104 Ca -0.13 0.72 -0.15 0.00 -0.52 0.00 0.00 57.07 56.99 1ub7 s TYR 104 Cb -0.05 0.46 -0.06 0.00 0.38 0.00 0.00 41.96 42.69 1ub7 s TYR 104 CO 0.02 -0.56 0.46 -0.51 -1.52 0.00 0.00 175.55 173.44 1ub7 s ASP 105 N -1.60 6.86 -0.19 -0.18 1.11 -1.26 -1.56 116.67 119.85 1ub7 s ASP 105 Ca -0.04 1.03 -0.03 0.00 0.18 0.00 0.00 52.55 53.70 1ub7 s ASP 105 Cb -0.00 -2.27 -0.01 0.00 1.07 0.00 0.00 42.92 41.70 1ub7 s ASP 105 CO 0.01 0.29 -0.08 -0.22 1.18 0.00 0.00 175.17 176.36 1ub7 s LEU 106 N -1.20 2.82 -0.30 1.23 0.20 0.50 -4.90 118.68 117.04 1ub7 s LEU 106 Ca 0.26 -0.37 -0.04 0.00 0.69 0.00 0.00 54.13 54.67 1ub7 s LEU 106 Cb -0.17 -1.69 0.03 0.00 -0.43 0.00 0.00 46.19 43.93 1ub7 s LEU 106 CO 0.15 0.04 0.04 -0.76 -0.29 0.00 0.00 176.35 175.53 1ub7 s LEU 107 N 1.09 3.86 -0.15 -0.68 1.02 -1.26 -2.11 118.68 120.44 1ub7 s LEU 107 Ca 0.01 -1.00 0.13 0.00 0.02 0.00 0.00 54.13 53.28 1ub7 s LEU 107 Cb -0.15 -1.79 0.29 0.00 0.02 0.00 0.00 46.19 44.57 1ub7 s LEU 107 CO -0.01 -0.23 1.22 0.00 0.02 0.00 0.00 176.35 177.35 1ub7 n ALA 108 N 4.75 3.05 -0.69 4.21 0.00 -1.26 -5.06 120.51 125.51 1ub7 n ALA 108 Ca -0.14 -1.43 0.00 0.00 0.00 0.00 0.00 53.44 51.87 1ub7 n ALA 108 Cb 0.46 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 19.26 1ub7 n ALA 108 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ub7 n GLY 109 N -0.51 0.98 0.24 0.00 0.00 -1.26 -3.54 105.19 101.11 1ub7 n GLY 109 Ca -0.13 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.45 1ub7 n GLY 109 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ub7 n PRO 111 N 0.00 0.00 -0.32 1.61 -0.02 -1.26 -4.66 135.00 130.34 1ub7 n PRO 111 Ca 0.00 0.00 0.20 0.00 -2.02 0.00 0.00 63.50 61.68 1ub7 n PRO 111 Cb 0.00 -0.08 0.39 0.00 -0.02 0.00 0.00 33.50 33.79 1ub7 n PRO 111 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1ub7 h GLY 112 N 0.00 1.65 0.99 -1.23 0.00 -1.93 -0.22 103.07 102.33 1ub7 h GLY 112 Ca 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 47.33 47.26 1ub7 h GLY 112 CO 0.00 -0.56 0.12 -0.25 0.00 0.00 0.00 176.54 175.85 1ub7 h TRP 113 N 0.09 0.90 -0.50 5.60 7.01 -1.84 0.86 115.95 128.08 1ub7 h TRP 113 Ca 0.67 -0.11 -0.09 0.00 2.11 0.00 0.00 58.89 61.47 1ub7 h TRP 113 Cb 1.53 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 28.31 1ub7 h TRP 113 CO -0.25 0.80 -0.05 0.82 -2.79 0.00 0.00 178.44 176.96 1ub7 h ILE 114 N 0.75 1.26 -0.47 2.65 2.04 -1.45 0.08 117.51 122.37 1ub7 h ILE 114 Ca 0.16 -1.13 0.05 0.00 1.00 0.00 0.00 64.86 64.94 1ub7 h ILE 114 Cb 0.36 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 37.32 1ub7 h ILE 114 CO 0.00 0.40 0.21 1.88 0.00 0.00 0.00 178.15 180.64 1ub7 h TYR 115 N 0.80 0.38 -0.64 1.37 -1.99 -0.88 -1.62 116.97 114.39 1ub7 h TYR 115 Ca 0.14 0.02 -0.03 0.00 2.00 0.00 0.00 58.73 60.86 1ub7 h TYR 115 Cb 0.55 -0.10 -0.03 0.00 2.00 0.00 0.00 36.73 39.15 1ub7 h TYR 115 CO 0.03 0.17 0.27 0.00 -0.00 0.00 0.00 178.16 178.63 1ub7 h ALA 116 N 1.27 1.28 -0.12 3.88 0.00 0.23 -0.88 119.26 124.92 1ub7 h ALA 116 Ca 0.21 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ub7 h ALA 116 Cb 0.16 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1ub7 h ALA 116 CO -0.17 0.54 0.07 -0.07 0.00 0.00 0.00 179.25 179.61 1ub7 h LEU 117 N 0.91 0.15 -0.31 0.00 3.38 -0.44 0.09 115.31 119.09 1ub7 h LEU 117 Ca 0.22 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.12 1ub7 h LEU 117 Cb 0.15 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1ub7 h LEU 117 CO -0.02 0.18 0.19 0.00 0.09 0.00 0.00 178.44 178.88 1ub7 h ALA 118 N 0.97 0.39 -0.77 1.53 0.00 -0.85 0.28 119.26 120.81 1ub7 h ALA 118 Ca 0.04 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ub7 h ALA 118 Cb 0.06 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1ub7 h ALA 118 CO -0.01 -0.16 0.44 1.96 0.00 0.00 0.00 179.25 181.48 1ub7 h GLN 119 N 0.40 1.07 -0.24 0.00 1.08 -1.07 -1.22 115.11 115.13 1ub7 h GLN 119 Ca 0.12 -0.11 -0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1ub7 h GLN 119 Cb -0.02 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 27.18 1ub7 h GLN 119 CO -0.04 0.77 0.14 0.00 -0.95 0.00 0.00 178.83 178.75 1ub7 h ALA 120 N 1.23 0.31 -0.87 3.87 0.00 -0.48 0.23 119.26 123.54 1ub7 h ALA 120 Ca 0.27 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.20 1ub7 h ALA 120 Cb 0.00 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 1ub7 h ALA 120 CO -0.05 -0.19 0.54 1.25 0.00 0.00 0.00 179.25 180.80 1ub7 h HIS 121 N 0.29 0.99 -0.40 0.00 -0.00 -0.16 -1.19 115.15 114.70 1ub7 h HIS 121 Ca 0.09 0.03 -0.03 0.00 -0.00 0.00 0.00 60.37 60.45 1ub7 h HIS 121 Cb 0.03 -0.32 -0.02 0.00 -0.00 0.00 0.00 27.41 27.10 1ub7 h HIS 121 CO -0.04 0.50 0.12 0.00 -0.00 0.00 0.00 177.93 178.50 1ub7 h ALA 122 N 1.41 0.52 -0.63 5.26 0.00 -0.56 -0.90 119.26 124.37 1ub7 h ALA 122 Ca 0.38 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1ub7 h ALA 122 Cb 0.19 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1ub7 h ALA 122 CO -0.18 0.17 0.31 -0.07 0.00 0.00 0.00 179.25 179.48 1ub7 h LEU 123 N 0.50 0.80 0.29 0.00 3.38 -0.28 0.68 115.31 120.67 1ub7 h LEU 123 Ca 0.13 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1ub7 h LEU 123 Cb 0.26 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1ub7 h LEU 123 CO -0.00 0.67 -0.14 0.58 0.09 0.00 0.00 178.44 179.64 1ub7 h VAL 124 N 0.89 0.64 -0.28 1.22 2.07 -1.03 0.46 116.25 120.23 1ub7 h VAL 124 Ca 0.22 -0.76 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 1ub7 h VAL 124 Cb 0.07 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 30.82 1ub7 h VAL 124 CO -0.03 0.13 0.10 -0.33 0.02 0.00 0.00 177.57 177.46 1ub7 h GLU 125 N -0.85 0.39 -0.00 1.57 4.39 -1.08 -1.66 114.58 117.33 1ub7 h GLU 125 Ca -0.04 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.61 1ub7 h GLU 125 Cb 0.52 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 1ub7 h GLU 125 CO 0.07 0.34 -0.10 0.00 -1.16 0.00 0.00 179.01 178.16 1ub7 n ALA 126 N -2.49 2.70 -1.03 3.43 0.00 0.22 -4.94 120.51 118.40 1ub7 n ALA 126 Ca 0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 53.44 53.22 1ub7 n ALA 126 Cb 0.14 -1.38 -0.00 0.00 0.00 0.00 0.00 19.45 18.21 1ub7 n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ub7 n GLY 127 N 1.32 0.48 0.03 0.00 0.00 -0.62 -4.92 105.19 101.48 1ub7 n GLY 127 Ca 0.13 -0.91 0.12 0.00 0.00 0.00 0.00 46.02 45.35 1ub7 n GLY 127 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ub7 n LEU 128 N -0.13 0.60 -3.74 0.99 4.77 0.08 -4.88 117.00 114.70 1ub7 n LEU 128 Ca -0.01 0.05 -0.13 0.00 -0.03 0.00 0.00 56.01 55.89 1ub7 n LEU 128 Cb 0.04 -0.19 -0.10 0.00 -2.33 0.00 0.00 43.42 40.84 1ub7 n LEU 128 CO 0.02 0.06 0.04 0.00 -1.33 0.00 0.00 177.39 176.18 1ub7 s ALA 129 N -3.09 -0.92 -0.02 -1.18 0.00 -0.79 -4.98 121.76 110.77 1ub7 s ALA 129 Ca 0.08 1.08 -0.21 0.00 0.00 0.00 0.00 51.96 52.91 1ub7 s ALA 129 Cb 0.15 -0.63 -0.28 0.00 0.00 0.00 0.00 23.12 22.36 1ub7 s ALA 129 CO 0.74 -0.18 0.98 0.37 0.00 0.00 0.00 175.76 177.66 1ub7 h GLN 130 N 5.67 0.35 -3.66 0.00 4.15 -1.87 -3.33 115.11 116.41 1ub7 h GLN 130 Ca -0.27 -0.50 -0.15 0.00 0.77 0.00 0.00 58.65 58.50 1ub7 h GLN 130 Cb 1.18 0.17 -0.20 0.00 0.21 0.00 0.00 27.48 28.84 1ub7 h GLN 130 CO 0.27 1.20 -0.54 0.15 -1.93 0.00 0.00 178.83 177.98 1ub7 s LYS 131 N -2.74 0.47 -0.03 1.69 1.02 -0.94 -4.37 119.74 114.84 1ub7 s LYS 131 Ca -0.13 -0.52 0.03 0.00 0.02 0.00 0.00 55.97 55.37 1ub7 s LYS 131 Cb 0.02 0.19 -0.00 0.00 -0.52 0.00 0.00 37.83 37.52 1ub7 s LYS 131 CO 0.83 -0.11 -0.11 0.08 -0.92 0.00 0.00 175.35 175.12 1ub7 s VAL 132 N -1.66 0.91 -0.40 3.17 1.01 0.18 -0.46 120.40 123.14 1ub7 s VAL 132 Ca -0.13 -0.44 -0.19 0.00 0.00 0.00 0.00 61.98 61.22 1ub7 s VAL 132 Cb -0.07 -0.79 0.01 0.00 0.00 0.00 0.00 36.38 35.53 1ub7 s VAL 132 CO -0.00 0.27 0.56 -0.22 0.00 0.00 0.00 175.10 175.71 1ub7 s LEU 133 N 0.08 4.53 -0.33 3.92 2.96 0.61 -0.13 118.68 130.32 1ub7 s LEU 133 Ca -0.02 -0.30 -0.06 0.00 -0.22 0.00 0.00 54.13 53.53 1ub7 s LEU 133 Cb -0.08 -2.61 0.04 0.00 0.50 0.00 0.00 46.19 44.03 1ub7 s LEU 133 CO 0.01 -0.64 0.10 0.00 -1.32 0.00 0.00 176.35 174.50 1ub7 s ALA 134 N 2.53 3.04 0.02 5.97 0.00 0.16 -0.68 121.76 132.79 1ub7 s ALA 134 Ca 0.19 -1.70 0.01 0.00 0.00 0.00 0.00 51.96 50.46 1ub7 s ALA 134 Cb -0.15 -2.24 -0.04 0.00 0.00 0.00 0.00 23.12 20.69 1ub7 s ALA 134 CO 0.16 -1.27 0.07 0.08 0.00 0.00 0.00 175.76 174.80 1ub7 s VAL 135 N 1.41 4.63 -0.28 0.00 1.01 0.38 -1.54 120.40 126.01 1ub7 s VAL 135 Ca -0.01 -0.51 -0.00 0.00 0.00 0.00 0.00 61.98 61.45 1ub7 s VAL 135 Cb -0.19 -3.14 0.09 0.00 0.00 0.00 0.00 36.38 33.13 1ub7 s VAL 135 CO 0.03 0.30 0.05 -0.83 0.00 0.00 0.00 175.10 174.64 1ub7 s GLY 136 N -1.88 1.17 0.01 4.51 0.00 0.32 -0.09 107.32 111.34 1ub7 s GLY 136 Ca 0.24 -1.57 0.02 0.00 0.00 0.00 0.00 44.72 43.41 1ub7 s GLY 136 CO 0.16 1.37 -0.06 0.00 0.00 0.00 0.00 173.10 174.56 1ub7 s ALA 137 N 1.52 0.49 -0.15 3.20 0.00 -1.04 -0.11 121.76 125.67 1ub7 s ALA 137 Ca 0.05 -0.34 -0.07 0.00 0.00 0.00 0.00 51.96 51.60 1ub7 s ALA 137 Cb -0.18 -0.09 0.06 0.00 0.00 0.00 0.00 23.12 22.92 1ub7 s ALA 137 CO -0.17 0.09 0.34 -1.21 0.00 0.00 0.00 175.76 174.81 1ub7 s GLU 138 N -0.42 0.28 -0.71 0.00 0.41 -0.45 -4.41 118.70 113.41 1ub7 s GLU 138 Ca -0.00 0.75 0.03 0.00 -0.41 0.00 0.00 54.97 55.34 1ub7 s GLU 138 Cb -0.04 0.01 0.33 0.00 -1.78 0.00 0.00 34.13 32.65 1ub7 s GLU 138 CO -0.00 -0.20 1.18 0.00 -0.49 0.00 0.00 175.26 175.75 1ub7 n ALA 139 N 4.66 5.04 -0.02 5.21 0.00 -1.26 -2.07 120.51 132.07 1ub7 n ALA 139 Ca -0.18 -4.69 0.23 0.00 0.00 0.00 0.00 53.44 48.80 1ub7 n ALA 139 Cb 0.52 -1.15 0.72 0.00 0.00 0.00 0.00 19.45 19.54 1ub7 n ALA 139 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1ub7 h LEU 140 N 3.40 0.00 -2.83 0.00 3.38 -1.94 -1.66 115.31 115.65 1ub7 h LEU 140 Ca 0.24 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.21 1ub7 h LEU 140 Cb 0.46 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 1ub7 h LEU 140 CO 0.93 0.00 -0.00 0.77 0.09 0.00 0.00 178.44 180.23 1ub7 h SER 141 N 0.00 0.00 1.52 -0.43 4.64 -1.89 -1.11 113.55 116.29 1ub7 h SER 141 Ca 0.28 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.54 1ub7 h SER 141 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.35 1ub7 h SER 141 CO -0.00 0.00 -0.30 0.11 -0.87 0.00 0.00 176.83 175.77 1ub7 h LYS 142 N 0.00 0.00 -0.01 4.77 1.79 -1.72 -3.31 116.57 118.10 1ub7 h LYS 142 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1ub7 h LYS 142 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 1ub7 h LYS 142 CO 0.00 0.30 -0.06 0.44 -1.08 0.00 0.00 179.45 179.04 1ub7 n ILE 143 N -3.22 0.00 -2.47 1.86 -5.35 -0.60 -5.04 119.36 104.55 1ub7 n ILE 143 Ca 0.02 -0.47 -0.34 0.00 -0.27 0.00 0.00 62.75 61.70 1ub7 n ILE 143 Cb 0.61 1.10 -0.03 0.00 -1.74 0.00 0.00 39.64 39.58 1ub7 n ILE 143 CO 0.00 0.00 0.00 -0.51 -1.76 0.00 0.00 176.55 174.28 1ub7 s ILE 144 N -0.75 3.81 -0.72 7.28 2.07 -0.52 -4.55 121.20 127.82 1ub7 s ILE 144 Ca 0.06 1.08 -0.15 0.00 -1.41 0.00 0.00 60.65 60.22 1ub7 s ILE 144 Cb 0.05 -3.45 0.18 0.00 0.13 0.00 0.00 42.46 39.37 1ub7 s ILE 144 CO 0.11 -0.29 0.69 -0.62 -1.91 0.00 0.00 174.94 172.92 1ub7 s ASP 145 N -2.13 6.52 0.58 4.50 2.15 -1.26 -4.94 116.67 122.10 1ub7 s ASP 145 Ca 0.67 -2.26 0.29 0.00 0.43 0.00 0.00 52.55 51.68 1ub7 s ASP 145 Cb -0.16 -2.23 1.42 0.00 -0.30 0.00 0.00 42.92 41.65 1ub7 s ASP 145 CO 0.23 -0.74 1.81 -0.50 -0.17 0.00 0.00 175.17 175.80 1ub7 h TRP 146 N 8.32 0.00 -0.33 -5.34 4.06 -1.94 -0.58 115.95 120.14 1ub7 h TRP 146 Ca -0.06 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.89 1ub7 h TRP 146 Cb 1.06 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.22 1ub7 h TRP 146 CO 0.92 0.00 0.00 0.09 -3.56 0.00 0.00 178.44 175.89 1ub7 n ASN 147 N -3.72 1.80 -4.24 -3.49 5.03 -1.26 -4.69 115.26 104.69 1ub7 n ASN 147 Ca 0.12 -1.98 -0.42 0.00 0.87 0.00 0.00 54.58 53.17 1ub7 n ASN 147 Cb 0.85 -0.22 -0.04 0.00 -1.02 0.00 0.00 39.78 39.35 1ub7 n ASN 147 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 1ub7 s ASP 148 N -1.04 6.35 0.60 6.41 2.15 -0.22 -4.94 116.67 125.98 1ub7 s ASP 148 Ca 0.23 -3.04 0.29 0.00 0.43 0.00 0.00 52.55 50.46 1ub7 s ASP 148 Cb 0.12 -2.07 1.07 0.00 -0.30 0.00 0.00 42.92 41.74 1ub7 s ASP 148 CO 0.16 -0.41 1.42 0.08 -0.17 0.00 0.00 175.17 176.24 1ub7 h ARG 149 N 7.13 0.00 -0.01 4.34 0.11 -1.86 0.94 114.38 125.03 1ub7 h ARG 149 Ca 0.10 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.18 1ub7 h ARG 149 Cb 0.96 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.04 1ub7 h ARG 149 CO 0.80 0.00 -0.21 0.00 0.10 0.00 0.00 179.97 180.66 1ub7 n ALA 150 N -2.32 2.98 0.00 0.08 0.00 -1.26 -4.48 120.51 115.51 1ub7 n ALA 150 Ca 0.23 -0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1ub7 n ALA 150 Cb 1.45 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1ub7 n ALA 150 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ub7 n THR 151 N -0.29 0.00 0.30 0.00 -2.24 0.17 -4.84 114.28 107.37 1ub7 n THR 151 Ca 0.14 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 62.06 1ub7 n THR 151 Cb 0.37 -0.35 0.70 0.00 -2.10 0.00 0.00 70.33 68.95 1ub7 n THR 151 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ub7 h ALA 152 N 0.00 1.54 -0.03 6.98 0.00 -1.32 -0.01 119.26 126.43 1ub7 h ALA 152 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ub7 h ALA 152 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1ub7 h ALA 152 CO 0.00 -0.48 -0.09 1.33 0.00 0.00 0.00 179.25 180.00 1ub7 n VAL 153 N -2.93 0.00 0.09 0.00 0.24 -1.26 -4.51 118.33 109.96 1ub7 n VAL 153 Ca -0.00 -0.45 0.11 0.00 -2.04 0.00 0.00 64.34 61.96 1ub7 n VAL 153 Cb 0.51 1.42 -0.02 0.00 -1.47 0.00 0.00 33.84 34.28 1ub7 n VAL 153 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 1ub7 n LEU 154 N 0.99 0.75 -4.64 1.34 4.77 -0.02 -4.95 117.00 115.24 1ub7 n LEU 154 Ca 0.12 0.29 -0.25 0.00 -0.03 0.00 0.00 56.01 56.14 1ub7 n LEU 154 Cb 0.54 -0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.50 1ub7 n LEU 154 CO 0.17 -0.16 -0.34 -0.36 -1.33 0.00 0.00 177.39 175.37 1ub7 s PHE 155 N -3.37 2.75 0.10 -1.77 0.08 -1.26 -1.36 117.98 113.15 1ub7 s PHE 155 Ca -0.01 -0.19 0.01 0.00 0.12 0.00 0.00 56.93 56.86 1ub7 s PHE 155 Cb 0.10 -1.29 -0.04 0.00 -0.57 0.00 0.00 43.02 41.22 1ub7 s PHE 155 CO 0.80 0.56 -0.04 0.20 -0.10 0.00 0.00 175.22 176.64 1ub7 s GLY 156 N -3.23 0.75 0.20 4.36 0.00 0.10 -4.64 107.32 104.86 1ub7 s GLY 156 Ca 0.29 -1.35 0.02 0.00 0.00 0.00 0.00 44.72 43.68 1ub7 s GLY 156 CO 0.19 -1.42 0.35 0.99 0.00 0.00 0.00 173.10 173.20 1ub7 s ASP 157 N -3.03 6.35 0.00 1.64 1.01 -0.46 -4.11 116.67 118.06 1ub7 s ASP 157 Ca 0.13 0.23 0.00 0.00 0.71 0.00 0.00 52.55 53.62 1ub7 s ASP 157 Cb 0.06 -1.94 0.00 0.00 1.01 0.00 0.00 42.92 42.06 1ub7 s ASP 157 CO -0.05 -0.03 0.00 0.61 0.21 0.00 0.00 175.17 175.92 1ub7 n GLY 158 N -0.85 1.45 3.05 0.21 0.00 -0.88 -4.52 105.19 103.66 1ub7 n GLY 158 Ca -0.07 -0.90 -0.08 0.00 0.00 0.00 0.00 46.02 44.98 1ub7 n GLY 158 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ub7 s GLY 159 N 0.00 0.38 0.08 -0.02 0.00 0.03 -1.34 107.32 106.45 1ub7 s GLY 159 Ca 0.00 -0.97 -0.15 0.00 0.00 0.00 0.00 44.72 43.60 1ub7 s GLY 159 CO 0.00 -1.07 0.35 -0.32 0.00 0.00 0.00 173.10 172.07 1ub7 s GLY 160 N -2.38 -0.19 0.00 0.20 0.00 0.84 -0.76 107.32 105.03 1ub7 s GLY 160 Ca -0.02 0.00 -0.26 0.00 0.00 0.00 0.00 44.72 44.45 1ub7 s GLY 160 CO -0.07 -0.24 0.59 0.00 0.00 0.00 0.00 173.10 173.39 1ub7 s ALA 161 N -3.10 -1.54 0.06 3.20 0.00 0.79 -0.53 121.76 120.65 1ub7 s ALA 161 Ca -0.01 0.95 -0.09 0.00 0.00 0.00 0.00 51.96 52.81 1ub7 s ALA 161 Cb 0.01 0.20 -0.00 0.00 0.00 0.00 0.00 23.12 23.33 1ub7 s ALA 161 CO -0.07 -0.44 0.18 0.00 0.00 0.00 0.00 175.76 175.44 1ub7 s ALA 162 N -1.80 -0.27 -0.15 0.00 0.00 -0.59 -0.88 121.76 118.08 1ub7 s ALA 162 Ca -0.09 -0.44 -0.03 0.00 0.00 0.00 0.00 51.96 51.41 1ub7 s ALA 162 Cb -0.01 0.34 -0.02 0.00 0.00 0.00 0.00 23.12 23.43 1ub7 s ALA 162 CO 0.04 -0.41 -0.06 0.08 0.00 0.00 0.00 175.76 175.41 1ub7 s VAL 163 N -3.02 3.67 -0.14 0.00 1.01 -0.65 -0.66 120.40 120.60 1ub7 s VAL 163 Ca -0.02 -0.44 -0.04 0.00 0.00 0.00 0.00 61.98 61.49 1ub7 s VAL 163 Cb 0.01 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.77 1ub7 s VAL 163 CO -0.06 0.51 -0.02 -0.69 0.00 0.00 0.00 175.10 174.83 1ub7 s VAL 164 N 0.31 4.09 0.13 2.92 1.01 0.82 -0.15 120.40 129.54 1ub7 s VAL 164 Ca -0.05 -0.30 -0.12 0.00 0.00 0.00 0.00 61.98 61.51 1ub7 s VAL 164 Cb -0.15 -2.78 0.04 0.00 0.00 0.00 0.00 36.38 33.49 1ub7 s VAL 164 CO 0.04 0.51 0.56 0.61 0.00 0.00 0.00 175.10 176.83 1ub7 n GLY 165 N 3.21 1.01 3.74 4.51 0.00 -0.81 -0.65 105.19 116.20 1ub7 n GLY 165 Ca -0.17 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.36 1ub7 n GLY 165 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ub7 s LYS 166 N -2.03 4.25 0.17 1.61 2.20 -1.26 -0.44 119.74 124.24 1ub7 s LYS 166 Ca 0.12 2.32 0.08 0.00 -0.36 0.00 0.00 55.97 58.13 1ub7 s LYS 166 Cb -0.02 -3.12 -0.04 0.00 -1.51 0.00 0.00 37.83 33.14 1ub7 s LYS 166 CO 0.04 -0.46 -0.18 0.14 -0.36 0.00 0.00 175.35 174.54 1ub7 s VAL 167 N 0.19 1.79 0.71 4.02 -7.23 -1.26 -4.80 120.40 113.83 1ub7 s VAL 167 Ca 0.61 -1.94 -0.16 0.00 -1.81 0.00 0.00 61.98 58.68 1ub7 s VAL 167 Cb -0.42 -1.85 -0.03 0.00 0.56 0.00 0.00 36.38 34.64 1ub7 s VAL 167 CO 0.41 -0.34 0.67 0.54 -0.31 0.00 0.00 175.10 176.07 1ub7 n ARG 168 N 0.24 0.37 -1.70 4.82 1.74 0.02 -4.81 116.66 117.35 1ub7 n ARG 168 Ca -0.13 0.17 -0.43 0.00 -0.77 0.00 0.00 57.85 56.69 1ub7 n ARG 168 Cb 0.57 -1.95 -0.02 0.00 -1.02 0.00 0.00 32.46 30.05 1ub7 n ARG 168 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1ub7 n GLU 169 N -1.06 2.22 -0.03 5.56 2.13 -1.26 -2.21 120.64 126.00 1ub7 n GLU 169 Ca 0.11 0.78 0.00 0.00 0.66 0.00 0.00 57.16 58.71 1ub7 n GLU 169 Cb 0.50 -2.44 0.00 0.00 0.27 0.00 0.00 31.44 29.76 1ub7 n GLU 169 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ub7 n GLY 170 N 1.58 0.35 3.55 8.31 0.00 -1.26 -5.06 105.19 112.66 1ub7 n GLY 170 Ca 0.08 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.85 1ub7 n GLY 170 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ub7 s TYR 171 N -2.11 2.28 0.00 1.61 1.51 -0.94 -4.92 117.35 114.79 1ub7 s TYR 171 Ca 0.00 -0.79 0.00 0.00 -1.01 0.00 0.00 57.07 55.27 1ub7 s TYR 171 Cb 0.00 -1.56 0.00 0.00 -0.11 0.00 0.00 41.96 40.29 1ub7 s TYR 171 CO 0.00 0.27 0.00 0.41 -1.11 0.00 0.00 175.55 175.12 1ub7 n GLY 172 N -0.84 -1.54 3.74 0.71 0.00 -0.67 -4.77 105.19 101.81 1ub7 n GLY 172 Ca -0.04 -2.07 -0.41 0.00 0.00 0.00 0.00 46.02 43.50 1ub7 n GLY 172 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ub7 s PHE 173 N 0.00 3.41 -0.04 1.61 0.08 0.94 -0.54 117.98 123.44 1ub7 s PHE 173 Ca 0.00 1.46 0.10 0.00 0.12 0.00 0.00 56.93 58.60 1ub7 s PHE 173 Cb 0.00 -3.44 -0.15 0.00 -0.57 0.00 0.00 43.02 38.86 1ub7 s PHE 173 CO 0.00 -1.20 0.16 0.54 -0.10 0.00 0.00 175.22 174.62 1ub7 n ARG 174 N 2.12 1.08 -3.50 0.44 1.74 -0.05 -4.75 116.66 113.73 1ub7 n ARG 174 Ca 0.03 -0.06 -0.12 0.00 -0.77 0.00 0.00 57.85 56.93 1ub7 n ARG 174 Cb 0.44 -1.25 -0.03 0.00 -1.02 0.00 0.00 32.46 30.60 1ub7 n ARG 174 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1ub7 s SER 175 N -3.56 -0.47 -0.00 0.55 1.04 -1.17 -4.47 113.70 105.62 1ub7 s SER 175 Ca -0.04 0.23 0.01 0.00 0.48 0.00 0.00 55.95 56.63 1ub7 s SER 175 Cb 0.05 0.45 -0.00 0.00 0.10 0.00 0.00 66.02 66.62 1ub7 s SER 175 CO 0.42 -0.64 -0.04 -0.36 0.98 0.00 0.00 173.24 173.61 1ub7 s PHE 176 N -2.45 0.32 -0.12 5.02 0.08 -1.26 -1.61 117.98 117.96 1ub7 s PHE 176 Ca -0.01 -0.07 -0.01 0.00 0.12 0.00 0.00 56.93 56.96 1ub7 s PHE 176 Cb -0.01 -0.20 0.04 0.00 -0.57 0.00 0.00 43.02 42.27 1ub7 s PHE 176 CO -0.04 -0.01 -0.02 0.08 -0.10 0.00 0.00 175.22 175.14 1ub7 s VAL 177 N -0.13 0.67 0.01 -0.44 1.01 0.87 -4.97 120.40 117.41 1ub7 s VAL 177 Ca 0.01 -0.22 0.05 0.00 0.00 0.00 0.00 61.98 61.81 1ub7 s VAL 177 Cb -0.02 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 1ub7 s VAL 177 CO -0.00 0.17 -0.14 -0.76 0.00 0.00 0.00 175.10 174.36 1ub7 s LEU 178 N 1.84 2.09 0.21 3.92 1.43 -1.26 -0.40 118.68 126.51 1ub7 s LEU 178 Ca 0.03 -0.35 -0.19 0.00 -1.03 0.00 0.00 54.13 52.58 1ub7 s LEU 178 Cb -0.14 -0.69 0.03 0.00 0.03 0.00 0.00 46.19 45.42 1ub7 s LEU 178 CO -0.07 0.12 0.59 -0.83 0.23 0.00 0.00 176.35 176.39 1ub7 s GLY 179 N -0.71 -0.18 -0.03 -3.19 0.00 -0.45 -5.01 107.32 97.75 1ub7 s GLY 179 Ca 0.04 -0.12 -0.22 0.00 0.00 0.00 0.00 44.72 44.42 1ub7 s GLY 179 CO 0.00 -0.14 0.47 0.00 0.00 0.00 0.00 173.10 173.43 1ub7 s ALA 180 N -3.87 -1.20 -0.38 3.20 0.00 -1.26 -2.02 121.76 116.23 1ub7 s ALA 180 Ca 0.09 0.75 0.02 0.00 0.00 0.00 0.00 51.96 52.82 1ub7 s ALA 180 Cb -0.02 0.04 0.15 0.00 0.00 0.00 0.00 23.12 23.29 1ub7 s ALA 180 CO -0.02 -0.31 0.32 0.34 0.00 0.00 0.00 175.76 176.10 1ub7 s ASP 181 N -1.26 1.76 0.10 0.00 -1.08 0.16 -4.99 116.67 111.35 1ub7 s ASP 181 Ca -0.12 -2.08 0.11 0.00 -0.52 0.00 0.00 52.55 49.93 1ub7 s ASP 181 Cb -0.03 0.09 0.50 0.00 -1.46 0.00 0.00 42.92 42.02 1ub7 s ASP 181 CO 0.07 -0.25 1.33 0.61 0.52 0.00 0.00 175.17 177.44 1ub7 n GLY 182 N 3.86 -0.79 0.00 2.66 0.00 -1.25 -0.38 105.19 109.30 1ub7 n GLY 182 Ca 0.15 0.04 0.09 0.00 0.00 0.00 0.00 46.02 46.30 1ub7 n GLY 182 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ub7 n THR 183 N -1.74 0.58 -0.61 2.61 -2.24 -1.26 -1.61 114.28 110.01 1ub7 n THR 183 Ca 0.01 0.15 0.06 0.00 -2.27 0.00 0.00 64.05 62.00 1ub7 n THR 183 Cb 0.07 -0.82 0.35 0.00 -2.10 0.00 0.00 70.33 67.83 1ub7 n THR 183 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ub7 n GLY 184 N 0.41 2.76 0.21 3.38 0.00 -0.69 -4.50 105.19 106.76 1ub7 n GLY 184 Ca 0.06 -0.79 -0.05 0.00 0.00 0.00 0.00 46.02 45.25 1ub7 n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ub7 h ALA 185 N 3.75 0.66 0.00 4.61 0.00 -1.37 -2.29 119.26 124.62 1ub7 h ALA 185 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ub7 h ALA 185 Cb 1.75 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.44 1ub7 h ALA 185 CO 0.41 -0.04 0.00 1.57 0.00 0.00 0.00 179.25 181.19 1ub7 h LYS 186 N 0.56 0.00 0.00 0.00 2.10 -1.85 -3.07 116.57 114.31 1ub7 h LYS 186 Ca 0.22 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.76 1ub7 h LYS 186 Cb 0.09 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.40 1ub7 h LYS 186 CO -0.13 0.00 -0.52 0.93 -2.00 0.00 0.00 179.45 177.73 1ub7 h GLU 187 N 0.00 0.00 -2.02 0.07 4.39 -1.74 -3.44 114.58 111.83 1ub7 h GLU 187 Ca 0.00 0.00 0.06 0.00 0.34 0.00 0.00 59.36 59.76 1ub7 h GLU 187 Cb 0.28 0.00 -0.21 0.00 -0.10 0.00 0.00 28.75 28.73 1ub7 h GLU 187 CO 0.00 0.52 -0.11 -1.17 -1.16 0.00 0.00 179.01 177.09 1ub7 s LEU 188 N -7.33 -1.08 0.33 1.33 2.96 -1.16 -1.34 118.68 112.39 1ub7 s LEU 188 Ca -0.01 1.54 -0.18 0.00 -0.22 0.00 0.00 54.13 55.27 1ub7 s LEU 188 Cb 0.12 2.28 0.05 0.00 0.50 0.00 0.00 46.19 49.14 1ub7 s LEU 188 CO 0.73 -0.22 0.80 -0.72 -1.32 0.00 0.00 176.35 175.62 1ub7 s TYR 189 N 2.62 0.04 -0.30 5.38 -0.85 -1.12 -4.53 117.35 118.59 1ub7 s TYR 189 Ca -0.07 -0.63 -0.05 0.00 -0.52 0.00 0.00 57.07 55.80 1ub7 s TYR 189 Cb -0.11 0.79 0.19 0.00 0.38 0.00 0.00 41.96 43.22 1ub7 s TYR 189 CO -0.19 -1.41 0.88 -1.58 -1.52 0.00 0.00 175.55 171.73 1ub7 s HIS 190 N -2.69 -0.98 0.86 -3.49 2.46 -1.26 -2.58 115.29 107.61 1ub7 s HIS 190 Ca 0.15 0.64 -0.14 0.00 0.47 0.00 0.00 55.06 56.18 1ub7 s HIS 190 Cb -0.05 0.19 0.02 0.00 -0.13 0.00 0.00 32.58 32.61 1ub7 s HIS 190 CO 0.10 -0.56 0.54 0.00 -2.47 0.00 0.00 174.74 172.34 1ub7 n ALA 191 N 5.26 -1.95 0.00 1.58 0.00 -1.26 -4.98 120.51 119.16 1ub7 n ALA 191 Ca 0.06 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1ub7 n ALA 191 Cb 0.56 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 18.14 1ub7 n ALA 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ub7 n VAL 193 N -2.09 0.00 -4.29 0.00 0.31 -1.26 -5.09 118.33 105.91 1ub7 n VAL 193 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 64.34 64.02 1ub7 n VAL 193 Cb 0.10 -0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 32.93 1ub7 n VAL 193 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ub7 s ALA 194 N -1.07 3.05 -2.63 3.52 0.00 -1.26 -5.02 121.76 118.34 1ub7 s ALA 194 Ca 0.00 -1.14 0.25 0.00 0.00 0.00 0.00 51.96 51.08 1ub7 s ALA 194 Cb 0.00 -1.05 0.68 0.00 0.00 0.00 0.00 23.12 22.76 1ub7 s ALA 194 CO 0.00 0.65 1.54 -0.35 0.00 0.00 0.00 175.76 177.59 1ub7 n PRO 195 N 0.98 1.96 -3.77 0.00 -0.04 -1.26 -4.74 135.00 128.13 1ub7 n PRO 195 Ca -0.13 -1.40 -0.13 0.00 -0.04 0.00 0.00 63.50 61.80 1ub7 n PRO 195 Cb 0.52 -1.47 -0.08 0.00 -0.04 0.00 0.00 33.50 32.43 1ub7 n PRO 195 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1ub7 s ARG 196 N -1.93 0.69 0.33 0.54 1.04 -1.26 -1.53 118.95 116.82 1ub7 s ARG 196 Ca 0.34 -0.30 -0.04 0.00 -1.04 0.00 0.00 55.73 54.70 1ub7 s ARG 196 Cb 0.20 0.30 -0.05 0.00 -2.04 0.00 0.00 34.95 33.37 1ub7 s ARG 196 CO 0.31 -0.20 0.59 -0.51 -0.04 0.00 0.00 175.30 175.45 1ub7 s LEU 197 N -1.54 3.99 0.27 -1.89 1.43 -0.70 -4.95 118.68 115.30 1ub7 s LEU 197 Ca -0.11 0.69 -0.03 0.00 -1.03 0.00 0.00 54.13 53.65 1ub7 s LEU 197 Cb -0.04 -3.53 0.58 0.00 0.03 0.00 0.00 46.19 43.23 1ub7 s LEU 197 CO 0.02 -0.27 1.61 -0.65 0.23 0.00 0.00 176.35 177.29 1ub7 h PRO 198 N 1.27 0.08 0.00 1.29 0.11 -1.98 0.60 132.00 133.37 1ub7 h PRO 198 Ca -0.48 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1ub7 h PRO 198 Cb 1.20 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1ub7 h PRO 198 CO 0.64 0.05 0.00 -0.40 -0.21 0.00 0.00 178.00 178.09 1ub7 n ASP 199 N -5.39 0.00 0.00 -2.05 5.75 -1.26 -4.82 116.55 108.78 1ub7 n ASP 199 Ca 0.18 -0.52 0.00 0.00 -0.01 0.00 0.00 54.79 54.44 1ub7 n ASP 199 Cb 0.60 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.69 1ub7 n ASP 199 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1ub7 n GLY 200 N -0.02 0.46 3.59 6.12 0.00 0.21 -5.02 105.19 110.53 1ub7 n GLY 200 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1ub7 n GLY 200 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ub7 n THR 201 N -2.00 0.27 -1.88 2.61 -1.04 -1.24 -4.66 114.28 106.34 1ub7 n THR 201 Ca 0.00 -0.52 -0.41 0.00 -2.04 0.00 0.00 64.05 61.07 1ub7 n THR 201 Cb 0.00 -2.61 -0.02 0.00 -1.82 0.00 0.00 70.33 65.88 1ub7 n THR 201 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1ub7 s SER 202 N 9.03 6.50 -0.17 8.00 0.15 -1.26 -1.72 113.70 134.22 1ub7 s SER 202 Ca 1.01 2.83 -0.08 0.00 0.70 0.00 0.00 55.95 60.40 1ub7 s SER 202 Cb -0.31 -2.63 -0.04 0.00 -1.71 0.00 0.00 66.02 61.33 1ub7 s SER 202 CO 0.34 -0.82 0.11 -0.04 1.20 0.00 0.00 173.24 174.02 1ub7 s MET 203 N -0.48 3.92 0.98 5.44 -1.94 -0.58 -4.93 119.30 121.71 1ub7 s MET 203 Ca 0.61 -0.25 -0.13 0.00 -1.71 0.00 0.00 55.69 54.21 1ub7 s MET 203 Cb -0.45 -3.28 0.18 0.00 2.01 0.00 0.00 34.83 33.28 1ub7 s MET 203 CO 0.46 0.41 1.13 0.15 -0.01 0.00 0.00 175.02 177.16 1ub7 s LYS 204 N 0.02 0.58 0.38 2.03 3.01 -1.26 -4.85 119.74 119.66 1ub7 s LYS 204 Ca 0.08 0.30 0.08 0.00 -1.01 0.00 0.00 55.97 55.42 1ub7 s LYS 204 Cb -0.12 -1.77 0.76 0.00 -1.01 0.00 0.00 37.83 35.69 1ub7 s LYS 204 CO -0.00 -2.58 1.93 -2.95 0.51 0.00 0.00 175.35 172.27 1ub7 h ASN 205 N -1.77 0.34 -4.41 2.83 -1.07 -1.99 -3.42 115.58 106.08 1ub7 h ASN 205 Ca -0.52 -0.05 -0.30 0.00 0.07 0.00 0.00 56.30 55.50 1ub7 h ASN 205 Cb 1.33 -0.09 -0.04 0.00 -2.07 0.00 0.00 38.32 37.45 1ub7 h ASN 205 CO 0.57 0.42 -0.17 0.54 0.07 0.00 0.00 177.43 178.85 1ub7 n ARG 206 N -4.32 1.20 -1.88 4.14 5.12 -1.26 -4.78 116.66 114.88 1ub7 n ARG 206 Ca 0.00 -1.75 -0.42 0.00 -1.93 0.00 0.00 57.85 53.75 1ub7 n ARG 206 Cb 0.22 0.30 -0.03 0.00 -1.16 0.00 0.00 32.46 31.79 1ub7 n ARG 206 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1ub7 s LEU 207 N 0.00 4.37 0.13 0.55 0.20 -1.26 -4.78 118.68 117.89 1ub7 s LEU 207 Ca 0.10 2.66 0.09 0.00 0.69 0.00 0.00 54.13 57.66 1ub7 s LEU 207 Cb -0.01 -3.59 -0.04 0.00 -0.43 0.00 0.00 46.19 42.12 1ub7 s LEU 207 CO 0.06 -0.87 -0.16 -0.47 -0.29 0.00 0.00 176.35 174.62 1ub7 s TYR 208 N 1.39 2.57 -0.28 5.38 5.04 -1.06 -4.97 117.35 125.40 1ub7 s TYR 208 Ca 0.72 -0.25 -0.01 0.00 -2.44 0.00 0.00 57.07 55.09 1ub7 s TYR 208 Cb -0.45 -1.34 0.17 0.00 0.35 0.00 0.00 41.96 40.70 1ub7 s TYR 208 CO 0.32 0.41 0.54 1.41 -1.34 0.00 0.00 175.55 176.89 1ub7 s MET 209 N -2.26 0.51 -0.82 4.97 -2.45 -1.26 -2.80 119.30 115.18 1ub7 s MET 209 Ca 0.19 0.85 -0.25 0.00 -1.25 0.00 0.00 55.69 55.24 1ub7 s MET 209 Cb -0.10 0.25 -0.00 0.00 1.25 0.00 0.00 34.83 36.23 1ub7 s MET 209 CO 0.11 -0.64 1.69 1.21 1.05 0.00 0.00 175.02 178.44 1ub7 s ASN 210 N 2.77 5.66 0.29 1.11 3.84 -0.45 -4.86 114.94 123.30 1ub7 s ASN 210 Ca 0.18 -0.55 -0.03 0.00 0.21 0.00 0.00 52.86 52.68 1ub7 s ASN 210 Cb -0.15 -2.55 0.42 0.00 -0.55 0.00 0.00 41.25 38.41 1ub7 s ASN 210 CO -0.20 -2.21 1.96 1.23 -2.79 0.00 0.00 177.10 175.09 1ub7 h GLY 211 N 15.48 1.19 0.98 1.21 0.00 -1.98 -2.80 103.07 117.16 1ub7 h GLY 211 Ca -0.04 -0.45 -0.03 0.00 0.00 0.00 0.00 47.33 46.81 1ub7 h GLY 211 CO 1.27 0.44 0.23 3.21 0.00 0.00 0.00 176.54 181.69 1ub7 h ARG 212 N 1.15 0.77 0.21 4.80 3.08 -1.99 -2.52 114.38 119.88 1ub7 h ARG 212 Ca 0.31 -0.13 -0.01 0.00 0.07 0.00 0.00 59.98 60.22 1ub7 h ARG 212 Cb -0.12 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 29.80 1ub7 h ARG 212 CO -0.07 0.67 -0.10 0.93 -1.07 0.00 0.00 179.97 180.33 1ub7 h GLU 213 N 0.71 -0.27 -0.13 0.04 4.39 -1.96 -2.59 114.58 114.77 1ub7 h GLU 213 Ca 0.18 0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.93 1ub7 h GLU 213 Cb 0.17 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1ub7 h GLU 213 CO -0.02 0.10 0.33 0.28 -1.16 0.00 0.00 179.01 178.55 1ub7 h VAL 214 N -0.72 0.15 0.01 3.13 2.07 -1.52 -1.30 116.25 118.07 1ub7 h VAL 214 Ca -0.03 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.49 1ub7 h VAL 214 Cb 0.49 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1ub7 h VAL 214 CO 0.05 0.00 -0.01 0.15 0.02 0.00 0.00 177.57 177.78 1ub7 h PHE 215 N 0.00 -0.01 -0.33 1.57 3.04 -1.32 -2.52 116.94 117.37 1ub7 h PHE 215 Ca 0.06 -0.00 0.07 0.00 3.98 0.00 0.00 57.97 62.08 1ub7 h PHE 215 Cb 0.72 0.00 -0.08 0.00 2.56 0.00 0.00 35.95 39.15 1ub7 h PHE 215 CO 0.00 0.21 -0.34 0.87 -2.02 0.00 0.00 178.31 177.03 1ub7 h LYS 216 N -1.00 -0.29 -0.46 1.11 1.57 -0.98 -1.31 116.57 115.21 1ub7 h LYS 216 Ca -0.00 0.02 0.09 0.00 -1.87 0.00 0.00 60.65 58.89 1ub7 h LYS 216 Cb 0.23 0.07 -0.08 0.00 0.08 0.00 0.00 32.23 32.53 1ub7 h LYS 216 CO 0.00 -0.19 -0.00 0.35 -0.57 0.00 0.00 179.45 179.04 1ub7 h PHE 217 N -0.30 -0.03 0.28 -1.35 3.57 -1.42 -2.15 116.94 115.55 1ub7 h PHE 217 Ca 0.15 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.69 1ub7 h PHE 217 Cb 0.55 0.08 -0.03 0.00 2.79 0.00 0.00 35.95 39.34 1ub7 h PHE 217 CO -0.52 -0.10 -0.39 0.00 -2.23 0.00 0.00 178.31 175.07 1ub7 h ALA 218 N 1.41 -0.78 -0.38 2.41 0.00 -0.79 0.18 119.26 121.30 1ub7 h ALA 218 Ca 0.23 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1ub7 h ALA 218 Cb 0.34 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1ub7 h ALA 218 CO -0.38 -0.99 0.15 0.28 0.00 0.00 0.00 179.25 178.31 1ub7 h VAL 219 N -0.73 1.15 0.40 0.00 2.07 -1.28 -0.54 116.25 117.33 1ub7 h VAL 219 Ca -0.01 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 1ub7 h VAL 219 Cb 0.69 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1ub7 h VAL 219 CO -0.13 0.18 -0.19 -0.09 0.02 0.00 0.00 177.57 177.36 1ub7 h ARG 220 N 0.53 -0.52 -0.61 1.57 2.43 -0.90 -3.18 114.38 113.70 1ub7 h ARG 220 Ca 0.13 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 1ub7 h ARG 220 Cb 0.11 0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 1ub7 h ARG 220 CO -0.01 -0.35 0.35 -0.24 -1.51 0.00 0.00 179.97 178.21 1ub7 h VAL 221 N -0.72 1.18 -0.49 0.20 3.04 -0.61 -2.70 116.25 116.14 1ub7 h VAL 221 Ca -0.06 -0.43 0.10 0.00 -1.01 0.00 0.00 66.70 65.30 1ub7 h VAL 221 Cb 0.42 0.34 -0.08 0.00 -2.01 0.00 0.00 31.29 29.95 1ub7 h VAL 221 CO 0.09 0.20 -0.01 0.24 -1.01 0.00 0.00 177.57 177.08 1ub7 h MET 222 N 0.85 0.10 0.03 4.17 2.86 -1.17 0.53 114.93 122.29 1ub7 h MET 222 Ca 0.22 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.85 1ub7 h MET 222 Cb -0.00 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.64 1ub7 h MET 222 CO -0.04 0.07 -0.01 -0.91 1.06 0.00 0.00 176.91 177.07 1ub7 h ASN 223 N 0.10 -0.03 -0.11 1.22 2.35 -1.49 -0.60 115.58 117.01 1ub7 h ASN 223 Ca 0.25 -0.48 0.02 0.00 -0.55 0.00 0.00 56.30 55.54 1ub7 h ASN 223 Cb 0.37 0.01 -0.02 0.00 0.05 0.00 0.00 38.32 38.73 1ub7 h ASN 223 CO -0.42 0.48 -0.04 0.74 -1.65 0.00 0.00 177.43 176.53 1ub7 h THR 224 N -0.56 0.85 -0.45 2.81 2.02 -1.18 0.21 112.91 116.61 1ub7 h THR 224 Ca -0.00 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 1ub7 h THR 224 Cb 0.52 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 1ub7 h THR 224 CO 0.01 0.00 0.26 0.00 0.37 0.00 0.00 175.52 176.16 1ub7 h ALA 225 N 1.08 0.58 0.07 6.16 0.00 -0.01 -0.73 119.26 126.40 1ub7 h ALA 225 Ca 0.06 -0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.91 1ub7 h ALA 225 Cb 0.11 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1ub7 h ALA 225 CO -0.13 0.08 -0.10 1.15 0.00 0.00 0.00 179.25 180.25 1ub7 h THR 226 N 0.60 0.75 -0.87 0.00 2.02 -0.58 0.11 112.91 114.94 1ub7 h THR 226 Ca 0.16 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.33 1ub7 h THR 226 Cb 0.02 0.75 -0.04 0.00 -1.74 0.00 0.00 68.15 67.14 1ub7 h THR 226 CO -0.03 0.00 0.49 -0.07 0.37 0.00 0.00 175.52 176.28 1ub7 h LEU 227 N -0.21 1.08 -0.11 2.58 3.38 -0.47 0.08 115.31 121.64 1ub7 h LEU 227 Ca 0.02 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.89 1ub7 h LEU 227 Cb 0.22 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1ub7 h LEU 227 CO -0.06 0.87 0.05 -0.08 0.09 0.00 0.00 178.44 179.31 1ub7 h GLU 228 N 1.22 0.16 -0.51 1.13 4.81 -0.86 -0.22 114.58 120.31 1ub7 h GLU 228 Ca 0.31 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.53 1ub7 h GLU 228 Cb 0.02 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.34 1ub7 h GLU 228 CO -0.05 0.23 0.31 0.00 -0.73 0.00 0.00 179.01 178.77 1ub7 h ALA 229 N 0.93 0.65 -0.58 2.92 0.00 -0.38 0.49 119.26 123.29 1ub7 h ALA 229 Ca 0.04 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1ub7 h ALA 229 Cb 0.12 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1ub7 h ALA 229 CO -0.00 0.02 0.33 0.82 0.00 0.00 0.00 179.25 180.41 1ub7 h ILE 230 N 0.62 1.18 -0.14 0.00 2.04 -0.73 -1.27 117.51 119.22 1ub7 h ILE 230 Ca 0.20 -0.45 -0.02 0.00 1.00 0.00 0.00 64.86 65.59 1ub7 h ILE 230 Cb -0.00 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 1ub7 h ILE 230 CO -0.08 0.20 -0.01 -0.08 0.00 0.00 0.00 178.15 178.18 1ub7 h GLU 231 N 0.78 0.25 -0.53 2.37 4.22 -0.66 -2.12 114.58 118.90 1ub7 h GLU 231 Ca 0.20 -0.08 0.13 0.00 0.08 0.00 0.00 59.36 59.69 1ub7 h GLU 231 Cb 0.03 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1ub7 h GLU 231 CO -0.03 0.50 0.37 -0.22 -2.18 0.00 0.00 179.01 177.44 1ub7 h LYS 232 N -0.02 0.14 -0.00 1.92 3.64 0.21 0.43 116.57 122.89 1ub7 h LYS 232 Ca 0.04 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1ub7 h LYS 232 Cb 0.39 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1ub7 h LYS 232 CO 0.01 0.09 -0.03 0.00 -2.27 0.00 0.00 179.45 177.25 1ub7 n ALA 233 N -2.59 2.57 -2.78 5.00 0.00 -0.50 -4.84 120.51 117.37 1ub7 n ALA 233 Ca 0.09 -0.18 -0.06 0.00 0.00 0.00 0.00 53.44 53.29 1ub7 n ALA 233 Cb 0.50 -1.45 0.02 0.00 0.00 0.00 0.00 19.45 18.51 1ub7 n ALA 233 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ub7 n GLY 234 N 1.27 0.54 3.35 0.00 0.00 0.15 -4.96 105.19 105.54 1ub7 n GLY 234 Ca 0.15 -0.42 -0.21 0.00 0.00 0.00 0.00 46.02 45.53 1ub7 n GLY 234 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ub7 s LEU 235 N -2.73 1.81 0.13 0.99 1.43 -0.82 -5.05 118.68 114.45 1ub7 s LEU 235 Ca 0.15 -1.75 0.07 0.00 -1.03 0.00 0.00 54.13 51.57 1ub7 s LEU 235 Cb -0.07 0.40 -0.04 0.00 0.03 0.00 0.00 46.19 46.51 1ub7 s LEU 235 CO 0.20 -1.04 -0.16 0.42 0.23 0.00 0.00 176.35 176.00 1ub7 s THR 236 N -3.37 1.51 0.40 5.49 -4.23 -1.26 -3.98 115.64 110.20 1ub7 s THR 236 Ca 0.36 -1.76 0.25 0.00 -1.18 0.00 0.00 61.69 59.37 1ub7 s THR 236 Cb 0.02 -1.62 0.42 0.00 1.34 0.00 0.00 72.50 72.66 1ub7 s THR 236 CO 0.24 -0.35 1.60 -0.65 -0.54 0.00 0.00 174.62 174.92 1ub7 h PRO 237 N 3.50 0.05 -0.03 3.99 0.11 -1.96 0.45 132.00 138.11 1ub7 h PRO 237 Ca -0.41 -0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.70 1ub7 h PRO 237 Cb 1.20 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1ub7 h PRO 237 CO 0.50 0.03 0.04 0.93 -0.21 0.00 0.00 178.00 179.29 1ub7 h GLU 238 N 0.05 0.00 0.00 1.05 3.07 -1.99 -1.81 114.58 114.96 1ub7 h GLU 238 Ca 0.84 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.70 1ub7 h GLU 238 Cb 2.42 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.33 1ub7 h GLU 238 CO -0.60 0.00 -0.04 -0.25 -1.40 0.00 0.00 179.01 176.72 1ub7 n ASP 239 N -3.66 0.22 -4.71 1.42 8.00 0.16 -4.84 116.55 113.15 1ub7 n ASP 239 Ca -0.02 0.47 -0.41 0.00 0.71 0.00 0.00 54.79 55.54 1ub7 n ASP 239 Cb 0.12 -0.52 -0.04 0.00 -0.02 0.00 0.00 41.12 40.66 1ub7 n ASP 239 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ub7 s ILE 240 N -3.03 4.97 0.00 0.53 -1.09 -0.68 -4.43 121.20 117.48 1ub7 s ILE 240 Ca 0.13 1.66 -0.13 0.00 -2.23 0.00 0.00 60.65 60.08 1ub7 s ILE 240 Cb 0.17 -4.14 -0.33 0.00 -1.58 0.00 0.00 42.46 36.58 1ub7 s ILE 240 CO 0.56 0.19 0.87 -0.09 -1.23 0.00 0.00 174.94 175.24 1ub7 h ARG 241 N 6.85 0.46 -3.36 2.79 9.65 -1.19 -3.47 114.38 126.11 1ub7 h ARG 241 Ca -0.39 -0.78 -0.20 0.00 -1.10 0.00 0.00 59.98 57.51 1ub7 h ARG 241 Cb 1.19 0.29 -0.27 0.00 -1.39 0.00 0.00 29.97 29.79 1ub7 h ARG 241 CO 0.76 1.37 -0.55 -1.17 2.80 0.00 0.00 179.97 183.18 1ub7 s LEU 242 N -7.42 1.34 -0.22 3.80 2.96 -1.24 -4.76 118.68 113.14 1ub7 s LEU 242 Ca -0.11 0.30 -0.08 0.00 -0.22 0.00 0.00 54.13 54.02 1ub7 s LEU 242 Cb 0.05 0.48 -0.04 0.00 0.50 0.00 0.00 46.19 47.19 1ub7 s LEU 242 CO 0.90 -0.06 0.08 -0.36 -1.32 0.00 0.00 176.35 175.59 1ub7 s PHE 243 N 0.24 3.18 -0.50 5.38 0.40 0.97 -1.66 117.98 126.00 1ub7 s PHE 243 Ca -0.01 -0.10 0.04 0.00 -0.60 0.00 0.00 56.93 56.25 1ub7 s PHE 243 Cb -0.03 -2.16 0.13 0.00 0.51 0.00 0.00 43.02 41.47 1ub7 s PHE 243 CO -0.01 -0.06 0.25 0.08 0.70 0.00 0.00 175.22 176.18 1ub7 s VAL 244 N 0.96 2.30 0.48 -0.44 1.01 0.13 -0.84 120.40 124.00 1ub7 s VAL 244 Ca 0.04 -3.12 -0.05 0.00 0.00 0.00 0.00 61.98 58.85 1ub7 s VAL 244 Cb -0.14 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.60 1ub7 s VAL 244 CO 0.03 -0.82 0.79 -2.16 0.00 0.00 0.00 175.10 172.95 1ub7 s PRO 245 N -0.11 3.55 0.37 2.72 0.04 -1.26 -2.62 135.00 137.68 1ub7 s PRO 245 Ca 0.17 0.22 -0.28 0.00 0.04 0.00 0.00 61.00 61.15 1ub7 s PRO 245 Cb -0.25 -2.37 -0.11 0.00 0.04 0.00 0.00 34.50 31.81 1ub7 s PRO 245 CO -0.00 -0.21 1.48 1.58 0.04 0.00 0.00 177.00 179.88 1ub7 n HIS 246 N -2.26 2.94 -2.99 0.56 -0.00 0.10 -4.78 115.22 108.79 1ub7 n HIS 246 Ca 0.01 0.45 -0.44 0.00 -0.00 0.00 0.00 57.72 57.74 1ub7 n HIS 246 Cb 0.55 -2.53 0.00 0.00 -0.00 0.00 0.00 29.99 28.02 1ub7 n HIS 246 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.34 177.38 1ub7 n GLN 247 N 0.50 3.60 -0.09 1.57 1.13 -1.26 -4.73 117.38 118.11 1ub7 n GLN 247 Ca 0.02 -4.09 -0.12 0.00 -1.94 0.00 0.00 57.00 50.87 1ub7 n GLN 247 Cb 0.39 -2.80 -0.09 0.00 0.11 0.00 0.00 30.24 27.85 1ub7 n GLN 247 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ub7 n ALA 248 N 3.88 1.61 -3.66 -1.58 0.00 -1.26 -3.60 120.51 115.91 1ub7 n ALA 248 Ca 0.32 -0.80 -0.06 0.00 0.00 0.00 0.00 53.44 52.90 1ub7 n ALA 248 Cb 0.39 0.06 -0.07 0.00 0.00 0.00 0.00 19.45 19.83 1ub7 n ALA 248 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1ub7 s ASN 249 N -5.63 -0.77 0.54 0.00 3.84 -1.26 -4.64 114.94 107.02 1ub7 s ASN 249 Ca -0.22 1.30 0.21 0.00 0.21 0.00 0.00 52.86 54.36 1ub7 s ASN 249 Cb 0.06 1.57 1.45 0.00 -0.55 0.00 0.00 41.25 43.78 1ub7 s ASN 249 CO 0.44 -0.22 2.18 0.25 -2.79 0.00 0.00 177.10 176.96 1ub7 h LEU 250 N 7.63 0.00 -0.01 3.21 5.85 -1.32 -1.38 115.31 129.30 1ub7 h LEU 250 Ca -0.24 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 1ub7 h LEU 250 Cb 1.15 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.18 1ub7 h LEU 250 CO 0.15 0.01 -0.00 0.03 -0.34 0.00 0.00 178.44 178.29 1ub7 h ARG 251 N 0.00 0.01 -0.69 1.25 3.08 -1.85 0.30 114.38 116.48 1ub7 h ARG 251 Ca -0.00 -0.01 0.06 0.00 0.07 0.00 0.00 59.98 60.10 1ub7 h ARG 251 Cb 0.02 -0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.02 1ub7 h ARG 251 CO 0.00 0.47 0.38 0.82 -1.07 0.00 0.00 179.97 180.57 1ub7 h ILE 252 N -0.44 0.96 0.02 2.04 2.04 -1.83 0.80 117.51 121.11 1ub7 h ILE 252 Ca 0.00 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.62 1ub7 h ILE 252 Cb 0.46 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.74 1ub7 h ILE 252 CO 0.00 0.13 -0.01 0.40 0.00 0.00 0.00 178.15 178.67 1ub7 h ILE 253 N 0.70 1.05 -0.67 -0.67 2.04 -1.18 0.12 117.51 118.90 1ub7 h ILE 253 Ca 0.31 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.91 1ub7 h ILE 253 Cb 0.20 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.45 1ub7 h ILE 253 CO -0.19 0.06 0.28 -0.78 0.00 0.00 0.00 178.15 177.51 1ub7 h ASP 254 N -0.13 0.91 0.13 1.72 3.58 0.14 0.83 116.42 123.61 1ub7 h ASP 254 Ca -0.00 -0.16 0.00 0.00 0.42 0.00 0.00 57.03 57.28 1ub7 h ASP 254 Cb 0.12 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.92 1ub7 h ASP 254 CO 0.01 0.83 -0.11 0.00 -2.88 0.00 0.00 179.24 177.08 1ub7 h ALA 255 N 1.12 -0.23 -0.70 -0.78 0.00 0.89 -2.11 119.26 117.45 1ub7 h ALA 255 Ca 0.22 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1ub7 h ALA 255 Cb 0.19 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1ub7 h ALA 255 CO -0.02 -0.64 0.40 0.00 0.00 0.00 0.00 179.25 178.99 1ub7 h ALA 256 N 0.60 0.89 -0.20 0.00 0.00 -0.60 -2.36 119.26 117.59 1ub7 h ALA 256 Ca 0.00 -0.10 0.06 0.00 0.00 0.00 0.00 54.91 54.87 1ub7 h ALA 256 Cb 0.24 -0.28 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 1ub7 h ALA 256 CO -0.02 0.38 -0.23 -0.09 0.00 0.00 0.00 179.25 179.29 1ub7 h ARG 257 N 0.95 -0.25 -0.49 0.00 2.43 -0.55 -2.12 114.38 114.35 1ub7 h ARG 257 Ca 0.25 0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.41 1ub7 h ARG 257 Cb 0.00 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.59 1ub7 h ARG 257 CO -0.04 -0.17 0.22 0.93 -1.51 0.00 0.00 179.97 179.40 1ub7 h GLU 258 N -0.26 0.72 -1.10 0.20 5.08 -1.28 -1.86 114.58 116.08 1ub7 h GLU 258 Ca 0.12 -0.12 0.30 0.00 -1.00 0.00 0.00 59.36 58.66 1ub7 h GLU 258 Cb 0.45 -0.12 -0.08 0.00 0.50 0.00 0.00 28.75 29.50 1ub7 h GLU 258 CO -0.35 0.62 0.74 -0.09 -1.00 0.00 0.00 179.01 178.93 1ub7 h ARG 259 N 0.65 0.22 -0.02 2.33 1.12 -0.85 1.13 114.38 118.96 1ub7 h ARG 259 Ca 0.17 -0.01 0.00 0.00 -1.11 0.00 0.00 59.98 59.02 1ub7 h ARG 259 Cb 0.16 -0.05 0.00 0.00 -0.01 0.00 0.00 29.97 30.07 1ub7 h ARG 259 CO -0.02 0.15 -0.18 1.28 -3.11 0.00 0.00 179.97 178.09 1ub7 n LEU 260 N -4.47 1.91 -2.76 3.80 4.77 -0.83 -4.97 117.00 114.46 1ub7 n LEU 260 Ca 0.26 -0.64 -0.15 0.00 -0.03 0.00 0.00 56.01 55.45 1ub7 n LEU 260 Cb 1.03 -0.03 0.06 0.00 -2.33 0.00 0.00 43.42 42.15 1ub7 n LEU 260 CO 0.31 0.33 0.14 0.61 -1.33 0.00 0.00 177.39 177.45 1ub7 n GLY 261 N 1.32 -0.14 3.62 -0.72 0.00 0.39 -5.02 105.19 104.64 1ub7 n GLY 261 Ca 0.14 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1ub7 n GLY 261 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ub7 s LEU 262 N -5.40 3.31 0.52 0.99 1.43 -0.77 -5.02 118.68 113.73 1ub7 s LEU 262 Ca 0.24 0.03 -0.14 0.00 -1.03 0.00 0.00 54.13 53.22 1ub7 s LEU 262 Cb -0.11 -1.75 -0.07 0.00 0.03 0.00 0.00 46.19 44.30 1ub7 s LEU 262 CO 0.53 0.36 0.96 -2.16 0.23 0.00 0.00 176.35 176.27 1ub7 s PRO 263 N -0.88 3.85 0.41 1.29 0.04 -1.26 -4.60 135.00 133.85 1ub7 s PRO 263 Ca 0.13 0.84 0.14 0.00 0.04 0.00 0.00 61.00 62.15 1ub7 s PRO 263 Cb -0.11 -2.16 1.00 0.00 0.04 0.00 0.00 34.50 33.27 1ub7 s PRO 263 CO 0.02 -0.30 1.91 -1.49 0.04 0.00 0.00 177.00 177.18 1ub7 h TRP 264 N 0.71 0.56 -0.10 0.56 4.06 -1.99 -1.78 115.95 117.98 1ub7 h TRP 264 Ca -0.46 0.02 0.03 0.00 2.06 0.00 0.00 58.89 60.53 1ub7 h TRP 264 Cb 1.19 -0.18 -0.00 0.00 -1.00 0.00 0.00 29.16 29.17 1ub7 h TRP 264 CO 0.64 0.21 0.41 0.93 -3.56 0.00 0.00 178.44 177.07 1ub7 h GLU 265 N 0.48 0.00 -0.54 0.49 3.07 -2.01 0.16 114.58 116.23 1ub7 h GLU 265 Ca 0.39 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 1ub7 h GLU 265 Cb 0.83 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.74 1ub7 h GLU 265 CO -0.14 0.00 0.00 0.54 -1.40 0.00 0.00 179.01 178.01 1ub7 n ARG 266 N -3.04 2.60 -5.15 2.33 1.74 -0.67 -4.91 116.66 109.57 1ub7 n ARG 266 Ca 0.00 -2.39 -0.32 0.00 -0.77 0.00 0.00 57.85 54.37 1ub7 n ARG 266 Cb 0.49 -1.49 -0.16 0.00 -1.02 0.00 0.00 32.46 30.28 1ub7 n ARG 266 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1ub7 s VAL 267 N -1.14 2.28 -0.15 1.55 1.01 0.56 -0.02 120.40 124.48 1ub7 s VAL 267 Ca 0.40 -0.96 -0.20 0.00 0.00 0.00 0.00 61.98 61.22 1ub7 s VAL 267 Cb 0.22 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 1ub7 s VAL 267 CO 0.29 0.56 0.58 0.00 0.00 0.00 0.00 175.10 176.53 1ub7 s ALA 268 N 0.08 3.49 -0.06 5.51 0.00 -0.02 -4.92 121.76 125.84 1ub7 s ALA 268 Ca -0.10 -0.19 0.01 0.00 0.00 0.00 0.00 51.96 51.68 1ub7 s ALA 268 Cb -0.16 -2.85 0.02 0.00 0.00 0.00 0.00 23.12 20.13 1ub7 s ALA 268 CO 0.06 -0.30 -0.08 0.08 0.00 0.00 0.00 175.76 175.52 1ub7 s VAL 269 N 1.30 0.83 0.00 0.00 1.01 -1.26 -4.54 120.40 117.74 1ub7 s VAL 269 Ca 0.29 -0.29 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1ub7 s VAL 269 Cb -0.16 -0.80 0.00 0.00 0.00 0.00 0.00 36.38 35.42 1ub7 s VAL 269 CO 0.12 0.29 0.49 -0.46 0.00 0.00 0.00 175.10 175.54 1ub7 n ASN 270 N 4.02 0.00 0.18 3.32 2.04 -1.26 -4.90 115.26 118.65 1ub7 n ASN 270 Ca -0.23 -1.16 0.06 0.00 -0.44 0.00 0.00 54.58 52.82 1ub7 n ASN 270 Cb 0.51 -0.03 0.55 0.00 -2.53 0.00 0.00 39.78 38.28 1ub7 n ASN 270 CO 0.00 0.00 0.00 1.62 -0.44 0.00 0.00 177.26 178.44 1ub7 h VAL 271 N 3.71 1.06 0.00 3.53 3.04 -1.87 -2.44 116.25 123.29 1ub7 h VAL 271 Ca 0.00 -0.20 -0.01 0.00 -1.01 0.00 0.00 66.70 65.48 1ub7 h VAL 271 Cb 1.06 0.95 -0.00 0.00 -2.01 0.00 0.00 31.29 31.29 1ub7 h VAL 271 CO 0.00 0.07 -0.04 -2.24 -1.01 0.00 0.00 177.57 174.35 1ub7 h ASP 272 N 0.15 0.00 0.00 3.17 2.03 -1.87 -0.37 116.42 119.53 1ub7 h ASP 272 Ca 0.04 0.00 -0.15 0.00 -0.73 0.00 0.00 57.03 56.19 1ub7 h ASP 272 Cb 0.06 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.54 1ub7 h ASP 272 CO -0.00 0.04 -1.70 0.54 -1.03 0.00 0.00 179.24 177.09 1ub7 n ARG 273 N -3.17 1.78 0.00 4.15 1.74 -1.01 -0.85 116.66 119.30 1ub7 n ARG 273 Ca -0.00 -0.03 0.04 0.00 -0.77 0.00 0.00 57.85 57.09 1ub7 n ARG 273 Cb 0.29 -1.28 0.02 0.00 -1.02 0.00 0.00 32.46 30.47 1ub7 n ARG 273 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1ub7 n TYR 274 N -2.28 0.00 -4.85 -1.55 4.01 -0.95 -2.47 117.16 109.07 1ub7 n TYR 274 Ca -0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.60 1ub7 n TYR 274 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.75 1ub7 n TYR 274 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ub7 n GLY 275 N 0.59 -0.21 3.59 2.72 0.00 -0.15 -3.76 105.19 107.97 1ub7 n GLY 275 Ca 0.04 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 1ub7 n GLY 275 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ub7 s ASN 276 N -4.00 6.58 -0.22 1.61 3.84 -0.46 -4.62 114.94 117.66 1ub7 s ASN 276 Ca 0.00 0.41 0.15 0.00 0.21 0.00 0.00 52.86 53.62 1ub7 s ASN 276 Cb 0.00 -2.41 0.59 0.00 -0.55 0.00 0.00 41.25 38.88 1ub7 s ASN 276 CO 0.00 -0.76 1.52 0.35 -2.79 0.00 0.00 177.10 175.42 1ub7 n THR 277 N 5.82 2.47 0.00 -5.21 -2.24 -1.26 0.02 114.28 113.88 1ub7 n THR 277 Ca 0.04 -1.91 0.00 0.00 -2.27 0.00 0.00 64.05 59.91 1ub7 n THR 277 Cb 0.48 -0.28 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 1ub7 n THR 277 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ub7 n SER 278 N -0.42 0.00 0.31 3.42 2.88 -1.26 -1.50 113.62 117.05 1ub7 n SER 278 Ca 0.26 0.00 0.19 0.00 -1.33 0.00 0.00 58.87 58.00 1ub7 n SER 278 Cb 1.01 0.00 1.01 0.00 -0.75 0.00 0.00 64.21 65.49 1ub7 n SER 278 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1ub7 h THR 279 N 0.00 0.15 0.00 2.46 1.35 -1.89 -0.20 112.91 114.78 1ub7 h THR 279 Ca 0.00 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.68 1ub7 h THR 279 Cb 0.00 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 67.57 1ub7 h THR 279 CO 0.00 0.02 -0.11 0.00 -0.25 0.00 0.00 175.52 175.18 1ub7 h ALA 280 N 1.98 0.93 -0.30 6.62 0.00 -1.34 -3.39 119.26 123.76 1ub7 h ALA 280 Ca -0.00 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1ub7 h ALA 280 Cb 0.15 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 1ub7 h ALA 280 CO 0.00 0.00 -0.25 1.03 0.00 0.00 0.00 179.25 180.03 1ub7 h SER 281 N 0.00 -0.81 -0.26 0.00 0.87 -1.04 -2.56 113.55 109.76 1ub7 h SER 281 Ca 0.00 0.15 -0.11 0.00 -1.23 0.00 0.00 61.79 60.60 1ub7 h SER 281 Cb 0.76 0.39 -0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1ub7 h SER 281 CO 0.00 -0.28 -0.26 0.40 -0.53 0.00 0.00 176.83 176.16 1ub7 h ILE 282 N -0.23 1.31 -0.40 2.23 2.04 -1.77 -2.56 117.51 118.13 1ub7 h ILE 282 Ca 0.15 -1.43 -0.03 0.00 1.00 0.00 0.00 64.86 64.56 1ub7 h ILE 282 Cb 0.47 1.65 -0.02 0.00 -0.74 0.00 0.00 36.82 38.18 1ub7 h ILE 282 CO -0.43 0.45 0.13 1.55 0.00 0.00 0.00 178.15 179.85 1ub7 h PRO 283 N 0.35 0.58 0.27 2.37 0.13 -1.78 0.86 132.00 134.77 1ub7 h PRO 283 Ca 0.04 -0.08 -0.01 0.00 -0.87 0.00 0.00 66.00 65.07 1ub7 h PRO 283 Cb 0.82 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1ub7 h PRO 283 CO 0.06 0.51 -0.13 -0.07 -0.23 0.00 0.00 178.00 178.14 1ub7 h LEU 284 N 0.57 -0.31 -0.71 1.56 3.38 -1.43 0.45 115.31 118.81 1ub7 h LEU 284 Ca 0.14 -0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1ub7 h LEU 284 Cb 0.16 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1ub7 h LEU 284 CO -0.01 -0.10 0.45 0.00 0.09 0.00 0.00 178.44 178.87 1ub7 h ALA 285 N 0.18 0.94 -0.40 1.53 0.00 -1.20 -2.29 119.26 118.01 1ub7 h ALA 285 Ca -0.04 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ub7 h ALA 285 Cb 0.38 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1ub7 h ALA 285 CO 0.06 0.22 0.25 -0.07 0.00 0.00 0.00 179.25 179.71 1ub7 h LEU 286 N 0.87 0.48 -0.55 0.00 3.38 -0.64 -1.40 115.31 117.44 1ub7 h LEU 286 Ca 0.29 -0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.27 1ub7 h LEU 286 Cb 0.03 -0.12 -0.05 0.00 0.09 0.00 0.00 40.66 40.60 1ub7 h LEU 286 CO -0.11 0.38 0.26 0.50 0.09 0.00 0.00 178.44 179.55 1ub7 h LYS 287 N 0.53 0.47 -0.51 1.13 3.64 -0.42 -0.47 116.57 120.94 1ub7 h LYS 287 Ca 0.14 -0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 1ub7 h LYS 287 Cb -0.01 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.68 1ub7 h LYS 287 CO -0.03 0.31 -0.01 0.93 -2.27 0.00 0.00 179.45 178.38 1ub7 h GLU 288 N 0.49 0.87 -0.48 1.90 5.08 -1.18 -1.68 114.58 119.57 1ub7 h GLU 288 Ca 0.25 -0.25 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 1ub7 h GLU 288 Cb 0.21 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 1ub7 h GLU 288 CO -0.20 0.87 0.21 0.00 -1.00 0.00 0.00 179.01 178.89 1ub7 h ALA 289 N 1.18 0.62 -0.56 3.43 0.00 -0.54 1.00 119.26 124.40 1ub7 h ALA 289 Ca 0.15 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1ub7 h ALA 289 Cb 0.50 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1ub7 h ALA 289 CO 0.02 0.21 0.26 0.28 0.00 0.00 0.00 179.25 180.03 1ub7 h VAL 290 N 0.63 1.21 -0.00 0.00 2.07 -0.89 0.18 116.25 119.45 1ub7 h VAL 290 Ca 0.16 -0.59 -0.12 0.00 0.82 0.00 0.00 66.70 66.97 1ub7 h VAL 290 Cb 0.16 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1ub7 h VAL 290 CO -0.02 0.24 -0.57 0.44 0.02 0.00 0.00 177.57 177.68 1ub7 h ASP 291 N 0.75 0.00 -0.06 0.57 3.32 -0.97 -2.27 116.42 117.77 1ub7 h ASP 291 Ca 0.19 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1ub7 h ASP 291 Cb 0.13 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 1ub7 h ASP 291 CO -0.02 0.57 0.00 0.00 -1.72 0.00 0.00 179.24 178.07 1ub7 n ALA 292 N -2.43 2.58 -1.10 3.45 0.00 0.32 -4.88 120.51 118.45 1ub7 n ALA 292 Ca -0.01 -0.25 -0.03 0.00 0.00 0.00 0.00 53.44 53.14 1ub7 n ALA 292 Cb 0.58 -1.22 -0.01 0.00 0.00 0.00 0.00 19.45 18.79 1ub7 n ALA 292 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ub7 n GLY 293 N 0.90 0.59 0.24 0.00 0.00 -0.85 -4.89 105.19 101.18 1ub7 n GLY 293 Ca 0.15 -0.26 0.14 0.00 0.00 0.00 0.00 46.02 46.04 1ub7 n GLY 293 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ub7 h ARG 294 N 0.36 0.00 -4.59 1.61 3.08 -0.88 -3.43 114.38 110.53 1ub7 h ARG 294 Ca -0.07 0.00 -0.50 0.00 0.07 0.00 0.00 59.98 59.48 1ub7 h ARG 294 Cb 0.46 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 30.18 1ub7 h ARG 294 CO 0.10 0.06 -0.81 0.42 -1.07 0.00 0.00 179.97 178.67 1ub7 s ILE 295 N -3.46 1.07 0.22 2.04 1.01 -1.18 -4.85 121.20 116.04 1ub7 s ILE 295 Ca 0.03 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.23 1ub7 s ILE 295 Cb 0.08 -0.97 -0.05 0.00 0.01 0.00 0.00 42.46 41.53 1ub7 s ILE 295 CO 0.61 0.33 0.08 -0.13 0.00 0.00 0.00 174.94 175.84 1ub7 s ARG 296 N 0.54 1.26 0.04 2.79 0.52 -1.26 -4.63 118.95 118.21 1ub7 s ARG 296 Ca -0.11 -1.66 -0.37 0.00 -0.52 0.00 0.00 55.73 53.07 1ub7 s ARG 296 Cb -0.14 -0.10 -0.16 0.00 0.52 0.00 0.00 34.95 35.07 1ub7 s ARG 296 CO 0.03 -0.28 1.41 -1.91 0.02 0.00 0.00 175.30 174.57 1ub7 n GLU 297 N -0.34 1.22 -0.03 3.54 2.13 -1.26 -1.20 120.64 124.70 1ub7 n GLU 297 Ca -0.01 0.44 0.00 0.00 0.66 0.00 0.00 57.16 58.25 1ub7 n GLU 297 Cb 0.65 -2.10 0.00 0.00 0.27 0.00 0.00 31.44 30.26 1ub7 n GLU 297 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ub7 n GLY 298 N 2.81 1.08 3.80 8.31 0.00 0.27 -4.97 105.19 116.49 1ub7 n GLY 298 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 1ub7 n GLY 298 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ub7 s ASP 299 N -2.76 6.58 -0.30 1.61 1.01 -0.34 -4.71 116.67 117.76 1ub7 s ASP 299 Ca 0.00 1.87 -0.13 0.00 0.71 0.00 0.00 52.55 54.99 1ub7 s ASP 299 Cb 0.00 -2.56 -0.03 0.00 1.01 0.00 0.00 42.92 41.34 1ub7 s ASP 299 CO 0.00 -0.61 0.28 -1.00 0.21 0.00 0.00 175.17 174.05 1ub7 s HIS 300 N -2.00 3.23 -0.06 4.23 3.76 -1.26 0.35 115.29 123.53 1ub7 s HIS 300 Ca 0.64 0.13 0.01 0.00 -0.15 0.00 0.00 55.06 55.69 1ub7 s HIS 300 Cb -0.15 -2.50 -0.03 0.00 1.11 0.00 0.00 32.58 31.01 1ub7 s HIS 300 CO 0.19 -0.26 -0.06 0.08 -0.85 0.00 0.00 174.74 173.84 1ub7 s VAL 301 N 1.89 3.81 -0.17 -0.90 1.01 0.14 -0.62 120.40 125.55 1ub7 s VAL 301 Ca 0.10 -0.47 -0.03 0.00 0.00 0.00 0.00 61.98 61.58 1ub7 s VAL 301 Cb -0.16 -2.58 -0.02 0.00 0.00 0.00 0.00 36.38 33.62 1ub7 s VAL 301 CO 0.11 0.57 -0.07 -0.22 0.00 0.00 0.00 175.10 175.50 1ub7 s LEU 302 N -0.90 2.95 -0.09 3.92 2.96 -0.66 -0.58 118.68 126.28 1ub7 s LEU 302 Ca 0.13 -0.29 0.01 0.00 -0.22 0.00 0.00 54.13 53.76 1ub7 s LEU 302 Cb -0.11 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.84 1ub7 s LEU 302 CO 0.02 0.09 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.28 1ub7 s LEU 303 N 0.80 2.89 -0.11 -0.68 1.43 0.53 0.17 118.68 123.71 1ub7 s LEU 303 Ca -0.02 -0.19 -0.08 0.00 -1.03 0.00 0.00 54.13 52.81 1ub7 s LEU 303 Cb -0.15 -1.63 0.04 0.00 0.03 0.00 0.00 46.19 44.48 1ub7 s LEU 303 CO 0.01 0.27 0.28 0.54 0.23 0.00 0.00 176.35 177.68 1ub7 s VAL 304 N -0.25 -0.02 0.04 -1.59 0.11 -1.08 0.20 120.40 117.82 1ub7 s VAL 304 Ca 0.02 0.08 -0.04 0.00 -2.93 0.00 0.00 61.98 59.11 1ub7 s VAL 304 Cb -0.13 -0.41 -0.02 0.00 -1.53 0.00 0.00 36.38 34.29 1ub7 s VAL 304 CO 0.03 0.03 0.06 -0.55 -3.33 0.00 0.00 175.10 171.34 1ub7 s SER 305 N 0.80 0.26 0.03 3.54 0.15 0.16 -0.72 113.70 117.90 1ub7 s SER 305 Ca -0.05 -0.66 -0.08 0.00 0.70 0.00 0.00 55.95 55.86 1ub7 s SER 305 Cb -0.06 0.22 -0.00 0.00 -1.71 0.00 0.00 66.02 64.46 1ub7 s SER 305 CO -0.05 -0.54 0.15 0.72 1.20 0.00 0.00 173.24 174.72 1ub7 s PHE 306 N -2.97 0.09 -0.41 3.44 -0.12 -1.26 0.15 117.98 116.90 1ub7 s PHE 306 Ca -0.02 -0.28 0.00 0.00 -0.05 0.00 0.00 56.93 56.58 1ub7 s PHE 306 Cb 0.01 -0.07 0.00 0.00 -0.63 0.00 0.00 43.02 42.33 1ub7 s PHE 306 CO -0.06 -0.36 0.00 0.41 -0.05 0.00 0.00 175.22 175.15 1ub7 n GLY 307 N 0.98 -0.72 3.75 1.99 0.00 0.51 -4.51 105.19 107.19 1ub7 n GLY 307 Ca -0.20 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 1ub7 n GLY 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ub7 n ALA 308 N 0.00 2.59 0.00 4.61 0.00 -1.26 -1.36 120.51 125.09 1ub7 n ALA 308 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1ub7 n ALA 308 Cb 0.00 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 16.98 1ub7 n ALA 308 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ub7 n GLY 309 N 2.19 0.39 3.78 0.00 0.00 -1.26 -3.20 105.19 107.08 1ub7 n GLY 309 Ca 0.09 0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.88 1ub7 n GLY 309 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ub7 s LEU 310 N 0.00 3.78 0.12 0.99 1.43 0.49 -3.66 118.68 121.84 1ub7 s LEU 310 Ca 0.00 2.15 0.05 0.00 -1.03 0.00 0.00 54.13 55.29 1ub7 s LEU 310 Cb 0.00 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.62 1ub7 s LEU 310 CO 0.00 -1.13 -0.11 -0.89 0.23 0.00 0.00 176.35 174.44 1ub7 s THR 311 N -1.79 1.12 -0.10 5.49 2.01 -0.46 -0.67 115.64 121.24 1ub7 s THR 311 Ca 0.71 -1.82 -0.25 0.00 0.31 0.00 0.00 61.69 60.64 1ub7 s THR 311 Cb -0.23 -1.58 0.06 0.00 0.01 0.00 0.00 72.50 70.76 1ub7 s THR 311 CO 0.26 -0.59 0.60 -1.66 -0.69 0.00 0.00 174.62 172.54 1ub7 s TRP 312 N -2.70 -0.59 0.09 4.92 -2.14 -0.86 -0.36 118.94 117.30 1ub7 s TRP 312 Ca 0.10 1.16 -0.14 0.00 2.66 0.00 0.00 56.10 59.89 1ub7 s TRP 312 Cb -0.01 0.30 0.02 0.00 -3.10 0.00 0.00 33.47 30.68 1ub7 s TRP 312 CO 0.01 -0.49 0.33 0.00 -2.66 0.00 0.00 176.95 174.15 1ub7 s ALA 313 N -0.73 -0.72 -0.01 2.67 0.00 0.12 -1.35 121.76 121.75 1ub7 s ALA 313 Ca -0.08 -0.13 -0.25 0.00 0.00 0.00 0.00 51.96 51.50 1ub7 s ALA 313 Cb -0.02 0.53 0.06 0.00 0.00 0.00 0.00 23.12 23.68 1ub7 s ALA 313 CO 0.06 -0.54 0.56 0.00 0.00 0.00 0.00 175.76 175.83 1ub7 s ALA 314 N -3.42 -1.44 0.08 0.00 0.00 0.46 0.36 121.76 117.81 1ub7 s ALA 314 Ca 0.01 0.89 -0.15 0.00 0.00 0.00 0.00 51.96 52.71 1ub7 s ALA 314 Cb 0.02 0.15 0.03 0.00 0.00 0.00 0.00 23.12 23.31 1ub7 s ALA 314 CO -0.09 -0.40 0.35 0.00 0.00 0.00 0.00 175.76 175.62 1ub7 s ALA 315 N -1.64 -0.78 -0.09 0.00 0.00 0.13 -0.09 121.76 119.30 1ub7 s ALA 315 Ca -0.10 -0.05 0.03 0.00 0.00 0.00 0.00 51.96 51.84 1ub7 s ALA 315 Cb -0.01 0.50 0.01 0.00 0.00 0.00 0.00 23.12 23.62 1ub7 s ALA 315 CO 0.05 -0.53 -0.16 0.08 0.00 0.00 0.00 175.76 175.20 1ub7 s VAL 316 N -3.25 1.49 -0.05 0.00 1.01 -0.63 -0.35 120.40 118.62 1ub7 s VAL 316 Ca -0.00 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.31 1ub7 s VAL 316 Cb 0.01 -1.34 0.02 0.00 0.00 0.00 0.00 36.38 35.07 1ub7 s VAL 316 CO -0.08 0.44 -0.06 -0.22 0.00 0.00 0.00 175.10 175.18 1ub7 s LEU 317 N 0.66 1.36 -0.51 3.92 2.96 0.26 -0.88 118.68 126.46 1ub7 s LEU 317 Ca -0.14 -0.17 -0.23 0.00 -0.22 0.00 0.00 54.13 53.37 1ub7 s LEU 317 Cb -0.16 -0.55 0.04 0.00 0.50 0.00 0.00 46.19 46.01 1ub7 s LEU 317 CO 0.04 -0.04 0.83 -0.89 -1.32 0.00 0.00 176.35 174.97 1ub7 s THR 318 N 0.94 4.57 0.54 3.68 2.01 0.30 0.24 115.64 127.92 1ub7 s THR 318 Ca -0.11 0.21 -0.20 0.00 0.31 0.00 0.00 61.69 61.90 1ub7 s THR 318 Cb -0.14 -4.42 -0.08 0.00 0.01 0.00 0.00 72.50 67.87 1ub7 s THR 318 CO 0.00 -0.92 0.83 1.87 -0.69 0.00 0.00 174.62 175.72 1ub7 n TRP 319 N 6.97 0.42 -3.06 4.92 -0.00 0.15 -1.68 117.44 125.17 1ub7 n TRP 319 Ca 0.01 0.47 0.00 0.00 -0.00 0.00 0.00 57.50 57.98 1ub7 n TRP 319 Cb 0.47 -2.10 0.00 0.00 -0.00 0.00 0.00 31.31 29.68 1ub7 n TRP 319 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1ub7 n GLY 320 N 1.43 -0.48 1.06 5.87 0.00 -1.26 -0.57 105.19 111.24 1ub7 n GLY 320 Ca 0.12 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.83 1ub7 n GLY 320 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ub7 n GLY 321 N 0.00 0.82 0.00 -0.02 0.00 -1.26 -4.41 105.19 100.31 1ub7 n GLY 321 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 1ub7 n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32