#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 2.34 3.58 5.00 0.00 0.14 -0.70 105.19 115.55 1ub7 n GLY 3 Ca 0.00 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.08 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 5.01 -0.23 -0.61 1.01 -1.26 -1.93 121.20 120.49 1ub7 s ILE 4 Ca 0.21 0.60 0.21 0.00 0.00 0.00 0.00 60.65 61.67 1ub7 s ILE 4 Cb -0.01 -3.93 0.01 0.00 0.01 0.00 0.00 42.46 38.54 1ub7 s ILE 4 CO 0.15 -0.12 1.07 -0.07 0.00 0.00 0.00 174.94 175.97 1ub7 h LEU 5 N 9.03 0.00 -7.00 2.97 3.38 -1.58 -3.42 115.31 118.69 1ub7 h LEU 5 Ca -0.28 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.64 1ub7 h LEU 5 Cb 1.13 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.68 1ub7 h LEU 5 CO 0.76 0.10 0.18 0.00 0.09 0.00 0.00 178.44 179.58 1ub7 s ALA 6 N -3.27 -1.77 0.02 1.53 0.00 -1.24 -4.95 121.76 112.08 1ub7 s ALA 6 Ca -0.00 1.47 0.02 0.00 0.00 0.00 0.00 51.96 53.46 1ub7 s ALA 6 Cb 0.09 -0.26 -0.01 0.00 0.00 0.00 0.00 23.12 22.93 1ub7 s ALA 6 CO 0.78 -0.36 -0.07 -1.17 0.00 0.00 0.00 175.76 174.94 1ub7 s LEU 7 N -0.85 2.14 0.03 0.00 2.96 -1.26 -1.83 118.68 119.87 1ub7 s LEU 7 Ca -0.09 -0.34 -0.20 0.00 -0.22 0.00 0.00 54.13 53.29 1ub7 s LEU 7 Cb -0.01 -0.25 0.04 0.00 0.50 0.00 0.00 46.19 46.47 1ub7 s LEU 7 CO 0.08 -0.06 0.45 -0.83 -1.32 0.00 0.00 176.35 174.67 1ub7 s GLY 8 N -0.88 -0.33 0.25 7.98 0.00 0.00 -4.35 107.32 109.99 1ub7 s GLY 8 Ca -0.04 0.46 -0.18 0.00 0.00 0.00 0.00 44.72 44.96 1ub7 s GLY 8 CO 0.00 0.19 0.61 0.00 0.00 0.00 0.00 173.10 173.90 1ub7 s ALA 9 N -2.28 -0.88 -0.21 3.20 0.00 -1.25 0.03 121.76 120.38 1ub7 s ALA 9 Ca -0.06 -0.46 -0.28 0.00 0.00 0.00 0.00 51.96 51.16 1ub7 s ALA 9 Cb -0.01 0.92 0.12 0.00 0.00 0.00 0.00 23.12 24.15 1ub7 s ALA 9 CO -0.01 -0.94 0.98 -0.47 0.00 0.00 0.00 175.76 175.33 1ub7 s TYR 10 N -3.94 -0.44 0.09 0.00 5.04 0.20 -4.65 117.35 113.65 1ub7 s TYR 10 Ca 0.14 0.92 0.06 0.00 -2.44 0.00 0.00 57.07 55.75 1ub7 s TYR 10 Cb -0.03 0.41 -0.03 0.00 0.35 0.00 0.00 41.96 42.65 1ub7 s TYR 10 CO 0.06 -0.31 -0.16 0.14 -1.34 0.00 0.00 175.55 173.94 1ub7 s VAL 11 N -0.51 1.32 0.84 3.14 -7.23 -1.26 -0.57 120.40 116.13 1ub7 s VAL 11 Ca -0.00 -1.48 -0.11 0.00 -1.81 0.00 0.00 61.98 58.58 1ub7 s VAL 11 Cb -0.02 -1.32 0.10 0.00 0.56 0.00 0.00 36.38 35.70 1ub7 s VAL 11 CO -0.01 -0.24 1.10 -2.84 -0.31 0.00 0.00 175.10 172.81 1ub7 s PRO 12 N -2.04 1.65 0.05 4.82 0.02 -1.26 -4.98 135.00 133.27 1ub7 s PRO 12 Ca 0.03 1.22 -0.21 0.00 0.02 0.00 0.00 61.00 62.06 1ub7 s PRO 12 Cb -0.09 -1.82 -0.13 0.00 0.02 0.00 0.00 34.50 32.48 1ub7 s PRO 12 CO 0.03 -2.08 1.46 1.49 -0.33 0.00 0.00 177.00 177.57 1ub7 h GLU 13 N -1.45 0.28 -6.40 5.54 4.81 -1.99 -3.43 114.58 111.93 1ub7 h GLU 13 Ca -0.45 -0.10 -0.53 0.00 -0.13 0.00 0.00 59.36 58.15 1ub7 h GLU 13 Cb 1.25 -0.02 0.02 0.00 0.63 0.00 0.00 28.75 30.63 1ub7 h GLU 13 CO 0.49 0.53 1.12 0.50 -0.73 0.00 0.00 179.01 180.92 1ub7 s ARG 14 N -4.85 4.16 0.17 1.92 3.52 -1.26 -4.92 118.95 117.70 1ub7 s ARG 14 Ca -0.14 2.47 -0.04 0.00 -0.13 0.00 0.00 55.73 57.89 1ub7 s ARG 14 Cb 0.06 -3.85 -0.05 0.00 -1.56 0.00 0.00 34.95 29.54 1ub7 s ARG 14 CO 0.72 -0.85 0.40 0.08 -0.81 0.00 0.00 175.30 174.84 1ub7 s VAL 15 N 3.50 5.16 -0.18 7.11 1.01 -1.26 -1.45 120.40 134.30 1ub7 s VAL 15 Ca 0.80 -0.07 -0.03 0.00 0.00 0.00 0.00 61.98 62.68 1ub7 s VAL 15 Cb -0.41 -3.66 0.06 0.00 0.00 0.00 0.00 36.38 32.36 1ub7 s VAL 15 CO 0.36 -0.06 0.04 -0.32 0.00 0.00 0.00 175.10 175.12 1ub7 s MET 16 N -2.94 0.53 0.53 2.72 1.75 -0.27 -4.93 119.30 116.70 1ub7 s MET 16 Ca 0.41 -0.32 -0.05 0.00 -1.25 0.00 0.00 55.69 54.48 1ub7 s MET 16 Cb -0.12 -1.99 -0.01 0.00 2.84 0.00 0.00 34.83 35.56 1ub7 s MET 16 CO 0.26 -0.63 0.82 0.95 -0.65 0.00 0.00 175.02 175.78 1ub7 s THR 17 N 1.92 4.17 0.43 10.11 -4.23 -1.26 -2.52 115.64 124.26 1ub7 s THR 17 Ca -0.00 -0.01 0.10 0.00 -1.18 0.00 0.00 61.69 60.60 1ub7 s THR 17 Cb -0.17 -3.61 0.28 0.00 1.34 0.00 0.00 72.50 70.35 1ub7 s THR 17 CO -0.08 -0.58 2.06 0.78 -0.54 0.00 0.00 174.62 176.26 1ub7 h ASN 18 N 0.06 0.38 -0.55 3.99 2.35 -1.81 -1.54 115.58 118.46 1ub7 h ASN 18 Ca -0.46 -0.01 0.09 0.00 -0.55 0.00 0.00 56.30 55.38 1ub7 h ASN 18 Cb 1.24 -0.09 -0.07 0.00 0.05 0.00 0.00 38.32 39.44 1ub7 h ASN 18 CO 0.60 0.27 0.14 0.00 -1.65 0.00 0.00 177.43 176.79 1ub7 h ALA 19 N 1.77 0.66 -0.08 -0.83 0.00 -1.92 0.15 119.26 119.00 1ub7 h ALA 19 Ca 0.15 0.10 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1ub7 h ALA 19 Cb 0.07 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ub7 h ALA 19 CO -0.04 -0.27 0.12 -0.44 0.00 0.00 0.00 179.25 178.62 1ub7 h ASP 20 N 0.29 0.00 0.19 0.00 3.32 -1.65 -2.39 116.42 116.18 1ub7 h ASP 20 Ca 0.28 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 57.07 1ub7 h ASP 20 Cb 0.37 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.95 1ub7 h ASP 20 CO -0.34 0.00 -1.19 -0.26 -1.72 0.00 0.00 179.24 175.74 1ub7 h PHE 21 N 0.00 0.72 -0.18 4.55 0.04 -0.71 -3.24 116.94 118.11 1ub7 h PHE 21 Ca 0.04 -0.52 -0.01 0.00 2.80 0.00 0.00 57.97 60.28 1ub7 h PHE 21 Cb 0.28 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.39 1ub7 h PHE 21 CO 0.00 1.46 0.08 0.93 -0.60 0.00 0.00 178.31 180.18 1ub7 h GLU 22 N -0.14 0.25 0.00 1.51 5.08 -0.96 -0.69 114.58 119.62 1ub7 h GLU 22 Ca -0.22 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1ub7 h GLU 22 Cb 1.89 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 31.08 1ub7 h GLU 22 CO 0.19 0.20 0.00 0.00 -1.00 0.00 0.00 179.01 178.40 1ub7 n ALA 23 N -2.51 1.36 -1.64 3.43 0.00 -0.95 -3.19 120.51 117.02 1ub7 n ALA 23 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ub7 n ALA 23 Cb 0.11 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.59 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 -1.08 0.00 -4.07 0.00 4.11 -0.81 -5.11 117.16 110.20 1ub7 n TYR 24 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.90 57.83 1ub7 n TYR 24 Cb 0.00 0.12 -0.10 0.00 -0.00 0.00 0.00 39.34 39.37 1ub7 n TYR 24 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1ub7 s LEU 25 N 0.00 2.29 -1.22 -3.48 1.43 -0.33 -5.07 118.68 112.30 1ub7 s LEU 25 Ca 0.00 -0.97 -0.11 0.00 -1.03 0.00 0.00 54.13 52.02 1ub7 s LEU 25 Cb 0.00 0.32 0.19 0.00 0.03 0.00 0.00 46.19 46.73 1ub7 s LEU 25 CO 0.00 -0.63 1.57 -0.67 0.23 0.00 0.00 176.35 176.85 1ub7 n ASP 26 N 0.07 5.30 -3.75 2.29 2.03 -1.26 -4.44 116.55 116.79 1ub7 n ASP 26 Ca -0.13 -3.06 -0.12 0.00 0.52 0.00 0.00 54.79 51.99 1ub7 n ASP 26 Cb 0.61 -1.50 -0.07 0.00 -0.72 0.00 0.00 41.12 39.44 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 0.55 0.08 0.06 5.18 -1.32 -1.26 -5.07 115.64 113.85 1ub7 s THR 27 Ca 0.40 -0.62 0.09 0.00 -1.21 0.00 0.00 61.69 60.35 1ub7 s THR 27 Cb 0.01 -0.88 -0.03 0.00 -1.51 0.00 0.00 72.50 70.09 1ub7 s THR 27 CO 0.00 -0.34 -0.26 -0.94 -2.21 0.00 0.00 174.62 170.88 1ub7 s SER 28 N -1.92 3.26 0.29 8.08 1.04 -1.26 -4.21 113.70 118.99 1ub7 s SER 28 Ca -0.07 -0.60 0.04 0.00 0.48 0.00 0.00 55.95 55.81 1ub7 s SER 28 Cb -0.02 -0.31 0.73 0.00 0.10 0.00 0.00 66.02 66.52 1ub7 s SER 28 CO -0.02 0.25 1.71 -0.78 0.98 0.00 0.00 173.24 175.38 1ub7 h ASP 29 N 4.61 0.43 -0.77 7.02 3.58 -1.98 0.40 116.42 129.71 1ub7 h ASP 29 Ca -0.47 0.14 -0.05 0.00 0.42 0.00 0.00 57.03 57.06 1ub7 h ASP 29 Cb 1.15 0.09 -0.03 0.00 1.72 0.00 0.00 39.33 42.26 1ub7 h ASP 29 CO 0.43 0.06 0.27 -0.08 -2.88 0.00 0.00 179.24 177.04 1ub7 h GLU 30 N 0.47 1.18 0.05 0.28 4.81 -1.98 -0.45 114.58 118.94 1ub7 h GLU 30 Ca 0.56 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.55 1ub7 h GLU 30 Cb 1.03 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.23 1ub7 h GLU 30 CO -0.49 0.98 -0.02 2.35 -0.73 0.00 0.00 179.01 181.09 1ub7 h TRP 31 N 1.14 -0.06 -0.17 0.92 -0.00 -0.69 0.13 115.95 117.22 1ub7 h TRP 31 Ca 0.25 -0.00 -0.00 0.00 -0.00 0.00 0.00 58.89 59.14 1ub7 h TRP 31 Cb 0.27 0.02 -0.01 0.00 -0.00 0.00 0.00 29.16 29.44 1ub7 h TRP 31 CO 0.02 0.06 0.09 0.82 -0.00 0.00 0.00 178.44 179.43 1ub7 h ILE 32 N -0.17 1.12 -0.58 2.65 2.04 -0.96 0.19 117.51 121.79 1ub7 h ILE 32 Ca -0.01 -0.33 -0.09 0.00 1.00 0.00 0.00 64.86 65.44 1ub7 h ILE 32 Cb 0.15 1.03 -0.02 0.00 -0.74 0.00 0.00 36.82 37.23 1ub7 h ILE 32 CO 0.01 0.11 0.02 0.58 0.00 0.00 0.00 178.15 178.87 1ub7 h VAL 33 N 0.16 1.26 -0.22 1.67 2.07 -1.06 0.13 116.25 120.26 1ub7 h VAL 33 Ca 0.06 -1.10 -0.04 0.00 0.82 0.00 0.00 66.70 66.44 1ub7 h VAL 33 Cb 0.10 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 1ub7 h VAL 33 CO -0.01 0.40 -0.02 0.71 0.02 0.00 0.00 177.57 178.67 1ub7 h THR 34 N 0.92 1.27 0.03 2.57 1.35 -0.80 -0.99 112.91 117.26 1ub7 h THR 34 Ca 0.17 -0.94 -0.22 0.00 -0.55 0.00 0.00 66.41 64.87 1ub7 h THR 34 Cb 0.51 1.45 -0.01 0.00 -1.73 0.00 0.00 68.15 68.38 1ub7 h THR 34 CO 0.03 0.29 -0.97 0.03 -0.25 0.00 0.00 175.52 174.64 1ub7 h ARG 35 N 0.15 0.25 0.00 4.72 2.47 -0.87 -3.41 114.38 117.68 1ub7 h ARG 35 Ca 0.06 -0.30 0.00 0.00 -1.26 0.00 0.00 59.98 58.48 1ub7 h ARG 35 Cb 0.44 0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.85 1ub7 h ARG 35 CO 0.01 1.05 -0.75 0.25 0.56 0.00 0.00 179.97 181.09 1ub7 n THR 36 N -3.63 0.00 -0.28 2.04 -2.24 0.43 -4.69 114.28 105.90 1ub7 n THR 36 Ca -0.05 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.73 1ub7 n THR 36 Cb 0.87 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 68.54 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 2.30 0.65 3.73 3.38 0.00 -0.37 -0.03 105.19 114.83 1ub7 n GLY 37 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.57 4.77 -0.07 -0.61 1.01 -1.26 -4.23 121.20 118.25 1ub7 s ILE 38 Ca 0.00 1.82 0.04 0.00 0.00 0.00 0.00 60.65 62.50 1ub7 s ILE 38 Cb 0.00 -4.21 -0.07 0.00 0.01 0.00 0.00 42.46 38.20 1ub7 s ILE 38 CO 0.00 0.28 -0.02 0.29 0.00 0.00 0.00 174.94 175.49 1ub7 n LYS 39 N 3.28 1.84 -4.17 2.79 5.02 -0.21 -3.95 118.16 122.76 1ub7 n LYS 39 Ca 0.01 0.02 -0.13 0.00 -2.02 0.00 0.00 58.31 56.19 1ub7 n LYS 39 Cb 0.50 -1.16 -0.08 0.00 -0.02 0.00 0.00 35.03 34.27 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 -2.16 1.39 -0.06 1.97 2.02 -0.25 -2.41 118.70 119.20 1ub7 s GLU 40 Ca -0.06 -1.63 -0.29 0.00 0.02 0.00 0.00 54.97 53.01 1ub7 s GLU 40 Cb 0.02 0.33 0.10 0.00 0.10 0.00 0.00 34.13 34.68 1ub7 s GLU 40 CO 0.23 -0.50 0.88 -0.98 0.02 0.00 0.00 175.26 174.91 1ub7 s ARG 41 N -3.95 0.80 0.14 1.61 1.70 -1.05 -2.88 118.95 115.33 1ub7 s ARG 41 Ca 0.36 -0.06 0.04 0.00 -0.47 0.00 0.00 55.73 55.60 1ub7 s ARG 41 Cb 0.04 0.37 -0.04 0.00 -0.57 0.00 0.00 34.95 34.76 1ub7 s ARG 41 CO 0.14 -0.30 0.16 1.03 -1.08 0.00 0.00 175.30 175.25 1ub7 s ARG 42 N -2.12 3.03 -0.06 3.89 1.81 -1.26 -1.11 118.95 123.13 1ub7 s ARG 42 Ca -0.00 -0.77 0.02 0.00 -1.72 0.00 0.00 55.73 53.26 1ub7 s ARG 42 Cb -0.01 -2.74 0.01 0.00 -0.45 0.00 0.00 34.95 31.77 1ub7 s ARG 42 CO -0.02 0.51 -0.10 0.08 -0.68 0.00 0.00 175.30 175.08 1ub7 s VAL 43 N -1.69 0.97 0.62 3.52 1.01 -0.52 -1.72 120.40 122.59 1ub7 s VAL 43 Ca 0.32 -0.39 -0.18 0.00 0.00 0.00 0.00 61.98 61.73 1ub7 s VAL 43 Cb -0.11 -0.90 -0.02 0.00 0.00 0.00 0.00 36.38 35.35 1ub7 s VAL 43 CO 0.24 0.32 1.21 0.00 0.00 0.00 0.00 175.10 176.87 1ub7 s ALA 44 N 0.69 2.46 1.17 5.51 0.00 -1.26 -4.03 121.76 126.30 1ub7 s ALA 44 Ca -0.13 0.97 -0.15 0.00 0.00 0.00 0.00 51.96 52.65 1ub7 s ALA 44 Cb -0.15 -3.45 0.27 0.00 0.00 0.00 0.00 23.12 19.79 1ub7 s ALA 44 CO 0.03 -1.31 1.04 0.00 0.00 0.00 0.00 175.76 175.52 1ub7 s ALA 45 N -1.69 -0.02 0.22 0.00 0.00 -1.26 -4.87 121.76 114.13 1ub7 s ALA 45 Ca 0.77 -0.43 -0.08 0.00 0.00 0.00 0.00 51.96 52.21 1ub7 s ALA 45 Cb -0.30 -3.11 0.30 0.00 0.00 0.00 0.00 23.12 20.01 1ub7 s ALA 45 CO 0.36 -3.67 1.76 1.49 0.00 0.00 0.00 175.76 175.70 1ub7 h GLU 46 N -2.55 0.50 -0.87 0.00 4.22 -2.05 -2.50 114.58 111.32 1ub7 h GLU 46 Ca -0.55 -0.03 -0.60 0.00 0.08 0.00 0.00 59.36 58.25 1ub7 h GLU 46 Cb 1.33 -0.11 -0.37 0.00 0.50 0.00 0.00 28.75 30.10 1ub7 h GLU 46 CO 0.48 0.33 -0.15 -0.40 -2.18 0.00 0.00 179.01 177.09 1ub7 n ASP 47 N -4.92 6.03 -4.03 1.04 5.75 -1.26 -4.90 116.55 114.25 1ub7 n ASP 47 Ca 0.10 -3.77 -0.31 0.00 -0.01 0.00 0.00 54.79 50.80 1ub7 n ASP 47 Cb 0.27 -0.60 -0.15 0.00 -1.03 0.00 0.00 41.12 39.61 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 -3.69 2.03 0.16 0.11 2.12 -0.94 -5.05 118.70 113.44 1ub7 s GLU 48 Ca 0.56 -1.27 0.01 0.00 0.36 0.00 0.00 54.97 54.63 1ub7 s GLU 48 Cb 0.45 -2.81 0.01 0.00 0.26 0.00 0.00 34.13 32.04 1ub7 s GLU 48 CO 0.01 -0.60 0.10 0.66 -0.54 0.00 0.00 175.26 174.90 1ub7 n TYR 49 N 4.49 -0.98 -0.24 5.30 4.02 -1.26 -4.39 117.16 124.10 1ub7 n TYR 49 Ca -0.13 -0.70 0.03 0.00 -0.01 0.00 0.00 57.90 57.10 1ub7 n TYR 49 Cb 0.43 -0.13 0.16 0.00 -0.02 0.00 0.00 39.34 39.78 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 0.63 0.73 -0.92 -0.72 2.02 -1.92 -0.12 112.91 112.61 1ub7 h THR 50 Ca -0.11 -0.16 0.05 0.00 0.77 0.00 0.00 66.41 66.96 1ub7 h THR 50 Cb 0.38 0.21 -0.06 0.00 -1.74 0.00 0.00 68.15 66.94 1ub7 h THR 50 CO 0.17 0.09 0.59 0.77 0.37 0.00 0.00 175.52 177.51 1ub7 h SER 51 N 0.47 0.96 -0.41 4.18 4.64 -1.94 -0.77 113.55 120.67 1ub7 h SER 51 Ca 0.38 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.68 1ub7 h SER 51 Cb 0.51 -0.20 -0.02 0.00 -0.31 0.00 0.00 62.40 62.38 1ub7 h SER 51 CO -0.35 0.63 0.19 0.44 -0.87 0.00 0.00 176.83 176.87 1ub7 h ASP 52 N 1.10 0.55 -0.84 4.97 3.32 -1.43 -0.24 116.42 123.85 1ub7 h ASP 52 Ca 0.39 -0.14 0.01 0.00 0.02 0.00 0.00 57.03 57.30 1ub7 h ASP 52 Cb 0.10 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 1ub7 h ASP 52 CO -0.15 0.53 0.55 -0.07 -1.72 0.00 0.00 179.24 178.38 1ub7 h LEU 53 N 0.52 0.98 -0.45 1.55 3.38 -0.71 -1.46 115.31 119.13 1ub7 h LEU 53 Ca 0.14 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1ub7 h LEU 53 Cb 0.14 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 1ub7 h LEU 53 CO -0.02 0.72 0.00 0.00 0.09 0.00 0.00 178.44 179.24 1ub7 h ALA 54 N 1.46 0.60 0.02 1.53 0.00 -0.73 -1.36 119.26 120.78 1ub7 h ALA 54 Ca 0.31 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ub7 h ALA 54 Cb -0.11 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1ub7 h ALA 54 CO -0.06 0.40 -0.03 0.74 0.00 0.00 0.00 179.25 180.29 1ub7 h PHE 55 N 0.64 -0.07 -0.75 0.00 0.04 -0.48 -1.29 116.94 115.02 1ub7 h PHE 55 Ca 0.13 0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.96 1ub7 h PHE 55 Cb 0.49 0.03 -0.06 0.00 2.20 0.00 0.00 35.95 38.61 1ub7 h PHE 55 CO 0.04 -0.05 0.44 0.87 -0.60 0.00 0.00 178.31 179.01 1ub7 h LYS 56 N -0.07 0.78 -0.76 1.51 1.79 -1.21 0.31 116.57 118.93 1ub7 h LYS 56 Ca 0.00 -0.05 -0.04 0.00 -2.18 0.00 0.00 60.65 58.38 1ub7 h LYS 56 Cb 0.07 -0.18 -0.03 0.00 -1.58 0.00 0.00 32.23 30.51 1ub7 h LYS 56 CO -0.01 0.52 0.30 0.00 -1.08 0.00 0.00 179.45 179.18 1ub7 h ALA 57 N 1.38 0.98 -0.28 3.86 0.00 -0.94 0.10 119.26 124.36 1ub7 h ALA 57 Ca 0.33 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 1ub7 h ALA 57 Cb 0.19 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1ub7 h ALA 57 CO -0.18 0.61 -0.39 0.28 0.00 0.00 0.00 179.25 179.56 1ub7 h VAL 58 N 1.09 1.29 -0.78 0.00 2.07 -0.26 -1.50 116.25 118.16 1ub7 h VAL 58 Ca 0.25 -1.56 -0.04 0.00 0.82 0.00 0.00 66.70 66.18 1ub7 h VAL 58 Cb 0.21 1.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 1ub7 h VAL 58 CO -0.02 0.50 0.35 -0.33 0.02 0.00 0.00 177.57 178.09 1ub7 h GLU 59 N 0.54 1.14 -0.48 1.57 5.08 0.06 0.17 114.58 122.67 1ub7 h GLU 59 Ca 0.05 -0.18 -0.08 0.00 -1.00 0.00 0.00 59.36 58.15 1ub7 h GLU 59 Cb 0.92 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 1ub7 h GLU 59 CO 0.08 0.90 -0.01 0.22 -1.00 0.00 0.00 179.01 179.20 1ub7 h ASP 60 N 1.13 0.84 -0.95 1.42 3.58 -0.70 -2.11 116.42 119.62 1ub7 h ASP 60 Ca 0.27 -0.31 0.04 0.00 0.42 0.00 0.00 57.03 57.44 1ub7 h ASP 60 Cb 0.15 -0.23 -0.05 0.00 1.72 0.00 0.00 39.33 40.92 1ub7 h ASP 60 CO -0.03 0.94 0.62 0.25 -2.88 0.00 0.00 179.24 178.15 1ub7 h LEU 61 N 0.71 1.04 -0.76 2.28 6.46 -0.59 -1.86 115.31 122.58 1ub7 h LEU 61 Ca 0.13 -0.01 -0.11 0.00 -0.12 0.00 0.00 57.88 57.77 1ub7 h LEU 61 Cb 0.52 -0.24 -0.01 0.00 -0.73 0.00 0.00 40.66 40.20 1ub7 h LEU 61 CO 0.03 0.71 -0.27 -0.07 -0.62 0.00 0.00 178.44 178.22 1ub7 h LEU 62 N 1.20 0.66 -0.56 2.25 3.38 -0.14 0.41 115.31 122.52 1ub7 h LEU 62 Ca 0.38 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.99 1ub7 h LEU 62 Cb 0.00 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1ub7 h LEU 62 CO -0.11 0.90 -0.10 0.03 0.09 0.00 0.00 178.44 179.24 1ub7 h ARG 63 N 0.56 1.05 -0.00 1.13 3.08 -0.81 -2.15 114.38 117.23 1ub7 h ARG 63 Ca 0.07 -0.39 -0.15 0.00 0.07 0.00 0.00 59.98 59.59 1ub7 h ARG 63 Cb 0.75 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.71 1ub7 h ARG 63 CO 0.06 1.08 -0.70 0.00 -1.07 0.00 0.00 179.97 179.34 1ub7 h ARG 64 N 0.93 0.03 -2.56 0.04 3.08 -1.24 -3.39 114.38 111.26 1ub7 h ARG 64 Ca 0.14 -0.02 -0.59 0.00 0.07 0.00 0.00 59.98 59.58 1ub7 h ARG 64 Cb 0.68 0.01 -0.39 0.00 0.08 0.00 0.00 29.97 30.34 1ub7 h ARG 64 CO 0.05 0.72 -0.88 -1.01 -1.07 0.00 0.00 179.97 177.78 1ub7 s HIS 65 N -3.43 1.25 0.47 3.04 3.76 0.12 -5.06 115.29 115.45 1ub7 s HIS 65 Ca -0.01 -2.18 -0.24 0.00 -0.15 0.00 0.00 55.06 52.48 1ub7 s HIS 65 Cb 0.12 -1.16 -0.07 0.00 1.11 0.00 0.00 32.58 32.58 1ub7 s HIS 65 CO 0.78 -0.80 1.30 -2.14 -0.85 0.00 0.00 174.74 173.02 1ub7 s PRO 66 N 0.32 3.63 -1.04 8.40 0.02 -0.82 -2.54 135.00 142.96 1ub7 s PRO 66 Ca 0.26 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.38 1ub7 s PRO 66 Cb -0.09 -2.50 0.00 0.00 0.02 0.00 0.00 34.50 31.93 1ub7 s PRO 66 CO -0.10 -0.76 0.00 0.41 -0.33 0.00 0.00 177.00 176.22 1ub7 n GLY 67 N 0.62 0.69 0.09 0.52 0.00 -1.26 -4.92 105.19 100.93 1ub7 n GLY 67 Ca 0.07 -0.50 -0.04 0.00 0.00 0.00 0.00 46.02 45.55 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 0.20 0.53 0.00 4.61 0.00 -1.85 -3.24 119.26 119.52 1ub7 h ALA 68 Ca -0.23 -0.88 0.00 0.00 0.00 0.00 0.00 54.91 53.80 1ub7 h ALA 68 Cb 0.89 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1ub7 h ALA 68 CO 0.31 1.11 0.00 1.28 0.00 0.00 0.00 179.25 181.95 1ub7 n LEU 69 N -3.22 0.00 -4.67 0.00 4.77 -1.26 -4.73 117.00 107.89 1ub7 n LEU 69 Ca -0.03 0.32 -0.43 0.00 -0.03 0.00 0.00 56.01 55.84 1ub7 n LEU 69 Cb 0.90 -0.32 -0.02 0.00 -2.33 0.00 0.00 43.42 41.64 1ub7 n LEU 69 CO 0.45 -0.02 1.02 -1.61 -1.33 0.00 0.00 177.39 175.89 1ub7 s GLU 70 N -2.64 4.28 0.00 3.23 2.02 -1.23 -2.18 118.70 122.18 1ub7 s GLU 70 Ca 0.25 1.63 0.00 0.00 0.02 0.00 0.00 54.97 56.87 1ub7 s GLU 70 Cb 0.19 -3.68 0.00 0.00 0.10 0.00 0.00 34.13 30.74 1ub7 s GLU 70 CO 0.44 -0.61 0.00 0.41 0.02 0.00 0.00 175.26 175.52 1ub7 n GLY 71 N 3.50 0.56 3.66 -1.39 0.00 -1.26 -5.02 105.19 105.23 1ub7 n GLY 71 Ca 0.13 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.00 4.28 -1.74 1.61 1.01 -0.93 -2.38 120.40 120.25 1ub7 s VAL 72 Ca 0.00 1.56 0.16 0.00 0.00 0.00 0.00 61.98 63.70 1ub7 s VAL 72 Cb 0.00 -4.00 0.06 0.00 0.00 0.00 0.00 36.38 32.44 1ub7 s VAL 72 CO 0.00 -0.13 0.93 0.47 0.00 0.00 0.00 175.10 176.37 1ub7 n ASP 73 N 6.48 1.98 -3.54 3.32 8.00 -0.31 -4.62 116.55 127.85 1ub7 n ASP 73 Ca 0.14 -1.49 -0.15 0.00 0.71 0.00 0.00 54.79 54.00 1ub7 n ASP 73 Cb 0.45 0.23 -0.05 0.00 -0.02 0.00 0.00 41.12 41.73 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 -1.61 -1.50 -0.09 2.24 0.00 -1.23 -1.89 121.76 117.68 1ub7 s ALA 74 Ca 0.16 0.83 0.01 0.00 0.00 0.00 0.00 51.96 52.97 1ub7 s ALA 74 Cb 0.13 0.29 0.02 0.00 0.00 0.00 0.00 23.12 23.56 1ub7 s ALA 74 CO 0.30 -0.48 -0.11 0.08 0.00 0.00 0.00 175.76 175.55 1ub7 s VAL 75 N -2.10 1.13 -0.15 0.00 1.01 -0.43 -0.73 120.40 119.13 1ub7 s VAL 75 Ca -0.07 -0.42 0.02 0.00 0.00 0.00 0.00 61.98 61.51 1ub7 s VAL 75 Cb -0.01 -1.07 0.01 0.00 0.00 0.00 0.00 36.38 35.31 1ub7 s VAL 75 CO 0.01 0.37 -0.20 -0.63 0.00 0.00 0.00 175.10 174.65 1ub7 s ILE 76 N 1.12 1.98 -0.30 2.22 1.01 -0.12 -2.21 121.20 124.90 1ub7 s ILE 76 Ca -0.06 -0.92 -0.05 0.00 0.00 0.00 0.00 60.65 59.63 1ub7 s ILE 76 Cb -0.14 -1.77 0.03 0.00 0.01 0.00 0.00 42.46 40.58 1ub7 s ILE 76 CO -0.02 0.53 0.05 -0.69 0.00 0.00 0.00 174.94 174.81 1ub7 s VAL 77 N 1.03 3.57 -0.44 2.92 1.01 -0.63 -0.07 120.40 127.79 1ub7 s VAL 77 Ca -0.02 -0.96 -0.24 0.00 0.00 0.00 0.00 61.98 60.76 1ub7 s VAL 77 Cb -0.14 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.35 1ub7 s VAL 77 CO -0.06 0.01 0.81 0.00 0.00 0.00 0.00 175.10 175.86 1ub7 s ALA 78 N 1.41 3.30 0.27 5.51 0.00 0.16 -0.56 121.76 131.86 1ub7 s ALA 78 Ca -0.00 -0.90 -0.12 0.00 0.00 0.00 0.00 51.96 50.94 1ub7 s ALA 78 Cb -0.18 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.46 1ub7 s ALA 78 CO 0.01 -1.87 0.52 -0.08 0.00 0.00 0.00 175.76 174.33 1ub7 s THR 79 N 3.35 0.00 0.00 0.00 -1.32 -0.74 -2.69 115.64 114.24 1ub7 s THR 79 Ca 0.32 -1.38 0.00 0.00 -1.21 0.00 0.00 61.69 59.42 1ub7 s THR 79 Cb -0.12 -2.29 0.00 0.00 -1.51 0.00 0.00 72.50 68.59 1ub7 s THR 79 CO 0.22 0.00 0.43 0.59 -2.21 0.00 0.00 174.62 173.65 1ub7 n ASN 80 N -0.58 0.35 -3.06 8.08 3.02 -1.26 -4.22 115.26 117.59 1ub7 n ASN 80 Ca -0.02 -1.14 -0.17 0.00 -0.03 0.00 0.00 54.58 53.22 1ub7 n ASN 80 Cb 0.61 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.77 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 -0.07 0.30 -1.75 3.41 -2.24 -1.26 -5.08 114.28 107.59 1ub7 n THR 81 Ca 0.00 -4.38 -0.33 0.00 -2.27 0.00 0.00 64.05 57.06 1ub7 n THR 81 Cb 0.36 -0.18 0.05 0.00 -2.10 0.00 0.00 70.33 68.45 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 -2.64 2.74 0.13 -0.78 0.04 -1.26 -4.61 135.00 128.62 1ub7 s PRO 82 Ca 0.38 1.48 -0.22 0.00 0.04 0.00 0.00 61.00 62.68 1ub7 s PRO 82 Cb 0.37 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.95 1ub7 s PRO 82 CO -0.06 -1.31 1.66 -0.44 0.04 0.00 0.00 177.00 176.89 1ub7 h ASP 83 N 0.10 -0.50 -4.39 6.66 5.19 -1.97 -3.45 116.42 118.07 1ub7 h ASP 83 Ca -0.47 0.09 -0.30 0.00 -0.62 0.00 0.00 57.03 55.72 1ub7 h ASP 83 Cb 1.26 0.23 -0.15 0.00 0.18 0.00 0.00 39.33 40.85 1ub7 h ASP 83 CO 0.54 -0.21 -0.67 0.00 -3.12 0.00 0.00 179.24 175.78 1ub7 s ALA 84 N -6.14 1.42 0.30 3.45 0.00 -1.26 -5.00 121.76 114.53 1ub7 s ALA 84 Ca -0.14 -1.61 0.18 0.00 0.00 0.00 0.00 51.96 50.39 1ub7 s ALA 84 Cb 0.10 0.51 0.87 0.00 0.00 0.00 0.00 23.12 24.60 1ub7 s ALA 84 CO 0.67 -0.30 1.85 -0.07 0.00 0.00 0.00 175.76 177.91 1ub7 h LEU 85 N 2.67 0.00 -7.00 0.00 3.38 -2.02 -3.44 115.31 108.90 1ub7 h LEU 85 Ca -0.37 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.70 1ub7 h LEU 85 Cb 1.21 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.67 1ub7 h LEU 85 CO 0.63 0.32 0.57 0.72 0.09 0.00 0.00 178.44 180.77 1ub7 s PHE 86 N -3.96 -0.36 0.92 1.13 -0.12 -1.26 -4.65 117.98 109.68 1ub7 s PHE 86 Ca -0.02 0.87 -0.10 0.00 -0.05 0.00 0.00 56.93 57.63 1ub7 s PHE 86 Cb 0.13 0.39 0.15 0.00 -0.63 0.00 0.00 43.02 43.06 1ub7 s PHE 86 CO 0.68 -0.17 1.12 -1.25 -0.05 0.00 0.00 175.22 175.55 1ub7 s PRO 87 N 0.22 0.97 0.45 1.99 0.04 -1.26 -5.13 135.00 132.27 1ub7 s PRO 87 Ca 0.04 1.37 -0.18 0.00 0.04 0.00 0.00 61.00 62.27 1ub7 s PRO 87 Cb -0.05 -1.73 -0.09 0.00 0.04 0.00 0.00 34.50 32.66 1ub7 s PRO 87 CO -0.09 -2.61 0.94 0.16 0.04 0.00 0.00 177.00 175.44 1ub7 s ASP 88 N -2.80 6.79 0.25 6.66 -4.77 -1.26 -4.30 116.67 117.25 1ub7 s ASP 88 Ca 0.66 1.58 -0.04 0.00 -3.30 0.00 0.00 52.55 51.46 1ub7 s ASP 88 Cb -0.22 -2.50 0.39 0.00 -1.09 0.00 0.00 42.92 39.49 1ub7 s ASP 88 CO 0.58 -0.43 1.86 0.74 0.70 0.00 0.00 175.17 178.62 1ub7 h THR 89 N 1.52 1.04 -0.92 2.11 2.02 -1.93 -2.11 112.91 114.63 1ub7 h THR 89 Ca -0.48 -0.36 0.09 0.00 0.77 0.00 0.00 66.41 66.43 1ub7 h THR 89 Cb 1.18 -0.09 -0.07 0.00 -1.74 0.00 0.00 68.15 67.43 1ub7 h THR 89 CO 0.62 0.19 0.59 0.00 0.37 0.00 0.00 175.52 177.29 1ub7 h ALA 90 N 1.44 1.57 -0.69 6.16 0.00 -1.90 -1.08 119.26 124.76 1ub7 h ALA 90 Ca 0.41 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.25 1ub7 h ALA 90 Cb 0.21 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 1ub7 h ALA 90 CO -0.19 0.26 0.20 0.00 0.00 0.00 0.00 179.25 179.52 1ub7 h ALA 91 N 1.53 0.90 -0.70 0.00 0.00 -1.66 0.19 119.26 119.53 1ub7 h ALA 91 Ca 0.42 -0.23 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1ub7 h ALA 91 Cb 0.34 -0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1ub7 h ALA 91 CO -0.18 0.60 0.45 -0.07 0.00 0.00 0.00 179.25 180.05 1ub7 h LEU 92 N 1.02 0.75 -0.30 0.00 3.38 -1.13 -0.29 115.31 118.74 1ub7 h LEU 92 Ca 0.22 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.15 1ub7 h LEU 92 Cb 0.32 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1ub7 h LEU 92 CO -0.00 0.53 0.08 0.58 0.09 0.00 0.00 178.44 179.72 1ub7 h VAL 93 N 0.89 1.21 -0.69 1.22 2.07 -0.86 0.10 116.25 120.20 1ub7 h VAL 93 Ca 0.27 -0.70 0.13 0.00 0.82 0.00 0.00 66.70 67.22 1ub7 h VAL 93 Cb -0.04 1.10 -0.09 0.00 -1.52 0.00 0.00 31.29 30.74 1ub7 h VAL 93 CO -0.08 0.23 0.24 -0.61 0.02 0.00 0.00 177.57 177.36 1ub7 h GLN 94 N 0.33 0.37 0.39 1.57 -0.00 -0.20 -2.26 115.11 115.30 1ub7 h GLN 94 Ca 0.10 -0.02 -0.02 0.00 -0.00 0.00 0.00 58.65 58.70 1ub7 h GLN 94 Cb 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 27.48 27.67 1ub7 h GLN 94 CO -0.00 0.24 -0.19 0.00 0.00 0.00 0.00 178.83 178.89 1ub7 h ALA 95 N 1.51 -0.52 -1.08 3.38 0.00 -0.78 -0.03 119.26 121.74 1ub7 h ALA 95 Ca 0.37 -0.18 0.42 0.00 0.00 0.00 0.00 54.91 55.51 1ub7 h ALA 95 Cb 0.55 0.20 -0.17 0.00 0.00 0.00 0.00 17.79 18.37 1ub7 h ALA 95 CO -0.39 -0.57 0.62 -0.09 0.00 0.00 0.00 179.25 178.81 1ub7 h ARG 96 N -0.96 0.04 -0.57 0.00 9.65 -0.42 0.68 114.38 122.79 1ub7 h ARG 96 Ca -0.05 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.82 1ub7 h ARG 96 Cb 0.54 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.11 1ub7 h ARG 96 CO 0.09 0.03 0.00 1.19 2.80 0.00 0.00 179.97 184.08 1ub7 n PHE 97 N -5.12 1.00 -3.78 2.20 3.01 -0.89 -4.99 117.46 108.90 1ub7 n PHE 97 Ca 0.38 -0.56 -0.31 0.00 1.01 0.00 0.00 57.45 57.97 1ub7 n PHE 97 Cb 1.31 -0.11 0.03 0.00 -0.01 0.00 0.00 39.48 40.70 1ub7 n PHE 97 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ub7 n GLY 98 N 1.04 -0.76 3.86 1.37 0.00 0.24 -4.97 105.19 105.96 1ub7 n GLY 98 Ca 0.21 0.36 -0.31 0.00 0.00 0.00 0.00 46.02 46.28 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 -6.68 4.11 -0.61 0.99 1.43 -0.06 -5.04 118.68 112.82 1ub7 s LEU 99 Ca 0.34 0.15 -0.14 0.00 -1.03 0.00 0.00 54.13 53.45 1ub7 s LEU 99 Cb -0.13 -2.75 0.15 0.00 0.03 0.00 0.00 46.19 43.50 1ub7 s LEU 99 CO 0.88 0.17 0.55 -0.75 0.23 0.00 0.00 176.35 177.43 1ub7 s LYS 100 N -2.45 3.09 0.03 1.70 2.20 -1.26 -4.77 119.74 118.27 1ub7 s LYS 100 Ca 0.32 -1.94 -0.28 0.00 -0.36 0.00 0.00 55.97 53.72 1ub7 s LYS 100 Cb -0.13 -4.28 0.10 0.00 -1.51 0.00 0.00 37.83 32.01 1ub7 s LYS 100 CO 0.25 -1.30 0.85 0.00 -0.36 0.00 0.00 175.35 174.80 1ub7 s ALA 101 N 1.14 -1.78 0.59 3.13 0.00 -1.26 -4.55 121.76 119.03 1ub7 s ALA 101 Ca 0.08 0.89 -0.08 0.00 0.00 0.00 0.00 51.96 52.84 1ub7 s ALA 101 Cb -0.24 0.49 -0.02 0.00 0.00 0.00 0.00 23.12 23.36 1ub7 s ALA 101 CO -0.01 -0.72 0.94 -0.59 0.00 0.00 0.00 175.76 175.38 1ub7 s PHE 102 N -3.21 3.46 -0.11 0.00 -0.71 -0.79 -4.89 117.98 111.73 1ub7 s PHE 102 Ca 0.05 0.95 -0.16 0.00 -1.04 0.00 0.00 56.93 56.73 1ub7 s PHE 102 Cb -0.01 -2.68 0.04 0.00 -1.21 0.00 0.00 43.02 39.16 1ub7 s PHE 102 CO -0.09 -0.70 0.41 0.00 -1.34 0.00 0.00 175.22 173.50 1ub7 s ALA 103 N -3.05 -1.03 0.11 1.99 0.00 -1.26 -1.32 121.76 117.21 1ub7 s ALA 103 Ca 0.53 0.94 -0.25 0.00 0.00 0.00 0.00 51.96 53.19 1ub7 s ALA 103 Cb -0.11 -0.40 0.07 0.00 0.00 0.00 0.00 23.12 22.69 1ub7 s ALA 103 CO 0.49 -0.23 0.64 1.52 0.00 0.00 0.00 175.76 178.17 1ub7 s TYR 104 N -0.37 -0.54 0.03 0.00 -0.85 -0.94 -4.70 117.35 109.97 1ub7 s TYR 104 Ca -0.05 0.45 -0.05 0.00 -0.52 0.00 0.00 57.07 56.90 1ub7 s TYR 104 Cb -0.03 0.53 -0.05 0.00 0.38 0.00 0.00 41.96 42.79 1ub7 s TYR 104 CO 0.03 -0.78 0.26 -0.51 -1.52 0.00 0.00 175.55 173.02 1ub7 s ASP 105 N -2.47 6.45 -0.14 -0.18 1.11 -1.26 -1.60 116.67 118.58 1ub7 s ASP 105 Ca -0.01 0.49 0.01 0.00 0.18 0.00 0.00 52.55 53.22 1ub7 s ASP 105 Cb -0.01 -2.06 -0.00 0.00 1.07 0.00 0.00 42.92 41.92 1ub7 s ASP 105 CO -0.09 0.22 -0.17 -0.22 1.18 0.00 0.00 175.17 176.09 1ub7 s LEU 106 N -1.99 2.44 -0.34 1.23 0.20 0.28 -4.88 118.68 115.61 1ub7 s LEU 106 Ca 0.30 -0.46 -0.00 0.00 0.69 0.00 0.00 54.13 54.66 1ub7 s LEU 106 Cb -0.13 -1.54 0.08 0.00 -0.43 0.00 0.00 46.19 44.18 1ub7 s LEU 106 CO 0.19 0.12 0.07 -0.76 -0.29 0.00 0.00 176.35 175.68 1ub7 s LEU 107 N 0.59 4.54 -0.07 -0.68 1.02 -1.26 -1.78 118.68 121.03 1ub7 s LEU 107 Ca -0.10 -1.77 0.21 0.00 0.02 0.00 0.00 54.13 52.49 1ub7 s LEU 107 Cb -0.16 -1.71 0.38 0.00 0.02 0.00 0.00 46.19 44.72 1ub7 s LEU 107 CO 0.03 -0.38 1.15 0.00 0.02 0.00 0.00 176.35 177.18 1ub7 n ALA 108 N 4.50 2.65 -0.58 4.21 0.00 -1.26 -5.06 120.51 124.97 1ub7 n ALA 108 Ca -0.05 -2.11 0.00 0.00 0.00 0.00 0.00 53.44 51.28 1ub7 n ALA 108 Cb 0.42 -0.71 0.00 0.00 0.00 0.00 0.00 19.45 19.16 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 0.07 1.10 0.42 0.00 0.00 -1.26 -3.69 105.19 101.84 1ub7 n GLY 109 Ca -0.00 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.49 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 -4.70 135.00 130.31 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 -0.17 0.41 0.00 -0.02 0.00 0.00 33.50 33.72 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 1.79 1.03 -1.23 0.00 -1.94 -1.64 103.07 101.08 1ub7 h GLY 112 Ca 0.00 -0.14 -0.09 0.00 0.00 0.00 0.00 47.33 47.10 1ub7 h GLY 112 CO 0.00 -0.47 -0.04 -0.25 0.00 0.00 0.00 176.54 175.77 1ub7 h TRP 113 N 0.24 1.01 -0.66 5.60 7.01 -1.84 0.10 115.95 127.42 1ub7 h TRP 113 Ca 0.67 -0.19 -0.08 0.00 2.11 0.00 0.00 58.89 61.40 1ub7 h TRP 113 Cb 1.49 -0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 28.27 1ub7 h TRP 113 CO -0.13 0.95 0.11 0.82 -2.79 0.00 0.00 178.44 177.41 1ub7 h ILE 114 N 0.78 1.26 -0.53 2.65 2.04 -1.69 0.32 117.51 122.34 1ub7 h ILE 114 Ca 0.14 -1.03 0.05 0.00 1.00 0.00 0.00 64.86 65.02 1ub7 h ILE 114 Cb 0.58 0.63 -0.05 0.00 -0.74 0.00 0.00 36.82 37.25 1ub7 h ILE 114 CO 0.03 0.39 0.26 1.88 0.00 0.00 0.00 178.15 180.71 1ub7 h TYR 115 N 1.02 0.47 -0.54 1.37 -1.99 -1.11 -0.18 116.97 116.00 1ub7 h TYR 115 Ca 0.20 0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.95 1ub7 h TYR 115 Cb 0.43 -0.13 -0.03 0.00 2.00 0.00 0.00 36.73 39.01 1ub7 h TYR 115 CO 0.03 0.21 0.31 0.00 -0.00 0.00 0.00 178.16 178.72 1ub7 h ALA 116 N 1.30 0.69 -0.43 3.88 0.00 -0.24 -0.03 119.26 124.43 1ub7 h ALA 116 Ca 0.24 -0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.12 1ub7 h ALA 116 Cb 0.17 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.70 1ub7 h ALA 116 CO -0.18 0.19 0.18 -0.07 0.00 0.00 0.00 179.25 179.37 1ub7 h LEU 117 N 0.73 0.22 -0.34 0.00 3.38 -0.20 -0.34 115.31 118.76 1ub7 h LEU 117 Ca 0.19 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.23 1ub7 h LEU 117 Cb 0.01 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1ub7 h LEU 117 CO -0.03 0.16 0.17 0.00 0.09 0.00 0.00 178.44 178.83 1ub7 h ALA 118 N 1.26 0.42 -0.73 1.53 0.00 -0.35 0.22 119.26 121.61 1ub7 h ALA 118 Ca 0.20 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1ub7 h ALA 118 Cb 0.16 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1ub7 h ALA 118 CO -0.18 -0.20 0.21 1.96 0.00 0.00 0.00 179.25 181.04 1ub7 h GLN 119 N 0.36 1.14 -0.24 0.00 1.08 -0.77 -1.35 115.11 115.33 1ub7 h GLN 119 Ca 0.14 -0.25 -0.01 0.00 -1.45 0.00 0.00 58.65 57.08 1ub7 h GLN 119 Cb 0.05 -0.16 -0.01 0.00 -0.05 0.00 0.00 27.48 27.31 1ub7 h GLN 119 CO -0.10 0.98 0.12 0.00 -0.95 0.00 0.00 178.83 178.89 1ub7 h ALA 120 N 1.13 0.30 -0.75 3.87 0.00 -0.59 0.15 119.26 123.37 1ub7 h ALA 120 Ca 0.23 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.12 1ub7 h ALA 120 Cb 0.33 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 1ub7 h ALA 120 CO -0.00 -0.15 0.45 1.25 0.00 0.00 0.00 179.25 180.79 1ub7 h HIS 121 N 0.26 0.83 -0.10 0.00 -0.00 -0.23 -1.10 115.15 114.81 1ub7 h HIS 121 Ca 0.08 0.03 -0.00 0.00 -0.00 0.00 0.00 60.37 60.47 1ub7 h HIS 121 Cb 0.09 -0.26 -0.00 0.00 -0.00 0.00 0.00 27.41 27.23 1ub7 h HIS 121 CO -0.03 0.42 0.05 0.00 -0.00 0.00 0.00 177.93 178.37 1ub7 h ALA 122 N 1.36 0.13 -0.40 5.26 0.00 -0.67 -0.26 119.26 124.69 1ub7 h ALA 122 Ca 0.33 -0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.22 1ub7 h ALA 122 Cb 0.15 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.85 1ub7 h ALA 122 CO -0.17 -0.30 0.10 -0.07 0.00 0.00 0.00 179.25 178.81 1ub7 h LEU 123 N 0.04 0.07 0.30 0.00 3.38 -0.43 0.50 115.31 119.17 1ub7 h LEU 123 Ca 0.04 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.05 1ub7 h LEU 123 Cb 0.12 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1ub7 h LEU 123 CO -0.00 0.07 -0.15 0.58 0.09 0.00 0.00 178.44 179.03 1ub7 h VAL 124 N 0.24 0.72 -0.01 1.22 2.07 -1.07 -0.34 116.25 119.08 1ub7 h VAL 124 Ca 0.19 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 1ub7 h VAL 124 Cb 0.21 0.81 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 1ub7 h VAL 124 CO -0.23 0.03 -0.10 -0.33 0.02 0.00 0.00 177.57 176.97 1ub7 h GLU 125 N -0.49 0.02 -0.01 1.57 4.39 -0.67 -1.73 114.58 117.66 1ub7 h GLU 125 Ca -0.04 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1ub7 h GLU 125 Cb 0.37 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 1ub7 h GLU 125 CO 0.07 0.12 -0.16 0.00 -1.16 0.00 0.00 179.01 177.88 1ub7 n ALA 126 N -2.52 2.88 -0.99 3.43 0.00 0.17 -4.95 120.51 118.53 1ub7 n ALA 126 Ca -0.02 -0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1ub7 n ALA 126 Cb 0.18 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 1.28 0.49 0.06 0.00 0.00 -0.43 -4.91 105.19 101.68 1ub7 n GLY 127 Ca 0.15 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.12 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 0.00 0.58 -3.73 0.99 4.77 -0.27 -4.82 117.00 114.52 1ub7 n LEU 128 Ca 0.00 0.41 -0.13 0.00 -0.03 0.00 0.00 56.01 56.26 1ub7 n LEU 128 Cb 0.00 -0.31 -0.10 0.00 -2.33 0.00 0.00 43.42 40.68 1ub7 n LEU 128 CO 0.00 -0.08 0.09 0.00 -1.33 0.00 0.00 177.39 176.07 1ub7 s ALA 129 N -3.09 -1.02 -0.03 -1.18 0.00 -1.16 -4.99 121.76 110.30 1ub7 s ALA 129 Ca 0.10 1.16 -0.23 0.00 0.00 0.00 0.00 51.96 52.99 1ub7 s ALA 129 Cb 0.15 -0.67 -0.24 0.00 0.00 0.00 0.00 23.12 22.35 1ub7 s ALA 129 CO 0.63 -0.20 1.04 0.37 0.00 0.00 0.00 175.76 177.60 1ub7 h GLN 130 N 5.47 0.27 -3.95 0.00 4.15 -1.88 -3.33 115.11 115.85 1ub7 h GLN 130 Ca -0.27 -0.30 -0.16 0.00 0.77 0.00 0.00 58.65 58.69 1ub7 h GLN 130 Cb 1.18 0.09 -0.20 0.00 0.21 0.00 0.00 27.48 28.76 1ub7 h GLN 130 CO 0.25 1.02 -0.66 0.15 -1.93 0.00 0.00 178.83 177.66 1ub7 s LYS 131 N -3.07 0.39 -0.04 1.69 1.02 -1.00 -4.37 119.74 114.36 1ub7 s LYS 131 Ca -0.15 -0.67 0.03 0.00 0.02 0.00 0.00 55.97 55.20 1ub7 s LYS 131 Cb 0.02 0.14 0.00 0.00 -0.52 0.00 0.00 37.83 37.47 1ub7 s LYS 131 CO 0.78 -0.07 -0.13 0.08 -0.92 0.00 0.00 175.35 175.08 1ub7 s VAL 132 N -1.85 1.12 -0.46 3.17 1.01 0.82 -1.17 120.40 123.06 1ub7 s VAL 132 Ca -0.12 -0.55 -0.21 0.00 0.00 0.00 0.00 61.98 61.10 1ub7 s VAL 132 Cb -0.07 -0.98 0.03 0.00 0.00 0.00 0.00 36.38 35.36 1ub7 s VAL 132 CO -0.02 0.33 0.66 -0.22 0.00 0.00 0.00 175.10 175.85 1ub7 s LEU 133 N 0.12 4.55 -0.38 3.92 2.96 0.10 0.98 118.68 130.92 1ub7 s LEU 133 Ca -0.04 -0.43 -0.11 0.00 -0.22 0.00 0.00 54.13 53.34 1ub7 s LEU 133 Cb -0.10 -2.69 0.03 0.00 0.50 0.00 0.00 46.19 43.93 1ub7 s LEU 133 CO 0.01 -0.82 0.21 0.00 -1.32 0.00 0.00 176.35 174.43 1ub7 s ALA 134 N 2.86 3.27 -0.03 5.97 0.00 0.21 -0.95 121.76 133.09 1ub7 s ALA 134 Ca 0.22 -1.76 -0.01 0.00 0.00 0.00 0.00 51.96 50.40 1ub7 s ALA 134 Cb -0.15 -2.59 -0.04 0.00 0.00 0.00 0.00 23.12 20.34 1ub7 s ALA 134 CO 0.18 -1.42 0.06 0.08 0.00 0.00 0.00 175.76 174.66 1ub7 s VAL 135 N 1.54 4.66 -0.26 0.00 1.01 0.89 -1.24 120.40 126.99 1ub7 s VAL 135 Ca 0.02 -0.33 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1ub7 s VAL 135 Cb -0.20 -3.08 0.07 0.00 0.00 0.00 0.00 36.38 33.18 1ub7 s VAL 135 CO 0.06 0.44 -0.01 -0.83 0.00 0.00 0.00 175.10 174.76 1ub7 s GLY 136 N -1.45 1.37 -0.00 4.51 0.00 1.00 0.40 107.32 113.14 1ub7 s GLY 136 Ca 0.20 -1.61 -0.00 0.00 0.00 0.00 0.00 44.72 43.30 1ub7 s GLY 136 CO 0.10 1.04 0.01 0.00 0.00 0.00 0.00 173.10 174.25 1ub7 s ALA 137 N 1.35 -0.03 -0.11 3.20 0.00 -1.10 0.42 121.76 125.49 1ub7 s ALA 137 Ca -0.00 0.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.94 1ub7 s ALA 137 Cb -0.19 -0.02 0.05 0.00 0.00 0.00 0.00 23.12 22.96 1ub7 s ALA 137 CO -0.10 -0.01 0.26 -1.21 0.00 0.00 0.00 175.76 174.70 1ub7 s GLU 138 N 0.03 0.22 -0.74 0.00 0.41 -0.53 -4.46 118.70 113.63 1ub7 s GLU 138 Ca -0.00 0.54 0.03 0.00 -0.41 0.00 0.00 54.97 55.13 1ub7 s GLU 138 Cb -0.00 -0.10 0.31 0.00 -1.78 0.00 0.00 34.13 32.56 1ub7 s GLU 138 CO -0.00 -0.16 1.17 0.00 -0.49 0.00 0.00 175.26 175.78 1ub7 n ALA 139 N 4.16 4.94 0.23 5.21 0.00 -1.26 -2.38 120.51 131.40 1ub7 n ALA 139 Ca -0.24 -4.71 0.16 0.00 0.00 0.00 0.00 53.44 48.64 1ub7 n ALA 139 Cb 0.53 -1.26 0.83 0.00 0.00 0.00 0.00 19.45 19.56 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 3.74 0.00 -1.59 0.00 3.38 -1.95 -1.18 115.31 117.71 1ub7 h LEU 140 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 1ub7 h LEU 140 Cb 0.50 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.25 1ub7 h LEU 140 CO 0.96 0.00 0.00 0.77 0.09 0.00 0.00 178.44 180.26 1ub7 h SER 141 N 0.00 0.00 0.86 -0.43 4.64 -1.88 -1.05 113.55 115.70 1ub7 h SER 141 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1ub7 h SER 141 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 1ub7 h SER 141 CO -0.00 0.00 -0.36 0.29 -0.87 0.00 0.00 176.83 175.89 1ub7 n LYS 142 N -2.54 0.13 0.00 4.77 4.76 -0.45 -4.08 118.16 120.76 1ub7 n LYS 142 Ca -0.01 0.06 0.00 0.00 -2.87 0.00 0.00 58.31 55.49 1ub7 n LYS 142 Cb 0.13 -1.60 0.00 0.00 -1.84 0.00 0.00 35.03 31.72 1ub7 n LYS 142 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 1ub7 n ILE 143 N -1.80 0.00 -2.34 -0.18 -5.35 -0.51 -5.06 119.36 104.12 1ub7 n ILE 143 Ca 0.05 -0.44 -0.37 0.00 -0.27 0.00 0.00 62.75 61.72 1ub7 n ILE 143 Cb 0.38 1.04 -0.02 0.00 -1.74 0.00 0.00 39.64 39.30 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 -0.61 3.28 -1.24 7.28 2.07 -0.52 -4.29 121.20 127.17 1ub7 s ILE 144 Ca 0.00 0.96 -0.17 0.00 -1.41 0.00 0.00 60.65 60.03 1ub7 s ILE 144 Cb 0.00 -3.49 0.10 0.00 0.13 0.00 0.00 42.46 39.20 1ub7 s ILE 144 CO 0.00 -0.01 1.60 -0.62 -1.91 0.00 0.00 174.94 174.00 1ub7 s ASP 145 N -1.42 6.89 0.63 4.50 -1.08 -1.26 -4.85 116.67 120.08 1ub7 s ASP 145 Ca 0.62 -2.55 0.20 0.00 -0.52 0.00 0.00 52.55 50.29 1ub7 s ASP 145 Cb -0.27 -2.51 0.83 0.00 -1.46 0.00 0.00 42.92 39.50 1ub7 s ASP 145 CO 0.33 -1.05 1.38 -0.50 0.52 0.00 0.00 175.17 175.85 1ub7 h TRP 146 N 7.62 0.00 0.00 -5.34 -0.00 -1.93 0.31 115.95 116.60 1ub7 h TRP 146 Ca 0.38 0.00 -0.19 0.00 -0.00 0.00 0.00 58.89 59.08 1ub7 h TRP 146 Cb 0.89 0.00 -0.03 0.00 -0.00 0.00 0.00 29.16 30.01 1ub7 h TRP 146 CO 1.30 0.00 -1.49 0.09 -0.00 0.00 0.00 178.44 178.34 1ub7 n ASN 147 N -3.05 0.84 -4.56 -3.49 5.03 -1.26 -4.69 115.26 104.07 1ub7 n ASN 147 Ca 0.11 0.38 -0.40 0.00 0.87 0.00 0.00 54.58 55.54 1ub7 n ASN 147 Cb 1.10 0.14 -0.03 0.00 -1.02 0.00 0.00 39.78 39.97 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 -5.82 6.41 0.53 6.41 2.15 0.11 -4.82 116.67 121.64 1ub7 s ASP 148 Ca -0.03 -1.60 0.34 0.00 0.43 0.00 0.00 52.55 51.69 1ub7 s ASP 148 Cb 0.09 -2.57 1.50 0.00 -0.30 0.00 0.00 42.92 41.64 1ub7 s ASP 148 CO 0.81 -1.59 1.83 0.08 -0.17 0.00 0.00 175.17 176.13 1ub7 h ARG 149 N 9.47 0.03 -0.13 4.34 0.11 -1.84 0.29 114.38 126.65 1ub7 h ARG 149 Ca 0.24 -0.00 0.04 0.00 0.10 0.00 0.00 59.98 60.36 1ub7 h ARG 149 Cb 0.98 -0.01 -0.01 0.00 1.11 0.00 0.00 29.97 32.05 1ub7 h ARG 149 CO 1.41 0.02 0.26 0.00 0.10 0.00 0.00 179.97 181.76 1ub7 h ALA 150 N 1.46 1.57 0.00 0.08 0.00 -1.94 -3.23 119.26 117.19 1ub7 h ALA 150 Ca 0.53 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.43 1ub7 h ALA 150 Cb 2.05 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.85 1ub7 h ALA 150 CO -0.03 -0.33 -0.00 0.25 0.00 0.00 0.00 179.25 179.14 1ub7 n THR 151 N -3.34 0.00 0.31 0.00 -2.24 -0.01 -4.86 114.28 104.13 1ub7 n THR 151 Ca 0.01 -0.00 0.20 0.00 -2.27 0.00 0.00 64.05 61.99 1ub7 n THR 151 Cb 0.36 0.42 1.05 0.00 -2.10 0.00 0.00 70.33 70.06 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 1.00 -0.47 6.98 0.00 -0.55 -1.93 119.26 124.29 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ub7 h ALA 152 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 179.25 180.58 1ub7 n VAL 153 N -2.94 0.77 -0.04 0.00 0.24 -1.26 -4.59 118.33 110.51 1ub7 n VAL 153 Ca -0.02 -0.89 -0.13 0.00 -2.04 0.00 0.00 64.34 61.26 1ub7 n VAL 153 Cb 0.10 0.71 -0.14 0.00 -1.47 0.00 0.00 33.84 33.03 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 1.23 1.39 -4.81 1.34 4.77 -0.73 -4.95 117.00 115.24 1ub7 n LEU 154 Ca 0.18 0.23 -0.26 0.00 -0.03 0.00 0.00 56.01 56.13 1ub7 n LEU 154 Cb 0.54 -0.22 -0.05 0.00 -2.33 0.00 0.00 43.42 41.36 1ub7 n LEU 154 CO 0.13 0.59 -0.21 -0.36 -1.33 0.00 0.00 177.39 176.21 1ub7 s PHE 155 N -2.56 3.18 0.19 -1.77 0.08 -1.26 -0.77 117.98 115.08 1ub7 s PHE 155 Ca -0.13 -0.00 0.01 0.00 0.12 0.00 0.00 56.93 56.92 1ub7 s PHE 155 Cb 0.07 -1.53 -0.05 0.00 -0.57 0.00 0.00 43.02 40.95 1ub7 s PHE 155 CO 0.79 0.52 0.06 0.20 -0.10 0.00 0.00 175.22 176.68 1ub7 s GLY 156 N -3.11 1.36 0.06 4.36 0.00 0.13 -4.66 107.32 105.48 1ub7 s GLY 156 Ca 0.31 -1.67 0.01 0.00 0.00 0.00 0.00 44.72 43.37 1ub7 s GLY 156 CO 0.24 -1.50 0.18 0.99 0.00 0.00 0.00 173.10 173.01 1ub7 s ASP 157 N -3.19 6.19 -0.05 1.64 1.01 -0.70 -4.16 116.67 117.41 1ub7 s ASP 157 Ca 0.30 0.22 -0.31 0.00 0.71 0.00 0.00 52.55 53.46 1ub7 s ASP 157 Cb 0.07 -1.86 0.13 0.00 1.01 0.00 0.00 42.92 42.26 1ub7 s ASP 157 CO 0.07 0.17 1.32 -0.83 0.21 0.00 0.00 175.17 176.12 1ub7 s GLY 158 N -2.47 -0.42 -0.01 0.21 0.00 -1.00 -4.41 107.32 99.21 1ub7 s GLY 158 Ca 0.34 0.83 -0.06 0.00 0.00 0.00 0.00 44.72 45.83 1ub7 s GLY 158 CO 0.27 0.17 0.12 -0.32 0.00 0.00 0.00 173.10 173.33 1ub7 s GLY 159 N -2.91 0.02 0.02 0.20 0.00 0.26 -1.45 107.32 103.46 1ub7 s GLY 159 Ca 0.14 -0.02 -0.10 0.00 0.00 0.00 0.00 44.72 44.73 1ub7 s GLY 159 CO -0.05 -0.13 0.21 -0.32 0.00 0.00 0.00 173.10 172.81 1ub7 s GLY 160 N -0.95 -0.00 -0.04 0.20 0.00 0.17 -0.63 107.32 106.07 1ub7 s GLY 160 Ca -0.10 -0.14 -0.19 0.00 0.00 0.00 0.00 44.72 44.29 1ub7 s GLY 160 CO 0.01 -0.32 0.41 0.00 0.00 0.00 0.00 173.10 173.20 1ub7 s ALA 161 N -2.15 -1.06 -0.02 3.20 0.00 0.10 -0.00 121.76 121.84 1ub7 s ALA 161 Ca -0.08 0.67 -0.10 0.00 0.00 0.00 0.00 51.96 52.45 1ub7 s ALA 161 Cb -0.03 -0.03 0.01 0.00 0.00 0.00 0.00 23.12 23.07 1ub7 s ALA 161 CO -0.02 -0.28 0.21 0.00 0.00 0.00 0.00 175.76 175.67 1ub7 s ALA 162 N -1.12 -0.52 -0.15 0.00 0.00 -0.38 -0.82 121.76 118.78 1ub7 s ALA 162 Ca -0.11 0.16 -0.06 0.00 0.00 0.00 0.00 51.96 51.94 1ub7 s ALA 162 Cb -0.04 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 1ub7 s ALA 162 CO 0.05 -0.21 0.07 0.08 0.00 0.00 0.00 175.76 175.76 1ub7 s VAL 163 N -1.08 4.90 -0.11 0.00 1.01 -0.76 0.67 120.40 125.03 1ub7 s VAL 163 Ca -0.12 -0.00 0.01 0.00 0.00 0.00 0.00 61.98 61.87 1ub7 s VAL 163 Cb -0.06 -3.17 -0.02 0.00 0.00 0.00 0.00 36.38 33.14 1ub7 s VAL 163 CO 0.02 0.52 -0.14 -0.69 0.00 0.00 0.00 175.10 174.82 1ub7 s VAL 164 N -0.19 3.02 0.29 2.92 1.01 0.27 -1.50 120.40 126.22 1ub7 s VAL 164 Ca 0.08 -0.69 -0.13 0.00 0.00 0.00 0.00 61.98 61.24 1ub7 s VAL 164 Cb -0.12 -2.24 0.05 0.00 0.00 0.00 0.00 36.38 34.07 1ub7 s VAL 164 CO 0.01 0.54 0.68 0.61 0.00 0.00 0.00 175.10 176.95 1ub7 n GLY 165 N 3.23 1.08 3.77 4.51 0.00 -0.81 -0.12 105.19 116.84 1ub7 n GLY 165 Ca -0.18 -1.19 -0.41 0.00 0.00 0.00 0.00 46.02 44.24 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 -2.07 4.22 0.22 1.61 2.20 -1.26 0.23 119.74 124.89 1ub7 s LYS 166 Ca 0.14 2.40 0.07 0.00 -0.36 0.00 0.00 55.97 58.22 1ub7 s LYS 166 Cb -0.04 -3.04 -0.05 0.00 -1.51 0.00 0.00 37.83 33.20 1ub7 s LYS 166 CO 0.09 -0.41 -0.12 0.14 -0.36 0.00 0.00 175.35 174.69 1ub7 s VAL 167 N -0.78 1.65 0.89 4.02 -7.23 -1.26 -4.74 120.40 112.94 1ub7 s VAL 167 Ca 0.54 -2.18 -0.13 0.00 -1.81 0.00 0.00 61.98 58.40 1ub7 s VAL 167 Cb -0.43 -2.13 0.04 0.00 0.56 0.00 0.00 36.38 34.41 1ub7 s VAL 167 CO 0.54 -0.53 0.61 0.54 -0.31 0.00 0.00 175.10 175.95 1ub7 n ARG 168 N -0.41 -0.14 -1.84 4.82 1.74 0.03 -4.86 116.66 116.00 1ub7 n ARG 168 Ca -0.07 0.01 -0.42 0.00 -0.77 0.00 0.00 57.85 56.60 1ub7 n ARG 168 Cb 0.61 -1.98 -0.03 0.00 -1.02 0.00 0.00 32.46 30.04 1ub7 n ARG 168 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1ub7 s GLU 169 N -3.64 4.18 0.00 5.56 2.12 -1.26 -2.56 118.70 123.10 1ub7 s GLU 169 Ca 0.62 2.46 0.00 0.00 0.36 0.00 0.00 54.97 58.41 1ub7 s GLU 169 Cb -0.25 -3.22 0.00 0.00 0.26 0.00 0.00 34.13 30.92 1ub7 s GLU 169 CO 0.63 -0.69 0.00 0.41 -0.54 0.00 0.00 175.26 175.06 1ub7 n GLY 170 N 3.90 1.53 3.94 -1.50 0.00 -1.26 -5.08 105.19 106.73 1ub7 n GLY 170 Ca 0.15 -0.12 -0.19 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.56 2.71 0.00 1.61 1.51 -1.06 -4.88 117.35 115.68 1ub7 s TYR 171 Ca 0.00 -0.46 0.00 0.00 -1.01 0.00 0.00 57.07 55.60 1ub7 s TYR 171 Cb 0.00 -2.27 0.00 0.00 -0.11 0.00 0.00 41.96 39.58 1ub7 s TYR 171 CO 0.00 -0.29 0.00 0.41 -1.11 0.00 0.00 175.55 174.56 1ub7 n GLY 172 N -1.71 -1.87 3.73 0.71 0.00 -0.38 -4.81 105.19 100.87 1ub7 n GLY 172 Ca 0.06 -2.18 -0.42 0.00 0.00 0.00 0.00 46.02 43.48 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 -0.58 3.05 -0.12 1.61 0.08 0.12 -1.33 117.98 120.80 1ub7 s PHE 173 Ca 0.00 0.88 0.12 0.00 0.12 0.00 0.00 56.93 58.05 1ub7 s PHE 173 Cb 0.00 -3.85 -0.18 0.00 -0.57 0.00 0.00 43.02 38.42 1ub7 s PHE 173 CO 0.00 -2.92 0.08 0.54 -0.10 0.00 0.00 175.22 172.81 1ub7 n ARG 174 N 3.02 1.63 -3.53 0.44 1.74 0.14 -4.79 116.66 115.30 1ub7 n ARG 174 Ca 0.10 -0.02 -0.12 0.00 -0.77 0.00 0.00 57.85 57.04 1ub7 n ARG 174 Cb 0.40 -1.35 -0.04 0.00 -1.02 0.00 0.00 32.46 30.44 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 -4.59 -0.44 0.01 0.55 1.04 -1.15 -4.52 113.70 104.60 1ub7 s SER 175 Ca -0.07 0.31 0.03 0.00 0.48 0.00 0.00 55.95 56.71 1ub7 s SER 175 Cb 0.05 0.40 -0.01 0.00 0.10 0.00 0.00 66.02 66.55 1ub7 s SER 175 CO 0.57 -0.53 -0.10 -0.36 0.98 0.00 0.00 173.24 173.80 1ub7 s PHE 176 N -1.95 0.87 -0.11 5.02 0.08 -1.26 -1.33 117.98 119.30 1ub7 s PHE 176 Ca -0.01 -0.24 -0.01 0.00 0.12 0.00 0.00 56.93 56.79 1ub7 s PHE 176 Cb -0.01 -0.54 0.03 0.00 -0.57 0.00 0.00 43.02 41.94 1ub7 s PHE 176 CO -0.01 -0.01 -0.02 0.08 -0.10 0.00 0.00 175.22 175.16 1ub7 s VAL 177 N -0.50 0.63 0.00 -0.44 1.01 0.35 -4.97 120.40 116.48 1ub7 s VAL 177 Ca 0.01 -0.15 0.03 0.00 0.00 0.00 0.00 61.98 61.87 1ub7 s VAL 177 Cb -0.05 -0.81 -0.01 0.00 0.00 0.00 0.00 36.38 35.51 1ub7 s VAL 177 CO 0.00 0.20 -0.09 -0.76 0.00 0.00 0.00 175.10 174.45 1ub7 s LEU 178 N 1.86 2.06 0.18 3.92 1.43 -1.26 -0.36 118.68 126.50 1ub7 s LEU 178 Ca 0.04 -0.23 -0.23 0.00 -1.03 0.00 0.00 54.13 52.68 1ub7 s LEU 178 Cb -0.13 -0.45 0.06 0.00 0.03 0.00 0.00 46.19 45.69 1ub7 s LEU 178 CO -0.07 0.07 0.72 -0.83 0.23 0.00 0.00 176.35 176.48 1ub7 s GLY 179 N -0.43 -0.37 0.05 -3.19 0.00 -0.72 -5.02 107.32 97.65 1ub7 s GLY 179 Ca 0.02 0.23 -0.12 0.00 0.00 0.00 0.00 44.72 44.85 1ub7 s GLY 179 CO -0.00 0.08 0.27 0.00 0.00 0.00 0.00 173.10 173.45 1ub7 s ALA 180 N -3.67 -0.57 -0.39 3.20 0.00 -1.26 -1.52 121.76 117.55 1ub7 s ALA 180 Ca 0.06 -0.14 0.03 0.00 0.00 0.00 0.00 51.96 51.91 1ub7 s ALA 180 Cb -0.03 0.36 0.16 0.00 0.00 0.00 0.00 23.12 23.61 1ub7 s ALA 180 CO -0.04 -0.43 0.39 0.34 0.00 0.00 0.00 175.76 176.02 1ub7 s ASP 181 N -2.23 1.10 0.39 0.00 -1.08 0.12 -4.98 116.67 109.99 1ub7 s ASP 181 Ca -0.03 -1.85 0.27 0.00 -0.52 0.00 0.00 52.55 50.42 1ub7 s ASP 181 Cb 0.00 0.47 1.43 0.00 -1.46 0.00 0.00 42.92 43.36 1ub7 s ASP 181 CO -0.05 -0.23 1.81 1.23 0.52 0.00 0.00 175.17 178.45 1ub7 h GLY 182 N 6.68 0.00 2.00 2.66 0.00 -1.77 0.39 103.07 113.03 1ub7 h GLY 182 Ca 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 1ub7 h GLY 182 CO 0.21 0.00 -0.01 -0.91 0.00 0.00 0.00 176.54 175.83 1ub7 h THR 183 N 0.00 0.05 -0.76 4.70 1.35 -1.95 -1.89 112.91 114.41 1ub7 h THR 183 Ca 0.00 -0.39 -0.39 0.00 -0.55 0.00 0.00 66.41 65.07 1ub7 h THR 183 Cb 0.02 1.37 -0.23 0.00 -1.73 0.00 0.00 68.15 67.58 1ub7 h THR 183 CO 0.00 0.01 0.50 0.61 -0.25 0.00 0.00 175.52 176.39 1ub7 n GLY 184 N -0.30 3.90 0.23 5.82 0.00 -0.80 -4.38 105.19 109.66 1ub7 n GLY 184 Ca -0.01 -0.84 -0.06 0.00 0.00 0.00 0.00 46.02 45.12 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 1.27 0.91 0.00 4.61 0.00 -1.38 -3.02 119.26 121.65 1ub7 h ALA 185 Ca 0.48 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1ub7 h ALA 185 Cb 2.43 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 20.11 1ub7 h ALA 185 CO 0.85 0.63 0.00 0.36 0.00 0.00 0.00 179.25 181.08 1ub7 n LYS 186 N -4.05 0.05 0.17 0.00 2.85 -1.26 -3.31 118.16 112.61 1ub7 n LYS 186 Ca -0.01 0.14 0.08 0.00 -1.05 0.00 0.00 58.31 57.47 1ub7 n LYS 186 Cb 0.49 -1.50 0.09 0.00 -0.65 0.00 0.00 35.03 33.46 1ub7 n LYS 186 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 177.40 178.28 1ub7 h GLU 187 N 0.00 0.00 -1.48 -1.58 4.39 -1.86 -3.45 114.58 110.60 1ub7 h GLU 187 Ca 0.00 0.00 0.11 0.00 0.34 0.00 0.00 59.36 59.81 1ub7 h GLU 187 Cb 0.33 0.00 -0.21 0.00 -0.10 0.00 0.00 28.75 28.77 1ub7 h GLU 187 CO 0.00 0.18 -0.09 -1.17 -1.16 0.00 0.00 179.01 176.76 1ub7 s LEU 188 N -6.16 -1.08 0.22 1.33 2.96 -1.21 -1.44 118.68 113.31 1ub7 s LEU 188 Ca 0.04 1.19 -0.23 0.00 -0.22 0.00 0.00 54.13 54.92 1ub7 s LEU 188 Cb 0.07 2.11 0.05 0.00 0.50 0.00 0.00 46.19 48.92 1ub7 s LEU 188 CO 0.72 -0.20 0.87 -0.72 -1.32 0.00 0.00 176.35 175.69 1ub7 s TYR 189 N 2.82 -0.12 -0.28 5.38 -0.85 -0.85 -4.49 117.35 118.96 1ub7 s TYR 189 Ca 0.02 -0.28 0.02 0.00 -0.52 0.00 0.00 57.07 56.31 1ub7 s TYR 189 Cb -0.12 0.68 0.17 0.00 0.38 0.00 0.00 41.96 43.08 1ub7 s TYR 189 CO -0.19 -1.04 0.49 -1.58 -1.52 0.00 0.00 175.55 171.71 1ub7 s HIS 190 N -3.37 -1.33 0.67 -3.49 2.46 -1.26 -1.43 115.29 107.54 1ub7 s HIS 190 Ca 0.13 0.87 -0.17 0.00 0.47 0.00 0.00 55.06 56.36 1ub7 s HIS 190 Cb -0.03 0.14 -0.04 0.00 -0.13 0.00 0.00 32.58 32.51 1ub7 s HIS 190 CO 0.05 -0.95 0.70 0.00 -2.47 0.00 0.00 174.74 172.06 1ub7 n ALA 191 N 5.39 -0.86 0.00 1.58 0.00 -1.26 -4.98 120.51 120.39 1ub7 n ALA 191 Ca 0.01 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1ub7 n ALA 191 Cb 0.51 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.01 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 -2.53 0.00 -4.64 0.00 0.31 -1.26 -5.01 118.33 105.21 1ub7 n VAL 193 Ca 0.00 -0.24 -0.30 0.00 -0.01 0.00 0.00 64.34 63.79 1ub7 n VAL 193 Cb 0.00 0.64 -0.13 0.00 -0.91 0.00 0.00 33.84 33.44 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 -2.57 2.47 -0.88 3.52 0.00 -1.26 -5.03 121.76 118.01 1ub7 s ALA 194 Ca 0.01 -1.29 0.25 0.00 0.00 0.00 0.00 51.96 50.93 1ub7 s ALA 194 Cb 0.10 -0.58 0.44 0.00 0.00 0.00 0.00 23.12 23.08 1ub7 s ALA 194 CO 0.56 0.56 1.37 -2.30 0.00 0.00 0.00 175.76 175.95 1ub7 n PRO 195 N 1.40 0.10 -4.15 0.00 -0.02 -1.26 -4.76 135.00 126.31 1ub7 n PRO 195 Ca -0.17 0.02 -0.10 0.00 -2.02 0.00 0.00 63.50 61.24 1ub7 n PRO 195 Cb 0.52 -1.56 -0.10 0.00 -0.02 0.00 0.00 33.50 32.35 1ub7 n PRO 195 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1ub7 s ARG 196 N -3.06 0.84 0.26 -0.52 1.04 -1.26 -0.74 118.95 115.51 1ub7 s ARG 196 Ca 0.09 -1.36 0.07 0.00 -1.04 0.00 0.00 55.73 53.49 1ub7 s ARG 196 Cb 0.16 0.06 -0.03 0.00 -2.04 0.00 0.00 34.95 33.10 1ub7 s ARG 196 CO 0.71 -0.14 0.24 -0.51 -0.04 0.00 0.00 175.30 175.55 1ub7 s LEU 197 N -3.03 3.86 0.32 -1.89 1.43 -0.11 -4.97 118.68 114.30 1ub7 s LEU 197 Ca 0.16 -0.23 0.09 0.00 -1.03 0.00 0.00 54.13 53.12 1ub7 s LEU 197 Cb 0.07 -2.41 0.92 0.00 0.03 0.00 0.00 46.19 44.79 1ub7 s LEU 197 CO -0.03 -0.09 1.67 -0.65 0.23 0.00 0.00 176.35 177.48 1ub7 h PRO 198 N 1.41 0.31 0.00 1.29 0.11 -1.98 0.60 132.00 133.74 1ub7 h PRO 198 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1ub7 h PRO 198 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1ub7 h PRO 198 CO 0.60 0.21 0.00 -0.40 -0.21 0.00 0.00 178.00 178.20 1ub7 n ASP 199 N -5.09 0.00 0.00 -2.05 5.68 -1.26 -4.86 116.55 108.97 1ub7 n ASP 199 Ca 0.27 -0.63 0.00 0.00 -0.50 0.00 0.00 54.79 53.93 1ub7 n ASP 199 Cb 0.83 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.77 1ub7 n ASP 199 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ub7 n GLY 200 N 0.48 2.45 3.70 6.12 0.00 0.21 -5.04 105.19 113.10 1ub7 n GLY 200 Ca 0.16 0.00 -0.53 0.00 0.00 0.00 0.00 46.02 45.65 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 -1.73 0.43 -2.38 2.61 -1.04 -1.25 -4.53 114.28 106.39 1ub7 n THR 201 Ca 0.00 -0.08 -0.33 0.00 -2.04 0.00 0.00 64.05 61.60 1ub7 n THR 201 Cb 0.00 -1.53 -0.02 0.00 -1.82 0.00 0.00 70.33 66.96 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 3.88 6.33 -0.03 8.00 0.15 -1.26 -0.93 113.70 129.84 1ub7 s SER 202 Ca 0.96 1.75 0.07 0.00 0.70 0.00 0.00 55.95 59.43 1ub7 s SER 202 Cb -0.90 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 60.86 1ub7 s SER 202 CO 0.59 -0.79 -0.23 -0.04 1.20 0.00 0.00 173.24 173.98 1ub7 s MET 203 N -3.74 2.22 0.60 5.44 -1.94 0.08 -4.92 119.30 117.03 1ub7 s MET 203 Ca 0.63 -0.87 -0.09 0.00 -1.71 0.00 0.00 55.69 53.65 1ub7 s MET 203 Cb -0.13 -2.14 0.14 0.00 2.01 0.00 0.00 34.83 34.71 1ub7 s MET 203 CO 0.28 0.58 0.81 1.63 -0.01 0.00 0.00 175.02 178.31 1ub7 n LYS 204 N 2.38 -0.71 -0.21 2.03 4.76 -1.26 -4.92 118.16 120.23 1ub7 n LYS 204 Ca -0.16 -1.34 -0.06 0.00 -2.87 0.00 0.00 58.31 53.88 1ub7 n LYS 204 Cb 0.51 -0.81 0.04 0.00 -1.84 0.00 0.00 35.03 32.93 1ub7 n LYS 204 CO 0.00 0.00 0.00 -0.97 -1.37 0.00 0.00 177.40 175.06 1ub7 h ASN 205 N -1.02 0.65 -3.08 4.39 -1.24 -2.00 -3.43 115.58 109.85 1ub7 h ASN 205 Ca -0.26 -0.01 -0.50 0.00 0.71 0.00 0.00 56.30 56.24 1ub7 h ASN 205 Cb 0.75 -0.16 -0.14 0.00 0.73 0.00 0.00 38.32 39.50 1ub7 h ASN 205 CO 0.19 0.47 -0.59 -0.13 -1.29 0.00 0.00 177.43 176.08 1ub7 s ARG 206 N -6.14 1.73 0.10 6.67 0.52 -1.26 -4.89 118.95 115.67 1ub7 s ARG 206 Ca -0.13 -1.98 -0.28 0.00 -0.52 0.00 0.00 55.73 52.82 1ub7 s ARG 206 Cb 0.13 -0.87 -0.15 0.00 0.52 0.00 0.00 34.95 34.58 1ub7 s ARG 206 CO 0.75 -0.24 0.62 -0.11 0.02 0.00 0.00 175.30 176.34 1ub7 n LEU 207 N -0.75 -0.63 -4.16 2.53 0.00 -1.26 -4.91 117.00 107.82 1ub7 n LEU 207 Ca -0.04 0.96 -0.25 0.00 0.00 0.00 0.00 56.01 56.69 1ub7 n LEU 207 Cb 0.66 -0.79 -0.15 0.00 0.00 0.00 0.00 43.42 43.14 1ub7 n LEU 207 CO 0.41 -2.14 -0.50 -0.47 0.00 0.00 0.00 177.39 174.69 1ub7 s TYR 208 N -0.50 1.55 -0.08 1.96 5.04 -0.52 -4.87 117.35 119.94 1ub7 s TYR 208 Ca 0.63 -0.30 -0.03 0.00 -2.44 0.00 0.00 57.07 54.92 1ub7 s TYR 208 Cb -0.90 -1.00 0.04 0.00 0.35 0.00 0.00 41.96 40.45 1ub7 s TYR 208 CO 0.47 -0.04 0.17 1.41 -1.34 0.00 0.00 175.55 176.22 1ub7 s MET 209 N -0.37 0.09 -0.87 4.97 -2.45 -1.26 -2.01 119.30 117.40 1ub7 s MET 209 Ca 0.06 0.47 -0.17 0.00 -1.25 0.00 0.00 55.69 54.80 1ub7 s MET 209 Cb -0.07 -0.20 0.17 0.00 1.25 0.00 0.00 34.83 35.98 1ub7 s MET 209 CO -0.00 -0.22 0.96 1.21 1.05 0.00 0.00 175.02 178.01 1ub7 s ASN 210 N 1.61 6.67 0.25 1.11 2.47 -0.52 -4.93 114.94 121.59 1ub7 s ASN 210 Ca -0.05 -2.29 -0.04 0.00 0.42 0.00 0.00 52.86 50.91 1ub7 s ASN 210 Cb -0.12 -2.32 0.45 0.00 -1.45 0.00 0.00 41.25 37.82 1ub7 s ASN 210 CO -0.06 -0.86 1.76 1.23 -3.72 0.00 0.00 177.10 175.45 1ub7 h GLY 211 N 9.28 1.22 0.62 1.21 0.00 -1.97 -2.84 103.07 110.61 1ub7 h GLY 211 Ca 0.11 -0.22 0.05 0.00 0.00 0.00 0.00 47.33 47.28 1ub7 h GLY 211 CO 0.96 -0.01 0.16 3.21 0.00 0.00 0.00 176.54 180.85 1ub7 h ARG 212 N 0.58 0.33 0.21 4.80 -0.00 -1.98 -2.28 114.38 116.04 1ub7 h ARG 212 Ca 0.41 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.98 59.86 1ub7 h ARG 212 Cb 0.55 -0.07 0.00 0.00 0.00 0.00 0.00 29.97 30.44 1ub7 h ARG 212 CO -0.34 0.22 -0.10 0.93 0.00 0.00 0.00 179.97 180.67 1ub7 h GLU 213 N 0.34 -0.28 -1.00 0.04 4.39 -1.95 -3.19 114.58 112.93 1ub7 h GLU 213 Ca 0.20 0.02 0.28 0.00 0.34 0.00 0.00 59.36 60.20 1ub7 h GLU 213 Cb 0.19 0.06 -0.14 0.00 -0.10 0.00 0.00 28.75 28.76 1ub7 h GLU 213 CO -0.20 0.10 0.58 0.28 -1.16 0.00 0.00 179.01 178.61 1ub7 h VAL 214 N -0.78 0.43 -0.01 3.13 2.07 -1.46 -0.05 116.25 119.58 1ub7 h VAL 214 Ca -0.03 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1ub7 h VAL 214 Cb 0.51 -0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.20 1ub7 h VAL 214 CO 0.05 0.08 0.00 0.15 0.02 0.00 0.00 177.57 177.88 1ub7 h PHE 215 N 0.46 0.01 0.01 1.57 3.04 -1.44 -0.53 116.94 120.07 1ub7 h PHE 215 Ca 0.68 -0.00 0.02 0.00 3.98 0.00 0.00 57.97 62.65 1ub7 h PHE 215 Cb 1.42 -0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.90 1ub7 h PHE 215 CO -0.01 0.06 -0.13 0.87 -2.02 0.00 0.00 178.31 177.08 1ub7 h LYS 216 N -0.05 -0.22 -0.28 1.11 1.57 -1.02 -2.38 116.57 115.30 1ub7 h LYS 216 Ca 0.00 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.86 1ub7 h LYS 216 Cb 0.06 0.05 -0.08 0.00 0.08 0.00 0.00 32.23 32.34 1ub7 h LYS 216 CO -0.00 -0.15 -0.26 0.35 -0.57 0.00 0.00 179.45 178.82 1ub7 h PHE 217 N -0.23 -0.70 -0.14 -1.35 3.57 -1.23 -2.79 116.94 114.06 1ub7 h PHE 217 Ca 0.04 0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.60 1ub7 h PHE 217 Cb 0.28 0.35 -0.03 0.00 2.79 0.00 0.00 35.95 39.35 1ub7 h PHE 217 CO -0.19 -0.34 -0.20 0.00 -2.23 0.00 0.00 178.31 175.36 1ub7 h ALA 218 N 0.79 -0.47 -0.65 2.41 0.00 -0.61 0.93 119.26 121.65 1ub7 h ALA 218 Ca 0.15 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.10 1ub7 h ALA 218 Cb 0.48 0.85 -0.05 0.00 0.00 0.00 0.00 17.79 19.08 1ub7 h ALA 218 CO -0.43 -0.56 0.39 0.28 0.00 0.00 0.00 179.25 178.93 1ub7 h VAL 219 N -0.14 1.04 0.13 0.00 2.07 -1.42 0.17 116.25 118.10 1ub7 h VAL 219 Ca 0.03 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.28 1ub7 h VAL 219 Cb 0.21 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.21 1ub7 h VAL 219 CO -0.21 0.14 -0.06 0.03 0.02 0.00 0.00 177.57 177.48 1ub7 h ARG 220 N 0.75 -0.17 0.24 1.57 3.08 -1.29 -2.74 114.38 115.81 1ub7 h ARG 220 Ca 0.28 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.33 1ub7 h ARG 220 Cb 0.09 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1ub7 h ARG 220 CO -0.14 -0.10 -0.11 -0.24 -1.07 0.00 0.00 179.97 178.31 1ub7 h VAL 221 N -0.19 0.82 -0.71 2.04 3.04 -0.51 -2.32 116.25 118.42 1ub7 h VAL 221 Ca -0.02 -0.38 0.13 0.00 -1.01 0.00 0.00 66.70 65.42 1ub7 h VAL 221 Cb 0.15 1.04 -0.13 0.00 -2.01 0.00 0.00 31.29 30.34 1ub7 h VAL 221 CO 0.03 0.08 -0.29 0.24 -1.01 0.00 0.00 177.57 176.63 1ub7 h MET 222 N -0.52 -0.08 0.79 4.17 2.86 -0.67 0.36 114.93 121.85 1ub7 h MET 222 Ca -0.03 0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.57 1ub7 h MET 222 Cb 0.38 0.02 0.01 0.00 0.06 0.00 0.00 31.60 32.07 1ub7 h MET 222 CO 0.05 -0.05 -0.38 -0.91 1.06 0.00 0.00 176.91 176.68 1ub7 h ASN 223 N -0.08 -0.90 -0.36 1.22 -0.26 -1.49 -0.33 115.58 113.39 1ub7 h ASN 223 Ca 0.30 0.02 0.04 0.00 -0.56 0.00 0.00 56.30 56.09 1ub7 h ASN 223 Cb 0.56 0.23 -0.04 0.00 -1.06 0.00 0.00 38.32 38.02 1ub7 h ASN 223 CO -0.76 -0.59 0.14 0.74 -1.06 0.00 0.00 177.43 175.89 1ub7 h THR 224 N -1.15 0.92 -0.38 2.81 2.02 -0.96 0.14 112.91 116.30 1ub7 h THR 224 Ca -0.11 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 66.94 1ub7 h THR 224 Cb 0.83 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.82 1ub7 h THR 224 CO 0.18 0.05 0.10 0.00 0.37 0.00 0.00 175.52 176.22 1ub7 h ALA 225 N 1.22 0.50 0.08 6.16 0.00 -0.35 -1.48 119.26 125.39 1ub7 h ALA 225 Ca 0.16 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1ub7 h ALA 225 Cb 0.12 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1ub7 h ALA 225 CO -0.15 0.17 -0.24 1.15 0.00 0.00 0.00 179.25 180.18 1ub7 h THR 226 N 0.47 0.46 -0.66 0.00 2.02 -0.65 -0.54 112.91 114.00 1ub7 h THR 226 Ca 0.12 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.30 1ub7 h THR 226 Cb 0.30 0.46 -0.03 0.00 -1.74 0.00 0.00 68.15 67.13 1ub7 h THR 226 CO 0.00 0.00 0.42 -0.07 0.37 0.00 0.00 175.52 176.24 1ub7 h LEU 227 N -0.42 0.78 -0.44 2.58 3.38 -0.90 -0.65 115.31 119.64 1ub7 h LEU 227 Ca 0.04 -0.03 -0.15 0.00 0.09 0.00 0.00 57.88 57.83 1ub7 h LEU 227 Cb 0.46 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1ub7 h LEU 227 CO -0.16 0.58 -0.33 -0.08 0.09 0.00 0.00 178.44 178.54 1ub7 h GLU 228 N 0.91 0.95 -0.52 1.13 4.81 -0.88 -0.90 114.58 120.07 1ub7 h GLU 228 Ca 0.24 -0.47 -0.08 0.00 -0.13 0.00 0.00 59.36 58.93 1ub7 h GLU 228 Cb -0.07 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 1ub7 h GLU 228 CO -0.05 1.13 0.01 0.00 -0.73 0.00 0.00 179.01 179.37 1ub7 h ALA 229 N 0.82 0.70 -0.20 2.92 0.00 -0.53 0.47 119.26 123.45 1ub7 h ALA 229 Ca 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1ub7 h ALA 229 Cb 0.92 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1ub7 h ALA 229 CO 0.09 0.51 0.06 0.82 0.00 0.00 0.00 179.25 180.72 1ub7 h ILE 230 N 0.78 1.19 0.16 0.00 2.04 -1.04 -0.53 117.51 120.12 1ub7 h ILE 230 Ca 0.15 -0.59 0.01 0.00 1.00 0.00 0.00 64.86 65.43 1ub7 h ILE 230 Cb 0.51 1.20 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 1ub7 h ILE 230 CO 0.02 0.19 -0.18 -0.08 0.00 0.00 0.00 178.15 178.10 1ub7 h GLU 231 N 0.15 -0.37 -0.07 2.37 4.57 -0.91 -2.06 114.58 118.26 1ub7 h GLU 231 Ca 0.07 0.03 0.02 0.00 -1.18 0.00 0.00 59.36 58.29 1ub7 h GLU 231 Cb 0.23 0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 28.90 1ub7 h GLU 231 CO -0.00 -0.25 0.06 -0.22 -1.18 0.00 0.00 179.01 177.43 1ub7 h LYS 232 N -0.38 0.00 -0.00 1.92 3.64 0.12 -0.03 116.57 121.83 1ub7 h LYS 232 Ca 0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1ub7 h LYS 232 Cb 0.37 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1ub7 h LYS 232 CO -0.06 0.00 -0.03 0.00 -2.27 0.00 0.00 179.45 177.10 1ub7 n ALA 233 N -2.43 2.62 -2.16 5.00 0.00 -0.22 -4.86 120.51 118.45 1ub7 n ALA 233 Ca -0.01 -0.21 -0.04 0.00 0.00 0.00 0.00 53.44 53.18 1ub7 n ALA 233 Cb 0.17 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.17 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 1.18 0.26 2.86 0.00 0.00 -0.02 -4.95 105.19 104.51 1ub7 n GLY 234 Ca 0.18 -0.68 -0.21 0.00 0.00 0.00 0.00 46.02 45.30 1ub7 n GLY 234 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ub7 n LEU 235 N -0.71 0.00 -4.26 0.99 4.77 -0.98 -5.06 117.00 111.75 1ub7 n LEU 235 Ca -0.04 -2.68 -0.19 0.00 -0.03 0.00 0.00 56.01 53.07 1ub7 n LEU 235 Cb 0.53 0.93 -0.11 0.00 -2.33 0.00 0.00 43.42 42.44 1ub7 n LEU 235 CO 0.07 -0.42 -0.46 0.42 -1.33 0.00 0.00 177.39 175.67 1ub7 s THR 236 N -2.88 1.47 0.52 -5.08 -4.23 -1.26 -4.15 115.64 100.02 1ub7 s THR 236 Ca 0.19 -1.74 0.16 0.00 -1.18 0.00 0.00 61.69 59.12 1ub7 s THR 236 Cb 0.01 -1.59 0.16 0.00 1.34 0.00 0.00 72.50 72.42 1ub7 s THR 236 CO 0.13 -0.36 1.45 1.55 -0.54 0.00 0.00 174.62 176.86 1ub7 h PRO 237 N 3.52 0.00 0.00 3.99 0.13 -1.96 0.66 132.00 138.34 1ub7 h PRO 237 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1ub7 h PRO 237 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1ub7 h PRO 237 CO 0.49 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.65 1ub7 n GLU 238 N -2.53 0.21 0.02 0.86 4.71 -1.26 -3.21 120.64 119.44 1ub7 n GLU 238 Ca -0.01 0.20 0.12 0.00 -0.01 0.00 0.00 57.16 57.45 1ub7 n GLU 238 Cb 0.57 -1.76 0.14 0.00 -1.01 0.00 0.00 31.44 29.38 1ub7 n GLU 238 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1ub7 n ASP 239 N -2.14 0.61 -4.66 1.62 8.00 0.23 -4.86 116.55 115.35 1ub7 n ASP 239 Ca 0.06 -0.23 -0.43 0.00 0.71 0.00 0.00 54.79 54.90 1ub7 n ASP 239 Cb 0.40 0.44 -0.02 0.00 -0.02 0.00 0.00 41.12 41.92 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 -3.09 4.36 0.06 0.53 -1.09 -1.20 -4.38 121.20 116.40 1ub7 s ILE 240 Ca 0.08 1.65 -0.15 0.00 -2.23 0.00 0.00 60.65 60.00 1ub7 s ILE 240 Cb 0.16 -4.06 -0.23 0.00 -1.58 0.00 0.00 42.46 36.74 1ub7 s ILE 240 CO 0.75 -0.14 1.18 -0.09 -1.23 0.00 0.00 174.94 175.40 1ub7 h ARG 241 N 8.01 0.65 -3.11 2.79 9.65 -1.05 -3.47 114.38 127.86 1ub7 h ARG 241 Ca -0.25 -0.69 -0.16 0.00 -1.10 0.00 0.00 59.98 57.78 1ub7 h ARG 241 Cb 1.10 0.19 -0.25 0.00 -1.39 0.00 0.00 29.97 29.62 1ub7 h ARG 241 CO 0.97 1.28 -0.41 -1.17 2.80 0.00 0.00 179.97 183.44 1ub7 s LEU 242 N -8.18 1.01 -0.21 3.80 2.96 -1.22 -4.78 118.68 112.07 1ub7 s LEU 242 Ca -0.11 0.49 -0.06 0.00 -0.22 0.00 0.00 54.13 54.23 1ub7 s LEU 242 Cb 0.06 0.91 -0.03 0.00 0.50 0.00 0.00 46.19 47.64 1ub7 s LEU 242 CO 0.90 -0.12 0.02 -0.36 -1.32 0.00 0.00 176.35 175.47 1ub7 s PHE 243 N 0.02 3.07 -0.47 5.38 0.08 0.01 -0.99 117.98 125.08 1ub7 s PHE 243 Ca -0.01 -0.40 0.04 0.00 0.12 0.00 0.00 56.93 56.68 1ub7 s PHE 243 Cb -0.02 -2.11 0.12 0.00 -0.57 0.00 0.00 43.02 40.44 1ub7 s PHE 243 CO 0.01 -0.22 0.21 0.08 -0.10 0.00 0.00 175.22 175.20 1ub7 s VAL 244 N 1.05 2.36 0.56 -0.44 1.01 0.11 -0.60 120.40 124.45 1ub7 s VAL 244 Ca 0.03 -3.01 -0.04 0.00 0.00 0.00 0.00 61.98 58.95 1ub7 s VAL 244 Cb -0.14 -2.67 0.01 0.00 0.00 0.00 0.00 36.38 33.58 1ub7 s VAL 244 CO 0.02 -0.77 0.85 -2.16 0.00 0.00 0.00 175.10 173.04 1ub7 s PRO 245 N 0.05 2.96 0.40 2.72 0.04 -1.26 -2.52 135.00 137.39 1ub7 s PRO 245 Ca 0.16 -0.11 -0.27 0.00 0.04 0.00 0.00 61.00 60.82 1ub7 s PRO 245 Cb -0.24 -2.34 -0.10 0.00 0.04 0.00 0.00 34.50 31.86 1ub7 s PRO 245 CO -0.02 -0.60 1.42 -1.58 0.04 0.00 0.00 177.00 176.26 1ub7 s HIS 246 N -2.89 2.64 -1.19 0.56 5.65 0.22 -4.70 115.29 115.57 1ub7 s HIS 246 Ca 0.53 1.26 -0.10 0.00 0.25 0.00 0.00 55.06 57.00 1ub7 s HIS 246 Cb -0.10 -3.90 0.21 0.00 -1.18 0.00 0.00 32.58 27.61 1ub7 s HIS 246 CO 0.44 -2.70 1.49 1.04 -0.65 0.00 0.00 174.74 174.36 1ub7 n GLN 247 N 0.25 3.63 -0.12 2.88 1.13 -1.26 -4.73 117.38 119.15 1ub7 n GLN 247 Ca 0.02 -3.99 -0.24 0.00 -1.94 0.00 0.00 57.00 50.86 1ub7 n GLN 247 Cb 0.41 -2.84 -0.11 0.00 0.11 0.00 0.00 30.24 27.81 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 3.98 1.26 -3.69 -1.58 0.00 -1.26 -3.81 120.51 115.40 1ub7 n ALA 248 Ca 0.33 -1.04 -0.10 0.00 0.00 0.00 0.00 53.44 52.64 1ub7 n ALA 248 Cb 0.39 -0.06 -0.11 0.00 0.00 0.00 0.00 19.45 19.68 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 -7.02 -0.46 0.26 0.00 3.84 -1.26 -4.65 114.94 105.64 1ub7 s ASN 249 Ca -0.36 0.91 -0.03 0.00 0.21 0.00 0.00 52.86 53.59 1ub7 s ASN 249 Cb 0.11 0.87 0.32 0.00 -0.55 0.00 0.00 41.25 42.01 1ub7 s ASN 249 CO 0.56 -0.20 1.81 0.25 -2.79 0.00 0.00 177.10 176.73 1ub7 h LEU 250 N 7.32 0.89 -0.81 3.21 5.85 -0.79 -1.18 115.31 129.80 1ub7 h LEU 250 Ca -0.33 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.27 1ub7 h LEU 250 Cb 1.17 -0.23 -0.05 0.00 0.37 0.00 0.00 40.66 41.92 1ub7 h LEU 250 CO 0.26 0.83 0.53 0.03 -0.34 0.00 0.00 178.44 179.75 1ub7 h ARG 251 N 0.93 1.02 -0.23 1.25 2.47 -1.84 0.16 114.38 118.14 1ub7 h ARG 251 Ca 0.21 -0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 58.85 1ub7 h ARG 251 Cb 0.26 -0.23 -0.01 0.00 -1.65 0.00 0.00 29.97 28.34 1ub7 h ARG 251 CO -0.01 0.67 0.07 0.82 0.56 0.00 0.00 179.97 182.08 1ub7 h ILE 252 N 1.05 1.20 -0.23 2.04 2.04 -1.81 -1.56 117.51 120.24 1ub7 h ILE 252 Ca 0.32 -0.63 0.03 0.00 1.00 0.00 0.00 64.86 65.57 1ub7 h ILE 252 Cb -0.04 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1ub7 h ILE 252 CO -0.10 0.20 0.05 0.40 0.00 0.00 0.00 178.15 178.70 1ub7 h ILE 253 N 0.20 0.90 -0.34 -0.67 2.04 -0.62 -1.30 117.51 117.72 1ub7 h ILE 253 Ca 0.07 -0.05 0.05 0.00 1.00 0.00 0.00 64.86 65.93 1ub7 h ILE 253 Cb 0.25 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 37.03 1ub7 h ILE 253 CO -0.00 0.02 0.08 -0.78 0.00 0.00 0.00 178.15 177.47 1ub7 h ASP 254 N 0.14 0.03 -0.16 1.72 1.82 -0.63 -0.61 116.42 118.72 1ub7 h ASP 254 Ca 0.10 0.05 0.05 0.00 -0.39 0.00 0.00 57.03 56.84 1ub7 h ASP 254 Cb 0.10 0.07 -0.05 0.00 0.68 0.00 0.00 39.33 40.12 1ub7 h ASP 254 CO -0.14 0.05 -0.17 0.00 -1.61 0.00 0.00 179.24 177.37 1ub7 h ALA 255 N 1.25 -0.08 0.00 -0.78 0.00 -0.67 -1.42 119.26 117.55 1ub7 h ALA 255 Ca 0.16 0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.07 1ub7 h ALA 255 Cb 0.17 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1ub7 h ALA 255 CO -0.20 -0.62 -0.26 0.00 0.00 0.00 0.00 179.25 178.17 1ub7 h ALA 256 N 0.86 1.57 -0.48 0.00 0.00 -0.89 -2.80 119.26 117.51 1ub7 h ALA 256 Ca 0.11 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1ub7 h ALA 256 Cb 0.36 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1ub7 h ALA 256 CO -0.28 0.32 -0.07 -0.09 0.00 0.00 0.00 179.25 179.14 1ub7 h ARG 257 N 0.00 0.86 -0.00 0.00 2.43 -0.06 -3.16 114.38 114.44 1ub7 h ARG 257 Ca -0.00 -0.27 -0.00 0.00 -0.81 0.00 0.00 59.98 58.89 1ub7 h ARG 257 Cb 0.46 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 1ub7 h ARG 257 CO 0.03 0.90 -0.00 0.93 -1.51 0.00 0.00 179.97 180.32 1ub7 h GLU 258 N 0.78 0.00 0.00 0.20 5.08 -1.15 -1.18 114.58 118.32 1ub7 h GLU 258 Ca 0.14 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1ub7 h GLU 258 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 1ub7 h GLU 258 CO 0.03 0.61 0.00 0.54 -1.00 0.00 0.00 179.01 179.19 1ub7 n ARG 259 N -4.80 0.00 0.00 2.33 3.00 -1.09 0.19 116.66 116.30 1ub7 n ARG 259 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.75 1ub7 n ARG 259 Cb 0.30 -1.08 0.00 0.00 0.00 0.00 0.00 32.46 31.68 1ub7 n ARG 259 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1ub7 n LEU 260 N -0.48 0.02 -2.82 0.55 4.77 -1.10 -5.03 117.00 112.91 1ub7 n LEU 260 Ca 0.00 -0.28 -0.14 0.00 -0.03 0.00 0.00 56.01 55.56 1ub7 n LEU 260 Cb 0.00 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.16 1ub7 n LEU 260 CO 0.00 0.00 0.10 0.61 -1.33 0.00 0.00 177.39 176.78 1ub7 n GLY 261 N 0.52 -0.16 3.64 -0.72 0.00 0.52 -5.01 105.19 103.98 1ub7 n GLY 261 Ca 0.00 -0.03 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 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 -5.36 3.39 0.29 0.99 1.43 -0.49 -5.04 118.68 113.90 1ub7 s LEU 262 Ca 0.09 0.06 -0.28 0.00 -1.03 0.00 0.00 54.13 52.97 1ub7 s LEU 262 Cb -0.04 -1.78 -0.09 0.00 0.03 0.00 0.00 46.19 44.31 1ub7 s LEU 262 CO 0.55 0.36 0.99 -2.84 0.23 0.00 0.00 176.35 175.63 1ub7 s PRO 263 N -0.91 4.64 0.50 1.29 0.02 -1.26 -4.71 135.00 134.57 1ub7 s PRO 263 Ca 0.13 1.50 0.29 0.00 0.02 0.00 0.00 61.00 62.94 1ub7 s PRO 263 Cb -0.11 -3.01 1.39 0.00 0.02 0.00 0.00 34.50 32.78 1ub7 s PRO 263 CO 0.03 0.30 1.84 -1.49 -0.33 0.00 0.00 177.00 177.34 1ub7 h TRP 264 N 3.56 0.19 0.00 6.54 4.06 -1.97 -0.33 115.95 128.00 1ub7 h TRP 264 Ca -0.46 0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.49 1ub7 h TRP 264 Cb 1.20 -0.06 0.00 0.00 -1.00 0.00 0.00 29.16 29.31 1ub7 h TRP 264 CO 0.60 0.03 0.00 0.39 -3.56 0.00 0.00 178.44 175.90 1ub7 n GLU 265 N -4.34 0.05 -0.43 0.49 4.71 -1.26 -1.52 120.64 118.33 1ub7 n GLU 265 Ca 0.22 0.30 0.08 0.00 -0.01 0.00 0.00 57.16 57.75 1ub7 n GLU 265 Cb 1.01 -1.50 0.26 0.00 -1.01 0.00 0.00 31.44 30.19 1ub7 n GLU 265 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 1ub7 n ARG 266 N -1.38 3.13 -4.56 3.49 1.74 -0.13 -4.94 116.66 114.02 1ub7 n ARG 266 Ca 0.02 -2.70 -0.24 0.00 -0.77 0.00 0.00 57.85 54.16 1ub7 n ARG 266 Cb 0.06 -1.76 -0.16 0.00 -1.02 0.00 0.00 32.46 29.58 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 -2.36 1.07 -0.01 1.55 1.01 -0.58 -0.81 120.40 120.27 1ub7 s VAL 267 Ca 0.40 -0.46 -0.25 0.00 0.00 0.00 0.00 61.98 61.66 1ub7 s VAL 267 Cb 0.30 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.66 1ub7 s VAL 267 CO 0.12 0.34 0.77 0.00 0.00 0.00 0.00 175.10 176.33 1ub7 s ALA 268 N 0.55 3.32 -0.03 5.51 0.00 0.23 -4.93 121.76 126.40 1ub7 s ALA 268 Ca -0.12 0.26 -0.01 0.00 0.00 0.00 0.00 51.96 52.09 1ub7 s ALA 268 Cb -0.14 -3.03 0.03 0.00 0.00 0.00 0.00 23.12 19.97 1ub7 s ALA 268 CO 0.03 -0.06 0.04 0.08 0.00 0.00 0.00 175.76 175.85 1ub7 s VAL 269 N 0.51 -0.04 0.00 0.00 1.01 -1.26 -4.58 120.40 116.04 1ub7 s VAL 269 Ca 0.40 0.30 0.00 0.00 0.00 0.00 0.00 61.98 62.68 1ub7 s VAL 269 Cb -0.19 -0.15 0.00 0.00 0.00 0.00 0.00 36.38 36.04 1ub7 s VAL 269 CO 0.22 0.14 0.44 -0.46 0.00 0.00 0.00 175.10 175.44 1ub7 n ASN 270 N 4.75 0.00 0.29 3.32 2.04 -1.26 -4.88 115.26 119.52 1ub7 n ASN 270 Ca -0.15 -1.14 0.15 0.00 -0.44 0.00 0.00 54.58 53.00 1ub7 n ASN 270 Cb 0.50 -0.03 0.88 0.00 -2.53 0.00 0.00 39.78 38.60 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 3.70 0.44 0.00 3.53 3.04 -1.86 -1.77 116.25 123.33 1ub7 h VAL 271 Ca 0.00 -0.23 -0.05 0.00 -1.01 0.00 0.00 66.70 65.42 1ub7 h VAL 271 Cb 1.06 1.15 -0.01 0.00 -2.01 0.00 0.00 31.29 31.48 1ub7 h VAL 271 CO 0.00 0.05 -0.22 -2.24 -1.01 0.00 0.00 177.57 174.14 1ub7 h ASP 272 N 0.00 0.00 0.00 3.17 2.03 -1.87 -0.93 116.42 118.81 1ub7 h ASP 272 Ca -0.00 0.00 -0.25 0.00 -0.73 0.00 0.00 57.03 56.05 1ub7 h ASP 272 Cb 0.15 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.60 1ub7 h ASP 272 CO 0.01 0.22 -2.04 0.54 -1.03 0.00 0.00 179.24 176.94 1ub7 n ARG 273 N -3.48 1.30 -0.01 4.15 1.74 -0.73 -1.05 116.66 118.58 1ub7 n ARG 273 Ca -0.00 -0.03 0.02 0.00 -0.77 0.00 0.00 57.85 57.07 1ub7 n ARG 273 Cb 0.40 -1.40 0.03 0.00 -1.02 0.00 0.00 32.46 30.46 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 -2.51 0.04 -4.96 -1.55 4.01 -0.80 -2.73 117.16 108.66 1ub7 n TYR 274 Ca -0.23 -0.11 0.00 0.00 -0.16 0.00 0.00 57.90 57.41 1ub7 n TYR 274 Cb 0.93 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.95 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 0.15 -0.06 3.58 2.72 0.00 -0.35 -3.88 105.19 107.34 1ub7 n GLY 275 Ca 0.03 -0.93 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 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 6.57 -0.24 1.61 3.84 0.05 -4.61 114.94 118.16 1ub7 s ASN 276 Ca 0.00 0.29 0.14 0.00 0.21 0.00 0.00 52.86 53.50 1ub7 s ASN 276 Cb 0.00 -2.49 0.73 0.00 -0.55 0.00 0.00 41.25 38.94 1ub7 s ASN 276 CO 0.00 -1.12 1.67 0.35 -2.79 0.00 0.00 177.10 175.21 1ub7 n THR 277 N 6.56 2.68 0.00 -5.21 -2.24 -1.26 0.23 114.28 115.04 1ub7 n THR 277 Ca 0.09 -1.60 0.00 0.00 -2.27 0.00 0.00 64.05 60.27 1ub7 n THR 277 Cb 0.49 -0.29 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 0.18 0.00 0.08 3.42 2.88 -1.26 -1.63 113.62 117.28 1ub7 n SER 278 Ca 0.28 0.00 0.20 0.00 -1.33 0.00 0.00 58.87 58.03 1ub7 n SER 278 Cb 1.15 0.00 0.75 0.00 -0.75 0.00 0.00 64.21 65.35 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 0.45 0.00 2.46 1.35 -1.88 0.12 112.91 115.41 1ub7 h THR 279 Ca 0.00 0.00 -0.10 0.00 -0.55 0.00 0.00 66.41 65.76 1ub7 h THR 279 Cb 0.00 0.68 -0.01 0.00 -1.73 0.00 0.00 68.15 67.08 1ub7 h THR 279 CO 0.00 0.00 -0.47 0.00 -0.25 0.00 0.00 175.52 174.80 1ub7 h ALA 280 N 1.57 0.77 -0.70 6.62 0.00 -1.42 -3.38 119.26 122.72 1ub7 h ALA 280 Ca 0.20 -0.43 0.09 0.00 0.00 0.00 0.00 54.91 54.77 1ub7 h ALA 280 Cb 1.03 -0.08 -0.11 0.00 0.00 0.00 0.00 17.79 18.64 1ub7 h ALA 280 CO -0.00 0.59 -0.50 1.03 0.00 0.00 0.00 179.25 180.37 1ub7 h SER 281 N 0.00 -1.75 -0.19 0.00 0.87 -0.72 -2.12 113.55 109.64 1ub7 h SER 281 Ca -0.00 0.28 -0.02 0.00 -1.23 0.00 0.00 61.79 60.81 1ub7 h SER 281 Cb 1.22 0.78 -0.01 0.00 -0.44 0.00 0.00 62.40 63.95 1ub7 h SER 281 CO 0.06 -0.32 0.04 0.40 -0.53 0.00 0.00 176.83 176.49 1ub7 h ILE 282 N -0.18 1.21 -0.05 2.23 2.04 -1.76 -2.36 117.51 118.64 1ub7 h ILE 282 Ca 0.17 -0.67 -0.03 0.00 1.00 0.00 0.00 64.86 65.33 1ub7 h ILE 282 Cb 0.53 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 1ub7 h ILE 282 CO -0.77 0.21 -0.12 1.55 0.00 0.00 0.00 178.15 179.01 1ub7 h PRO 283 N 0.11 0.07 0.00 2.37 0.13 -1.76 0.13 132.00 133.05 1ub7 h PRO 283 Ca 0.06 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1ub7 h PRO 283 Cb 0.28 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.39 1ub7 h PRO 283 CO 0.00 0.20 -0.00 -0.07 -0.23 0.00 0.00 178.00 177.90 1ub7 h LEU 284 N 0.07 -0.00 -0.72 1.56 3.38 -1.22 -0.24 115.31 118.13 1ub7 h LEU 284 Ca 0.01 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.70 1ub7 h LEU 284 Cb 0.26 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 1ub7 h LEU 284 CO 0.02 0.29 0.47 0.00 0.09 0.00 0.00 178.44 179.31 1ub7 h ALA 285 N 0.70 0.92 -0.13 1.53 0.00 -1.00 -1.69 119.26 119.59 1ub7 h ALA 285 Ca -0.00 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.89 1ub7 h ALA 285 Cb 0.30 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1ub7 h ALA 285 CO 0.00 0.31 -0.03 -0.07 0.00 0.00 0.00 179.25 179.46 1ub7 h LEU 286 N 0.95 -0.12 0.09 0.00 3.38 -0.60 -0.87 115.31 118.14 1ub7 h LEU 286 Ca 0.27 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.30 1ub7 h LEU 286 Cb -0.08 0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1ub7 h LEU 286 CO -0.07 -0.04 -0.25 0.50 0.09 0.00 0.00 178.44 178.67 1ub7 h LYS 287 N -0.00 -0.42 -0.60 1.13 3.64 -0.57 0.17 116.57 119.91 1ub7 h LYS 287 Ca 0.06 0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.56 1ub7 h LYS 287 Cb 0.09 0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 31.94 1ub7 h LYS 287 CO -0.13 -0.28 0.22 0.93 -2.27 0.00 0.00 179.45 177.92 1ub7 h GLU 288 N -0.44 0.39 -0.74 1.90 5.08 -1.11 0.07 114.58 119.74 1ub7 h GLU 288 Ca 0.04 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.34 1ub7 h GLU 288 Cb 0.47 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 1ub7 h GLU 288 CO -0.16 0.26 0.34 0.00 -1.00 0.00 0.00 179.01 178.45 1ub7 h ALA 289 N 1.41 1.20 -0.50 3.43 0.00 -0.68 0.72 119.26 124.83 1ub7 h ALA 289 Ca 0.30 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1ub7 h ALA 289 Cb 0.37 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1ub7 h ALA 289 CO -0.30 0.60 -0.08 0.28 0.00 0.00 0.00 179.25 179.75 1ub7 h VAL 290 N 1.06 1.27 0.00 0.00 2.07 0.15 -0.76 116.25 120.03 1ub7 h VAL 290 Ca 0.25 -1.21 -0.06 0.00 0.82 0.00 0.00 66.70 66.51 1ub7 h VAL 290 Cb 0.14 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1ub7 h VAL 290 CO -0.03 0.42 -0.26 0.44 0.02 0.00 0.00 177.57 178.16 1ub7 h ASP 291 N 0.80 0.00 -0.39 0.57 3.32 -0.28 -2.62 116.42 117.82 1ub7 h ASP 291 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1ub7 h ASP 291 Cb 0.63 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.18 1ub7 h ASP 291 CO 0.04 0.26 0.00 0.00 -1.72 0.00 0.00 179.24 177.83 1ub7 n ALA 292 N -2.28 2.98 -1.19 3.45 0.00 0.18 -4.89 120.51 118.77 1ub7 n ALA 292 Ca -0.01 -1.01 -0.06 0.00 0.00 0.00 0.00 53.44 52.36 1ub7 n ALA 292 Cb 0.41 -1.03 -0.03 0.00 0.00 0.00 0.00 19.45 18.80 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 0.71 0.77 0.09 0.00 0.00 -0.99 -4.89 105.19 100.89 1ub7 n GLY 293 Ca 0.16 -0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.13 1ub7 n GLY 293 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ub7 n ARG 294 N -1.46 0.23 -4.14 1.61 1.74 -0.31 -4.74 116.66 109.59 1ub7 n ARG 294 Ca -0.06 0.19 -0.21 0.00 -0.77 0.00 0.00 57.85 57.00 1ub7 n ARG 294 Cb 0.38 -1.77 -0.16 0.00 -1.02 0.00 0.00 32.46 29.89 1ub7 n ARG 294 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1ub7 s ILE 295 N -3.09 0.56 0.17 0.55 1.01 -1.20 -4.85 121.20 114.34 1ub7 s ILE 295 Ca 0.11 -0.12 0.07 0.00 0.00 0.00 0.00 60.65 60.71 1ub7 s ILE 295 Cb 0.13 -0.59 -0.04 0.00 0.01 0.00 0.00 42.46 41.97 1ub7 s ILE 295 CO 0.59 0.24 -0.14 -0.13 0.00 0.00 0.00 174.94 175.49 1ub7 s ARG 296 N 1.00 1.19 0.08 2.79 1.81 -1.26 -4.74 118.95 119.83 1ub7 s ARG 296 Ca -0.10 -1.44 -0.37 0.00 -1.72 0.00 0.00 55.73 52.10 1ub7 s ARG 296 Cb -0.14 -1.01 -0.17 0.00 -0.45 0.00 0.00 34.95 33.18 1ub7 s ARG 296 CO -0.00 0.18 1.33 -1.91 -0.68 0.00 0.00 175.30 174.21 1ub7 n GLU 297 N 0.00 1.09 0.00 3.54 2.13 -1.26 -0.44 120.64 125.70 1ub7 n GLU 297 Ca -0.11 0.39 0.00 0.00 0.66 0.00 0.00 57.16 58.10 1ub7 n GLU 297 Cb 0.59 -2.03 0.00 0.00 0.27 0.00 0.00 31.44 30.27 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 2.47 3.39 3.78 8.31 0.00 -0.07 -4.96 105.19 118.11 1ub7 n GLY 298 Ca 0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.89 6.19 -0.21 1.61 1.01 0.42 -4.70 116.67 120.10 1ub7 s ASP 299 Ca 0.00 2.07 -0.14 0.00 0.71 0.00 0.00 52.55 55.19 1ub7 s ASP 299 Cb 0.00 -2.58 -0.04 0.00 1.01 0.00 0.00 42.92 41.31 1ub7 s ASP 299 CO 0.00 -0.89 0.33 -1.00 0.21 0.00 0.00 175.17 173.82 1ub7 s HIS 300 N -1.81 3.36 -0.04 4.23 3.76 -1.26 0.36 115.29 123.89 1ub7 s HIS 300 Ca 0.67 0.50 0.06 0.00 -0.15 0.00 0.00 55.06 56.15 1ub7 s HIS 300 Cb -0.21 -2.45 -0.02 0.00 1.11 0.00 0.00 32.58 31.00 1ub7 s HIS 300 CO 0.25 0.01 -0.22 0.08 -0.85 0.00 0.00 174.74 174.01 1ub7 s VAL 301 N 1.25 2.41 -0.13 -0.90 1.01 0.18 -0.38 120.40 123.84 1ub7 s VAL 301 Ca 0.16 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 1ub7 s VAL 301 Cb -0.14 -1.88 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 1ub7 s VAL 301 CO 0.07 0.58 -0.08 -0.22 0.00 0.00 0.00 175.10 175.45 1ub7 s LEU 302 N -0.59 3.02 -0.01 3.92 0.20 -0.16 -0.82 118.68 124.24 1ub7 s LEU 302 Ca 0.09 -0.19 0.07 0.00 0.69 0.00 0.00 54.13 54.79 1ub7 s LEU 302 Cb -0.11 -1.70 -0.02 0.00 -0.43 0.00 0.00 46.19 43.93 1ub7 s LEU 302 CO 0.00 0.20 -0.23 -0.76 -0.29 0.00 0.00 176.35 175.27 1ub7 s LEU 303 N 0.17 2.25 -0.22 -0.68 1.43 -0.05 0.08 118.68 121.65 1ub7 s LEU 303 Ca -0.04 -0.43 -0.18 0.00 -1.03 0.00 0.00 54.13 52.46 1ub7 s LEU 303 Cb -0.14 -1.39 0.06 0.00 0.03 0.00 0.00 46.19 44.75 1ub7 s LEU 303 CO 0.04 0.31 0.57 0.54 0.23 0.00 0.00 176.35 178.04 1ub7 s VAL 304 N -0.68 -0.00 0.06 -1.59 0.11 -1.05 0.04 120.40 117.29 1ub7 s VAL 304 Ca 0.11 0.01 -0.08 0.00 -2.93 0.00 0.00 61.98 59.10 1ub7 s VAL 304 Cb -0.10 -0.80 -0.01 0.00 -1.53 0.00 0.00 36.38 33.94 1ub7 s VAL 304 CO 0.00 0.01 0.16 -0.55 -3.33 0.00 0.00 175.10 171.38 1ub7 s SER 305 N 0.68 0.14 -0.00 3.54 0.15 0.15 -0.61 113.70 117.75 1ub7 s SER 305 Ca -0.03 -0.60 -0.06 0.00 0.70 0.00 0.00 55.95 55.96 1ub7 s SER 305 Cb -0.05 0.30 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 1ub7 s SER 305 CO -0.05 -0.64 0.12 0.72 1.20 0.00 0.00 173.24 174.59 1ub7 s PHE 306 N -3.36 0.05 0.00 3.44 -0.71 -1.26 -0.17 117.98 115.96 1ub7 s PHE 306 Ca 0.01 -0.13 0.00 0.00 -1.04 0.00 0.00 56.93 55.77 1ub7 s PHE 306 Cb 0.03 -0.05 0.00 0.00 -1.21 0.00 0.00 43.02 41.79 1ub7 s PHE 306 CO -0.08 -0.26 0.00 0.41 -1.34 0.00 0.00 175.22 173.95 1ub7 n GLY 307 N 1.60 1.60 3.74 1.99 0.00 0.24 -4.55 105.19 109.81 1ub7 n GLY 307 Ca -0.22 -0.45 -0.42 0.00 0.00 0.00 0.00 46.02 44.93 1ub7 n GLY 307 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ub7 s ALA 308 N -1.00 3.68 0.00 4.61 0.00 -1.26 -1.77 121.76 126.02 1ub7 s ALA 308 Ca 0.00 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1ub7 s ALA 308 Cb 0.00 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1ub7 s ALA 308 CO 0.00 -0.79 0.00 0.41 0.00 0.00 0.00 175.76 175.38 1ub7 n GLY 309 N 2.53 -0.12 3.79 0.00 0.00 -1.26 -3.48 105.19 106.65 1ub7 n GLY 309 Ca 0.09 0.24 -0.34 0.00 0.00 0.00 0.00 46.02 46.01 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 0.05 0.99 1.43 0.13 -3.53 118.68 121.52 1ub7 s LEU 310 Ca 0.00 1.97 0.03 0.00 -1.03 0.00 0.00 54.13 55.10 1ub7 s LEU 310 Cb 0.00 -4.56 -0.02 0.00 0.03 0.00 0.00 46.19 41.63 1ub7 s LEU 310 CO 0.00 -0.93 -0.10 -0.89 0.23 0.00 0.00 176.35 174.66 1ub7 s THR 311 N -2.00 0.70 0.03 5.49 2.01 -0.73 0.11 115.64 121.25 1ub7 s THR 311 Ca 0.68 -1.12 -0.13 0.00 0.31 0.00 0.00 61.69 61.43 1ub7 s THR 311 Cb -0.18 -0.74 0.02 0.00 0.01 0.00 0.00 72.50 71.61 1ub7 s THR 311 CO 0.24 -0.32 0.28 -1.66 -0.69 0.00 0.00 174.62 172.46 1ub7 s TRP 312 N -1.31 -0.08 -0.10 4.92 -2.14 -0.58 0.82 118.94 120.47 1ub7 s TRP 312 Ca -0.07 -0.01 -0.27 0.00 2.66 0.00 0.00 56.10 58.40 1ub7 s TRP 312 Cb -0.10 0.06 0.06 0.00 -3.10 0.00 0.00 33.47 30.40 1ub7 s TRP 312 CO 0.01 -0.45 0.64 0.00 -2.66 0.00 0.00 176.95 174.49 1ub7 s ALA 313 N -2.20 -1.65 0.03 2.67 0.00 0.76 -1.76 121.76 119.61 1ub7 s ALA 313 Ca -0.08 1.38 -0.05 0.00 0.00 0.00 0.00 51.96 53.21 1ub7 s ALA 313 Cb -0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 1ub7 s ALA 313 CO -0.01 -0.35 0.09 0.00 0.00 0.00 0.00 175.76 175.49 1ub7 s ALA 314 N -0.79 -0.09 -0.05 0.00 0.00 0.52 0.30 121.76 121.65 1ub7 s ALA 314 Ca -0.08 -0.50 -0.23 0.00 0.00 0.00 0.00 51.96 51.14 1ub7 s ALA 314 Cb -0.02 0.22 0.05 0.00 0.00 0.00 0.00 23.12 23.38 1ub7 s ALA 314 CO 0.07 -0.29 0.52 0.00 0.00 0.00 0.00 175.76 176.05 1ub7 s ALA 315 N -2.38 -1.33 -0.16 0.00 0.00 0.11 -0.50 121.76 117.51 1ub7 s ALA 315 Ca -0.07 0.92 -0.00 0.00 0.00 0.00 0.00 51.96 52.81 1ub7 s ALA 315 Cb -0.03 -0.03 -0.00 0.00 0.00 0.00 0.00 23.12 23.07 1ub7 s ALA 315 CO -0.04 -0.32 -0.15 0.08 0.00 0.00 0.00 175.76 175.34 1ub7 s VAL 316 N -1.15 2.69 -0.09 0.00 1.01 -0.44 -0.88 120.40 121.55 1ub7 s VAL 316 Ca -0.11 -0.76 0.02 0.00 0.00 0.00 0.00 61.98 61.13 1ub7 s VAL 316 Cb -0.02 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.22 1ub7 s VAL 316 CO 0.07 0.51 -0.14 -0.22 0.00 0.00 0.00 175.10 175.32 1ub7 s LEU 317 N 0.88 1.66 -0.41 3.92 2.96 0.00 0.23 118.68 127.92 1ub7 s LEU 317 Ca -0.04 -0.36 -0.21 0.00 -0.22 0.00 0.00 54.13 53.30 1ub7 s LEU 317 Cb -0.15 -0.96 0.02 0.00 0.50 0.00 0.00 46.19 45.59 1ub7 s LEU 317 CO -0.01 0.02 0.65 -0.89 -1.32 0.00 0.00 176.35 174.80 1ub7 s THR 318 N 0.85 4.84 0.66 3.68 2.01 -0.44 0.49 115.64 127.73 1ub7 s THR 318 Ca -0.10 0.26 -0.17 0.00 0.31 0.00 0.00 61.69 61.99 1ub7 s THR 318 Cb -0.15 -4.17 -0.01 0.00 0.01 0.00 0.00 72.50 68.17 1ub7 s THR 318 CO 0.01 -0.52 1.11 1.87 -0.69 0.00 0.00 174.62 176.40 1ub7 n TRP 319 N 6.22 1.26 -4.02 4.92 -0.00 0.16 -1.25 117.44 124.72 1ub7 n TRP 319 Ca -0.01 0.42 0.00 0.00 -0.00 0.00 0.00 57.50 57.90 1ub7 n TRP 319 Cb 0.48 -2.18 0.00 0.00 -0.00 0.00 0.00 31.31 29.62 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 1.07 0.03 2.30 5.87 0.00 -1.26 -0.90 105.19 112.30 1ub7 n GLY 320 Ca 0.15 -1.01 0.00 0.00 0.00 0.00 0.00 46.02 45.15 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 0.84 0.00 -0.02 0.00 -1.26 -4.50 105.19 100.25 1ub7 n GLY 321 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1ub7 n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32