#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k7f n GLU 2 N 0.00 1.30 -0.04 0.03 1.02 -1.26 -5.01 120.64 116.68 1k7f n GLU 2 Ca 0.00 -2.40 -0.08 0.00 -0.02 0.00 0.00 57.16 54.66 1k7f n GLU 2 Cb 0.00 -0.56 0.08 0.00 -0.02 0.00 0.00 31.44 30.94 1k7f n GLU 2 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1k7f h ARG 3 N 2.20 0.67 0.38 3.49 3.08 -1.97 -2.29 114.38 119.94 1k7f h ARG 3 Ca -0.24 -0.33 -0.02 0.00 0.07 0.00 0.00 59.98 59.46 1k7f h ARG 3 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.31 1k7f h ARG 3 CO 0.11 0.94 -0.18 1.88 -1.07 0.00 0.00 179.97 181.65 1k7f h TYR 4 N 0.56 -0.48 -0.37 3.04 0.05 -1.91 -0.16 116.97 117.70 1k7f h TYR 4 Ca 0.05 -0.01 0.08 0.00 0.05 0.00 0.00 58.73 58.90 1k7f h TYR 4 Cb 0.89 0.16 -0.09 0.00 1.01 0.00 0.00 36.73 38.71 1k7f h TYR 4 CO 0.04 -0.30 -0.26 0.93 -1.05 0.00 0.00 178.16 177.53 1k7f h GLU 5 N -0.51 -0.20 -0.30 4.88 5.08 -1.81 0.10 114.58 121.82 1k7f h GLU 5 Ca -0.05 0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.38 1k7f h GLU 5 Cb 0.39 0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.64 1k7f h GLU 5 CO 0.08 -0.13 -0.04 -0.91 -1.00 0.00 0.00 179.01 177.01 1k7f h ASN 6 N -0.21 -0.20 -1.00 1.42 -0.26 -1.33 -0.47 115.58 113.54 1k7f h ASN 6 Ca 0.18 0.08 0.03 0.00 -0.56 0.00 0.00 56.30 56.03 1k7f h ASN 6 Cb 0.48 0.15 -0.06 0.00 -1.06 0.00 0.00 38.32 37.84 1k7f h ASN 6 CO -0.49 -0.06 0.66 0.25 -1.06 0.00 0.00 177.43 176.73 1k7f h LEU 7 N 0.04 1.10 -0.22 1.61 5.85 -0.61 -2.02 115.31 121.06 1k7f h LEU 7 Ca 0.15 -0.02 -0.17 0.00 0.84 0.00 0.00 57.88 58.68 1k7f h LEU 7 Cb 0.21 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1k7f h LEU 7 CO -0.28 0.76 -0.81 -0.26 -0.34 0.00 0.00 178.44 177.52 1k7f h PHE 8 N 1.28 0.00 -0.31 1.25 0.04 -0.07 -1.21 116.94 117.93 1k7f h PHE 8 Ca 0.39 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 61.06 1k7f h PHE 8 Cb -0.04 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.11 1k7f h PHE 8 CO -0.00 0.81 -0.20 0.00 -0.60 0.00 0.00 178.31 178.32 1k7f h ALA 9 N 1.19 0.45 -0.38 2.45 0.00 -1.04 0.29 119.26 122.22 1k7f h ALA 9 Ca -0.01 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1k7f h ALA 9 Cb 1.52 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 1k7f h ALA 9 CO 0.11 0.39 0.22 1.96 0.00 0.00 0.00 179.25 181.92 1k7f h GLN 10 N 0.45 0.52 -0.04 0.00 4.20 -1.07 0.56 115.11 119.73 1k7f h GLN 10 Ca 0.06 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.57 1k7f h GLN 10 Cb 0.74 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 1k7f h GLN 10 CO 0.05 0.41 -0.67 -0.07 -0.67 0.00 0.00 178.83 177.88 1k7f h LEU 11 N 0.49 0.21 -0.33 1.46 3.38 -0.92 -0.13 115.31 119.46 1k7f h LEU 11 Ca 0.13 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1k7f h LEU 11 Cb 0.03 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1k7f h LEU 11 CO -0.02 0.82 -0.02 -1.13 0.09 0.00 0.00 178.44 178.18 1k7f h ASN 12 N 0.13 0.60 -0.97 -0.43 -0.73 -0.11 0.20 115.58 114.26 1k7f h ASN 12 Ca -0.01 -0.32 0.24 0.00 1.87 0.00 0.00 56.30 58.07 1k7f h ASN 12 Cb 1.20 -0.16 -0.07 0.00 0.27 0.00 0.00 38.32 39.55 1k7f h ASN 12 CO 0.10 0.78 0.64 0.44 -0.37 0.00 0.00 177.43 179.02 1k7f h ASP 13 N 0.40 0.39 -0.50 1.15 3.32 -0.08 0.65 116.42 121.76 1k7f h ASP 13 Ca 0.09 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1k7f h ASP 13 Cb 0.48 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.02 1k7f h ASP 13 CO 0.02 0.12 0.00 0.54 -1.72 0.00 0.00 179.24 178.20 1k7f n ARG 14 N -4.53 3.12 -4.10 3.56 1.74 -0.14 -4.95 116.66 111.36 1k7f n ARG 14 Ca 0.22 -2.19 -0.39 0.00 -0.77 0.00 0.00 57.85 54.72 1k7f n ARG 14 Cb 0.80 -1.76 -0.01 0.00 -1.02 0.00 0.00 32.46 30.47 1k7f n ARG 14 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1k7f n ARG 15 N 0.80 -0.79 -4.25 5.56 1.74 0.23 -4.98 116.66 114.97 1k7f n ARG 15 Ca 0.20 0.14 -0.18 0.00 -0.77 0.00 0.00 57.85 57.23 1k7f n ARG 15 Cb 0.72 -3.15 -0.11 0.00 -1.02 0.00 0.00 32.46 28.90 1k7f n ARG 15 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1k7f s GLU 16 N -7.22 1.04 0.61 5.56 2.12 0.53 -4.74 118.70 116.60 1k7f s GLU 16 Ca 0.31 -1.24 0.01 0.00 0.36 0.00 0.00 54.97 54.41 1k7f s GLU 16 Cb -0.16 -0.95 0.07 0.00 0.26 0.00 0.00 34.13 33.35 1k7f s GLU 16 CO 0.96 0.19 0.85 0.20 -0.54 0.00 0.00 175.26 176.92 1k7f s GLY 17 N -2.42 1.80 0.01 -1.50 0.00 0.11 -4.40 107.32 100.91 1k7f s GLY 17 Ca 0.09 -1.49 -0.18 0.00 0.00 0.00 0.00 44.72 43.13 1k7f s GLY 17 CO 0.03 -1.10 0.52 0.00 0.00 0.00 0.00 173.10 172.55 1k7f s ALA 18 N -2.89 3.58 -0.19 3.20 0.00 -0.66 -4.83 121.76 119.96 1k7f s ALA 18 Ca 0.61 -0.07 -0.04 0.00 0.00 0.00 0.00 51.96 52.46 1k7f s ALA 18 Cb -0.08 -2.60 -0.02 0.00 0.00 0.00 0.00 23.12 20.42 1k7f s ALA 18 CO 0.41 0.30 -0.03 0.12 0.00 0.00 0.00 175.76 176.55 1k7f s PHE 19 N -0.60 2.98 -0.25 0.00 5.36 -1.26 -1.89 117.98 122.31 1k7f s PHE 19 Ca 0.28 -0.60 -0.01 0.00 -0.96 0.00 0.00 56.93 55.64 1k7f s PHE 19 Cb -0.18 -2.04 0.08 0.00 -0.34 0.00 0.00 43.02 40.54 1k7f s PHE 19 CO 0.16 -0.30 0.04 0.08 -1.46 0.00 0.00 175.22 173.74 1k7f s VAL 20 N 0.97 0.94 0.37 3.12 1.01 -0.10 -1.13 120.40 125.57 1k7f s VAL 20 Ca 0.00 -1.10 -0.19 0.00 0.00 0.00 0.00 61.98 60.70 1k7f s VAL 20 Cb -0.15 -1.51 -0.10 0.00 0.00 0.00 0.00 36.38 34.63 1k7f s VAL 20 CO 0.01 -0.39 0.85 -2.16 0.00 0.00 0.00 175.10 173.41 1k7f s PRO 21 N 1.63 4.15 -0.10 2.72 0.04 -1.25 -1.25 135.00 140.95 1k7f s PRO 21 Ca 0.03 0.93 0.01 0.00 0.04 0.00 0.00 61.00 62.01 1k7f s PRO 21 Cb -0.18 -2.35 -0.02 0.00 0.04 0.00 0.00 34.50 31.99 1k7f s PRO 21 CO -0.15 0.09 -0.12 0.12 0.04 0.00 0.00 177.00 176.98 1k7f s PHE 22 N -2.04 2.81 0.21 0.56 2.19 0.25 -1.66 117.98 120.30 1k7f s PHE 22 Ca 0.57 -0.40 0.01 0.00 0.33 0.00 0.00 56.93 57.44 1k7f s PHE 22 Cb -0.10 -1.77 -0.05 0.00 -1.31 0.00 0.00 43.02 39.79 1k7f s PHE 22 CO 0.16 -0.02 0.08 0.14 1.83 0.00 0.00 175.22 177.41 1k7f s VAL 23 N -0.10 0.40 -0.21 3.12 -7.23 -0.79 -4.47 120.40 111.11 1k7f s VAL 23 Ca -0.01 -1.98 -0.13 0.00 -1.81 0.00 0.00 61.98 58.04 1k7f s VAL 23 Cb -0.14 -2.41 -0.04 0.00 0.56 0.00 0.00 36.38 34.35 1k7f s VAL 23 CO 0.03 -0.17 0.27 -0.89 -0.31 0.00 0.00 175.10 174.04 1k7f s THR 24 N -3.86 5.29 0.22 5.32 2.01 -1.26 -1.61 115.64 121.75 1k7f s THR 24 Ca 0.33 0.44 -0.30 0.00 0.31 0.00 0.00 61.69 62.47 1k7f s THR 24 Cb 0.07 -3.61 -0.09 0.00 0.01 0.00 0.00 72.50 68.88 1k7f s THR 24 CO 0.09 0.31 1.37 -0.76 -0.69 0.00 0.00 174.62 174.95 1k7f s LEU 25 N 1.08 4.40 0.00 4.42 1.43 -0.47 -2.29 118.68 127.26 1k7f s LEU 25 Ca 0.13 2.52 0.00 0.00 -1.03 0.00 0.00 54.13 55.76 1k7f s LEU 25 Cb -0.14 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.47 1k7f s LEU 25 CO 0.06 -0.61 0.00 0.61 0.23 0.00 0.00 176.35 176.64 1k7f n GLY 26 N 2.30 0.64 3.56 -3.19 0.00 -1.26 -4.71 105.19 102.53 1k7f n GLY 26 Ca 0.06 -0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 1k7f n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k7f s ASP 27 N -2.00 5.49 0.00 1.61 2.15 -0.97 -1.70 116.67 121.25 1k7f s ASP 27 Ca 0.00 -0.04 0.25 0.00 0.43 0.00 0.00 52.55 53.19 1k7f s ASP 27 Cb 0.00 -1.97 0.63 0.00 -0.30 0.00 0.00 42.92 41.28 1k7f s ASP 27 CO 0.00 0.07 1.51 -0.81 -0.17 0.00 0.00 175.17 175.76 1k7f n PRO 28 N 4.26 2.01 -3.96 4.34 -0.04 -1.26 -4.32 135.00 136.02 1k7f n PRO 28 Ca -0.16 -1.47 -0.08 0.00 -0.04 0.00 0.00 63.50 61.74 1k7f n PRO 28 Cb 0.52 -1.47 -0.04 0.00 -0.04 0.00 0.00 33.50 32.47 1k7f n PRO 28 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1k7f s GLY 29 N -1.89 0.36 0.11 0.55 0.00 -0.69 -4.82 107.32 100.94 1k7f s GLY 29 Ca 0.34 -0.71 -0.24 0.00 0.00 0.00 0.00 44.72 44.10 1k7f s GLY 29 CO 0.31 -0.47 1.67 -2.22 0.00 0.00 0.00 173.10 172.40 1k7f h ILE 30 N 2.18 0.62 0.00 0.90 5.03 -1.93 -0.64 117.51 123.67 1k7f h ILE 30 Ca -0.24 0.00 -0.26 0.00 -0.12 0.00 0.00 64.86 64.24 1k7f h ILE 30 Cb 1.25 0.62 0.02 0.00 -3.03 0.00 0.00 36.82 35.68 1k7f h ILE 30 CO 0.32 0.00 -1.04 -0.08 -0.68 0.00 0.00 178.15 176.67 1k7f h GLU 31 N -0.27 0.68 -0.67 2.37 4.81 -1.96 -2.82 114.58 116.72 1k7f h GLU 31 Ca 0.05 -0.73 0.03 0.00 -0.13 0.00 0.00 59.36 58.58 1k7f h GLU 31 Cb 0.32 0.21 -0.04 0.00 0.63 0.00 0.00 28.75 29.87 1k7f h GLU 31 CO -0.14 1.31 0.44 0.37 -0.73 0.00 0.00 179.01 180.26 1k7f h GLN 32 N 0.38 0.79 -0.81 1.92 5.75 -1.95 -2.67 115.11 118.51 1k7f h GLN 32 Ca -0.13 -0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.33 1k7f h GLN 32 Cb 1.69 -0.18 -0.04 0.00 1.07 0.00 0.00 27.48 30.02 1k7f h GLN 32 CO 0.20 0.52 0.53 1.03 -2.65 0.00 0.00 178.83 178.46 1k7f h SER 33 N 0.81 0.94 -0.33 -0.69 0.87 -0.95 0.06 113.55 114.26 1k7f h SER 33 Ca 0.26 -0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.76 1k7f h SER 33 Cb 0.05 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 1k7f h SER 33 CO -0.07 0.69 0.09 -0.07 -0.53 0.00 0.00 176.83 176.95 1k7f h LEU 34 N 1.10 0.48 -0.33 2.23 3.38 -1.37 0.81 115.31 121.63 1k7f h LEU 34 Ca 0.30 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1k7f h LEU 34 Cb -0.11 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 1k7f h LEU 34 CO -0.06 0.57 0.19 0.11 0.09 0.00 0.00 178.44 179.33 1k7f h LYS 35 N 0.37 0.45 -0.21 1.13 1.57 -1.33 -0.06 116.57 118.50 1k7f h LYS 35 Ca 0.10 -0.05 0.06 0.00 -1.87 0.00 0.00 60.65 58.89 1k7f h LYS 35 Cb 0.26 -0.09 -0.07 0.00 0.08 0.00 0.00 32.23 32.42 1k7f h LYS 35 CO -0.00 0.37 -0.24 0.82 -0.57 0.00 0.00 179.45 179.83 1k7f h ILE 36 N 0.41 0.41 -0.73 1.86 2.04 -0.78 0.05 117.51 120.77 1k7f h ILE 36 Ca 0.12 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.97 1k7f h ILE 36 Cb 0.04 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 36.50 1k7f h ILE 36 CO -0.02 0.00 0.42 0.40 0.00 0.00 0.00 178.15 178.95 1k7f h ILE 37 N -0.26 1.21 -0.10 -0.67 2.04 -0.65 -0.74 117.51 118.35 1k7f h ILE 37 Ca 0.13 -0.50 -0.07 0.00 1.00 0.00 0.00 64.86 65.42 1k7f h ILE 37 Cb 0.45 0.22 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1k7f h ILE 37 CO -0.36 0.23 -0.25 0.44 0.00 0.00 0.00 178.15 178.21 1k7f h ASP 38 N 1.00 0.16 -0.39 1.72 3.32 -0.77 -1.35 116.42 120.12 1k7f h ASP 38 Ca 0.26 -0.04 -0.10 0.00 0.02 0.00 0.00 57.03 57.17 1k7f h ASP 38 Cb -0.00 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1k7f h ASP 38 CO -0.05 0.42 -0.13 0.74 -1.72 0.00 0.00 179.24 178.50 1k7f h THR 39 N 0.15 1.28 -0.67 0.35 2.02 0.23 -1.50 112.91 114.77 1k7f h THR 39 Ca 0.03 -1.24 0.08 0.00 0.77 0.00 0.00 66.41 66.05 1k7f h THR 39 Cb 0.53 1.27 -0.07 0.00 -1.74 0.00 0.00 68.15 68.14 1k7f h THR 39 CO 0.04 0.41 0.33 -0.07 0.37 0.00 0.00 175.52 176.60 1k7f h LEU 40 N 0.58 0.43 -0.25 2.58 3.38 -0.55 0.67 115.31 122.16 1k7f h LEU 40 Ca 0.09 0.05 -0.16 0.00 0.09 0.00 0.00 57.88 57.95 1k7f h LEU 40 Cb 0.66 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1k7f h LEU 40 CO 0.05 0.26 -0.48 0.40 0.09 0.00 0.00 178.44 178.75 1k7f h ILE 41 N 0.58 1.30 -0.29 1.22 2.04 -1.11 -2.22 117.51 119.02 1k7f h ILE 41 Ca 0.32 -1.68 -0.03 0.00 1.00 0.00 0.00 64.86 64.46 1k7f h ILE 41 Cb 0.31 1.74 -0.02 0.00 -0.74 0.00 0.00 36.82 38.11 1k7f h ILE 41 CO -0.25 0.54 0.03 -0.78 0.00 0.00 0.00 178.15 177.70 1k7f h ASP 42 N 0.50 0.39 0.63 1.72 3.58 -0.82 -0.99 116.42 121.44 1k7f h ASP 42 Ca 0.01 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.41 1k7f h ASP 42 Cb 1.09 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 42.04 1k7f h ASP 42 CO 0.11 0.43 0.00 0.00 -2.88 0.00 0.00 179.24 176.90 1k7f n ALA 43 N -2.48 2.02 0.00 -0.78 0.00 0.19 -4.89 120.51 114.57 1k7f n ALA 43 Ca 0.01 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1k7f n ALA 43 Cb 0.20 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.30 1k7f n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k7f n GLY 44 N 0.66 1.04 3.70 0.00 0.00 -0.38 -3.75 105.19 106.46 1k7f n GLY 44 Ca 0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.66 1k7f n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k7f n ALA 45 N 0.00 1.34 0.04 4.61 0.00 -0.86 -4.83 120.51 120.81 1k7f n ALA 45 Ca 0.00 0.37 0.02 0.00 0.00 0.00 0.00 53.44 53.84 1k7f n ALA 45 Cb 0.00 -2.27 -0.07 0.00 0.00 0.00 0.00 19.45 17.11 1k7f n ALA 45 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1k7f n ASP 46 N 1.08 0.83 -3.82 0.00 8.00 -0.29 -4.81 116.55 117.54 1k7f n ASP 46 Ca 0.06 0.35 -0.08 0.00 0.71 0.00 0.00 54.79 55.84 1k7f n ASP 46 Cb 0.35 0.27 -0.02 0.00 -0.02 0.00 0.00 41.12 41.70 1k7f n ASP 46 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1k7f s ALA 47 N -3.02 -1.14 0.06 2.24 0.00 -1.25 -4.31 121.76 114.33 1k7f s ALA 47 Ca -0.03 -0.29 0.07 0.00 0.00 0.00 0.00 51.96 51.71 1k7f s ALA 47 Cb 0.09 0.88 -0.03 0.00 0.00 0.00 0.00 23.12 24.06 1k7f s ALA 47 CO 0.81 -0.98 -0.18 -0.51 0.00 0.00 0.00 175.76 174.89 1k7f s LEU 48 N -2.91 2.20 -0.11 0.00 1.43 -0.53 -3.77 118.68 115.00 1k7f s LEU 48 Ca 0.11 -0.55 0.04 0.00 -1.03 0.00 0.00 54.13 52.70 1k7f s LEU 48 Cb -0.05 -0.82 0.00 0.00 0.03 0.00 0.00 46.19 45.36 1k7f s LEU 48 CO 0.05 0.09 -0.23 -0.70 0.23 0.00 0.00 176.35 175.78 1k7f s GLU 49 N -1.36 2.98 -0.04 1.70 2.56 -0.66 -0.83 118.70 123.06 1k7f s GLU 49 Ca 0.05 -0.85 0.06 0.00 0.00 0.00 0.00 54.97 54.23 1k7f s GLU 49 Cb -0.09 -2.30 -0.01 0.00 2.00 0.00 0.00 34.13 33.73 1k7f s GLU 49 CO 0.02 0.12 -0.22 -0.51 -0.56 0.00 0.00 175.26 174.11 1k7f s LEU 50 N 0.49 2.02 0.15 2.70 1.43 0.21 -1.88 118.68 123.79 1k7f s LEU 50 Ca -0.15 -0.42 0.05 0.00 -1.03 0.00 0.00 54.13 52.57 1k7f s LEU 50 Cb -0.17 -1.18 -0.04 0.00 0.03 0.00 0.00 46.19 44.83 1k7f s LEU 50 CO 0.06 0.24 0.10 -0.83 0.23 0.00 0.00 176.35 176.14 1k7f s GLY 51 N -0.29 1.76 -0.18 -3.19 0.00 -0.63 -1.44 107.32 103.36 1k7f s GLY 51 Ca 0.02 -1.21 -0.01 0.00 0.00 0.00 0.00 44.72 43.51 1k7f s GLY 51 CO 0.01 -1.22 -0.11 0.14 0.00 0.00 0.00 173.10 171.93 1k7f s VAL 52 N -1.68 2.98 -0.06 1.40 1.01 -1.25 -1.37 120.40 121.43 1k7f s VAL 52 Ca 0.30 -0.65 -0.39 0.00 0.00 0.00 0.00 61.98 61.24 1k7f s VAL 52 Cb -0.10 -2.30 -0.17 0.00 0.00 0.00 0.00 36.38 33.81 1k7f s VAL 52 CO 0.22 0.48 1.41 -2.65 0.00 0.00 0.00 175.10 174.57 1k7f n PRO 53 N 4.28 0.88 -3.79 2.72 -0.02 -1.26 -4.90 135.00 132.92 1k7f n PRO 53 Ca -0.19 0.32 -0.13 0.00 -2.02 0.00 0.00 63.50 61.49 1k7f n PRO 53 Cb 0.51 -1.94 -0.12 0.00 -0.02 0.00 0.00 33.50 31.93 1k7f n PRO 53 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1k7f s PHE 54 N 1.31 -0.24 0.39 6.00 2.99 -1.26 -4.89 117.98 122.28 1k7f s PHE 54 Ca 0.90 0.58 0.14 0.00 0.00 0.00 0.00 56.93 58.56 1k7f s PHE 54 Cb -1.07 0.06 0.85 0.00 0.00 0.00 0.00 43.02 42.86 1k7f s PHE 54 CO 0.55 -0.13 1.89 0.66 -0.00 0.00 0.00 175.22 178.19 1k7f h SER 55 N 6.15 0.00 -2.11 1.36 4.64 -2.01 -3.35 113.55 118.23 1k7f h SER 55 Ca -0.29 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.45 1k7f h SER 55 Cb 1.19 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.87 1k7f h SER 55 CO 0.38 0.30 -0.84 0.47 -0.87 0.00 0.00 176.83 176.27 1k7f n ASP 56 N -4.12 2.02 -4.30 4.97 8.00 -1.26 -5.05 116.55 116.81 1k7f n ASP 56 Ca -0.02 -3.08 -0.38 0.00 0.71 0.00 0.00 54.79 52.03 1k7f n ASP 56 Cb 0.35 -0.66 -0.03 0.00 -0.02 0.00 0.00 41.12 40.76 1k7f n ASP 56 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1k7f n PRO 57 N 1.15 2.31 0.00 -0.24 -0.05 -1.26 -4.79 135.00 132.11 1k7f n PRO 57 Ca 0.26 -2.66 0.03 0.00 -0.05 0.00 0.00 63.50 61.07 1k7f n PRO 57 Cb 0.47 -3.45 0.16 0.00 -0.05 0.00 0.00 33.50 30.63 1k7f n PRO 57 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 175.50 176.92 1k7f n LEU 58 N 10.00 0.00 -0.26 1.53 -0.00 -1.26 -1.66 117.00 125.35 1k7f n LEU 58 Ca 0.48 0.00 0.02 0.00 -0.00 0.00 0.00 56.01 56.51 1k7f n LEU 58 Cb 0.44 0.00 0.06 0.00 -0.00 0.00 0.00 43.42 43.92 1k7f n LEU 58 CO 0.80 0.00 0.53 0.00 -0.00 0.00 0.00 177.39 178.72 1k7f n ALA 59 N -0.66 2.12 -2.45 1.47 0.00 -1.26 -5.00 120.51 114.74 1k7f n ALA 59 Ca 0.04 -1.00 -0.31 0.00 0.00 0.00 0.00 53.44 52.17 1k7f n ALA 59 Cb 0.02 -0.18 -0.13 0.00 0.00 0.00 0.00 19.45 19.16 1k7f n ALA 59 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1k7f s ASP 60 N -0.93 3.77 0.00 0.00 1.01 -0.66 -5.16 116.67 114.69 1k7f s ASP 60 Ca 0.09 -0.43 0.00 0.00 0.71 0.00 0.00 52.55 52.93 1k7f s ASP 60 Cb 0.05 -0.60 0.00 0.00 1.01 0.00 0.00 42.92 43.38 1k7f s ASP 60 CO 0.07 0.26 0.00 0.61 0.21 0.00 0.00 175.17 176.32 1k7f n GLY 61 N 1.60 1.30 0.07 0.21 0.00 -1.26 -4.92 105.19 102.18 1k7f n GLY 61 Ca -0.16 -1.77 -0.09 0.00 0.00 0.00 0.00 46.02 43.99 1k7f n GLY 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1k7f h PRO 62 N 0.00 0.00 -0.92 1.61 0.13 -2.01 -1.13 132.00 129.68 1k7f h PRO 62 Ca 0.00 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 65.33 1k7f h PRO 62 Cb 0.00 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.06 1k7f h PRO 62 CO 0.00 0.61 0.60 1.15 -0.23 0.00 0.00 178.00 180.13 1k7f h THR 63 N -1.00 0.68 0.04 1.56 2.02 -1.98 0.35 112.91 114.58 1k7f h THR 63 Ca -0.02 -0.15 -0.08 0.00 0.77 0.00 0.00 66.41 66.93 1k7f h THR 63 Cb 0.65 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.26 1k7f h THR 63 CO -0.01 0.08 -0.36 0.40 0.37 0.00 0.00 175.52 176.00 1k7f h ILE 64 N 0.44 1.64 -0.99 3.11 1.08 -1.96 -2.81 117.51 118.03 1k7f h ILE 64 Ca 0.48 -2.39 0.22 0.00 -0.39 0.00 0.00 64.86 62.78 1k7f h ILE 64 Cb 1.15 3.25 -0.12 0.00 -3.07 0.00 0.00 36.82 38.03 1k7f h ILE 64 CO -0.20 0.63 0.57 1.56 -0.69 0.00 0.00 178.15 180.02 1k7f h GLN 65 N -0.80 0.59 0.00 2.37 4.20 -0.90 0.16 115.11 120.73 1k7f h GLN 65 Ca -0.07 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.60 1k7f h GLN 65 Cb 1.23 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1k7f h GLN 65 CO 0.03 0.39 0.00 0.09 -0.67 0.00 0.00 178.83 178.67 1k7f n ASN 66 N -4.87 0.02 -0.00 1.46 3.02 0.12 -2.01 115.26 112.99 1k7f n ASN 66 Ca 0.25 0.50 -0.09 0.00 -0.03 0.00 0.00 54.58 55.22 1k7f n ASN 66 Cb 0.68 -0.51 -0.14 0.00 -0.61 0.00 0.00 39.78 39.20 1k7f n ASN 66 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k7f h ALA 67 N 2.81 0.68 0.00 5.41 0.00 -0.46 -2.55 119.26 125.15 1k7f h ALA 67 Ca 0.00 -1.35 -0.08 0.00 0.00 0.00 0.00 54.91 53.48 1k7f h ALA 67 Cb 0.41 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1k7f h ALA 67 CO 0.00 1.51 -0.37 -0.91 0.00 0.00 0.00 179.25 179.48 1k7f h ASN 68 N 0.00 0.00 -0.22 0.00 2.35 -0.78 -1.21 115.58 115.71 1k7f h ASN 68 Ca -0.23 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.37 1k7f h ASN 68 Cb 1.97 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.34 1k7f h ASN 68 CO 0.09 0.37 -0.42 -0.07 -1.65 0.00 0.00 177.43 175.75 1k7f h LEU 69 N 0.00 0.75 -1.38 1.61 -0.00 -1.40 -0.16 115.31 114.74 1k7f h LEU 69 Ca -0.00 -0.54 -0.07 0.00 -0.00 0.00 0.00 57.88 57.27 1k7f h LEU 69 Cb 0.69 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 41.12 1k7f h LEU 69 CO 0.05 1.15 -0.31 0.03 -0.00 0.00 0.00 178.44 179.36 1k7f h ARG 70 N 0.38 0.00 0.48 1.13 3.08 -1.17 -1.32 114.38 116.96 1k7f h ARG 70 Ca 0.01 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 1k7f h ARG 70 Cb 1.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.07 1k7f h ARG 70 CO 0.09 0.31 -0.23 0.00 -1.07 0.00 0.00 179.97 179.08 1k7f h ALA 71 N 1.69 -0.87 -0.92 0.04 0.00 -0.30 -2.50 119.26 116.39 1k7f h ALA 71 Ca -0.00 -0.14 0.24 0.00 0.00 0.00 0.00 54.91 55.00 1k7f h ALA 71 Cb 0.58 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.56 1k7f h ALA 71 CO 0.04 -0.82 0.63 0.74 0.00 0.00 0.00 179.25 179.84 1k7f h PHE 72 N -0.85 0.33 -0.46 0.00 0.04 -0.87 -1.40 116.94 113.74 1k7f h PHE 72 Ca -0.07 0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.61 1k7f h PHE 72 Cb 0.49 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 1k7f h PHE 72 CO 0.05 0.07 -0.14 0.00 -0.60 0.00 0.00 178.31 177.70 1k7f h ALA 73 N 1.58 0.89 -0.00 2.45 0.00 -1.22 -2.55 119.26 120.40 1k7f h ALA 73 Ca 0.47 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1k7f h ALA 73 Cb 1.45 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1k7f h ALA 73 CO -0.12 0.63 0.00 0.00 0.00 0.00 0.00 179.25 179.76 1k7f n ALA 74 N -2.49 2.66 -2.13 0.00 0.00 -0.54 -4.89 120.51 113.12 1k7f n ALA 74 Ca 0.01 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1k7f n ALA 74 Cb 0.39 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1k7f n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k7f n GLY 75 N 1.00 0.90 3.62 0.00 0.00 -0.96 -4.95 105.19 104.81 1k7f n GLY 75 Ca 0.22 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 1k7f n GLY 75 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k7f s VAL 76 N -2.86 4.98 0.48 1.61 1.01 -1.21 -5.05 120.40 119.36 1k7f s VAL 76 Ca 0.00 1.10 0.05 0.00 0.00 0.00 0.00 61.98 63.14 1k7f s VAL 76 Cb 0.00 -3.94 0.02 0.00 0.00 0.00 0.00 36.38 32.47 1k7f s VAL 76 CO 0.00 0.02 0.67 0.42 0.00 0.00 0.00 175.10 176.20 1k7f s THR 77 N 2.51 2.83 0.55 3.92 -4.23 -1.26 -4.79 115.64 115.17 1k7f s THR 77 Ca 0.26 -0.85 0.27 0.00 -1.18 0.00 0.00 61.69 60.19 1k7f s THR 77 Cb -0.15 -2.97 0.39 0.00 1.34 0.00 0.00 72.50 71.11 1k7f s THR 77 CO 0.09 0.00 1.99 -0.65 -0.54 0.00 0.00 174.62 175.50 1k7f h PRO 78 N 0.37 0.00 -0.03 3.99 0.11 -1.97 -1.37 132.00 133.10 1k7f h PRO 78 Ca -0.41 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.48 1k7f h PRO 78 Cb 1.29 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.41 1k7f h PRO 78 CO 0.48 0.00 -0.86 0.00 -0.21 0.00 0.00 178.00 177.41 1k7f h ALA 79 N 1.67 0.14 -0.11 -0.75 0.00 -2.01 -1.20 119.26 117.01 1k7f h ALA 79 Ca 0.23 -0.64 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 1k7f h ALA 79 Cb 1.00 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1k7f h ALA 79 CO -0.00 0.57 -0.27 1.96 0.00 0.00 0.00 179.25 181.51 1k7f h GLN 80 N 0.26 0.19 -0.43 0.00 4.20 -1.84 -2.02 115.11 115.48 1k7f h GLN 80 Ca -0.10 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.52 1k7f h GLN 80 Cb 1.52 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 29.27 1k7f h GLN 80 CO 0.17 0.46 0.18 0.00 -0.67 0.00 0.00 178.83 178.97 1k7f h PHE 82 N 0.56 0.41 -0.51 0.00 0.04 -0.55 -0.45 116.94 116.44 1k7f h PHE 82 Ca 0.15 -0.10 -0.06 0.00 2.80 0.00 0.00 57.97 60.76 1k7f h PHE 82 Cb 0.17 -0.10 -0.02 0.00 2.20 0.00 0.00 35.95 38.20 1k7f h PHE 82 CO -0.00 0.67 0.09 0.93 -0.60 0.00 0.00 178.31 179.39 1k7f h GLU 83 N 0.31 0.80 -0.12 1.51 5.08 -1.39 0.89 114.58 121.65 1k7f h GLU 83 Ca 0.04 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1k7f h GLU 83 Cb 0.76 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.90 1k7f h GLU 83 CO 0.06 0.75 0.01 0.52 -1.00 0.00 0.00 179.01 179.35 1k7f h MET 84 N 0.77 0.21 -0.95 2.33 2.86 -0.87 -1.78 114.93 117.50 1k7f h MET 84 Ca 0.16 -0.06 0.11 0.00 -2.06 0.00 0.00 59.70 57.85 1k7f h MET 84 Cb 0.34 -0.02 -0.08 0.00 0.06 0.00 0.00 31.60 31.90 1k7f h MET 84 CO 0.00 0.42 0.58 -0.07 1.06 0.00 0.00 176.91 178.91 1k7f h LEU 85 N -0.04 0.86 -0.47 1.22 3.38 -0.66 -0.32 115.31 119.28 1k7f h LEU 85 Ca 0.04 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1k7f h LEU 85 Cb 0.32 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1k7f h LEU 85 CO 0.00 0.47 0.16 0.00 0.09 0.00 0.00 178.44 179.16 1k7f h ALA 86 N 1.51 0.61 0.00 1.53 0.00 -0.64 -1.22 119.26 121.06 1k7f h ALA 86 Ca 0.46 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 55.04 1k7f h ALA 86 Cb 0.43 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 1k7f h ALA 86 CO -0.26 0.25 -0.78 1.25 0.00 0.00 0.00 179.25 179.71 1k7f h LEU 87 N 0.62 0.00 -0.38 0.00 5.85 -0.43 -1.17 115.31 119.80 1k7f h LEU 87 Ca 0.15 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 1k7f h LEU 87 Cb 0.24 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 1k7f h LEU 87 CO -0.01 0.78 0.16 0.40 -0.34 0.00 0.00 178.44 179.44 1k7f h ILE 88 N 0.00 1.19 -0.46 4.05 2.04 -0.84 -0.27 117.51 123.22 1k7f h ILE 88 Ca -0.01 -0.56 -0.05 0.00 1.00 0.00 0.00 64.86 65.23 1k7f h ILE 88 Cb 1.52 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 38.42 1k7f h ILE 88 CO 0.10 0.20 0.06 -0.09 0.00 0.00 0.00 178.15 178.43 1k7f h ARG 89 N 0.48 0.72 0.00 2.37 9.65 -0.96 -1.26 114.38 125.38 1k7f h ARG 89 Ca 0.13 -0.16 -0.07 0.00 -1.10 0.00 0.00 59.98 58.78 1k7f h ARG 89 Cb 0.17 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 28.64 1k7f h ARG 89 CO -0.01 0.69 -0.35 0.93 2.80 0.00 0.00 179.97 184.03 1k7f h GLU 90 N 0.69 0.00 0.00 0.20 5.08 -0.30 -1.79 114.58 118.46 1k7f h GLU 90 Ca 0.15 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.34 1k7f h GLU 90 Cb 0.34 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1k7f h GLU 90 CO 0.01 0.35 -0.82 0.87 -1.00 0.00 0.00 179.01 178.41 1k7f h LYS 91 N 0.00 0.00 -2.68 2.33 1.57 -0.88 -3.43 116.57 113.47 1k7f h LYS 91 Ca -0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 1k7f h LYS 91 Cb 0.68 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 32.59 1k7f h LYS 91 CO 0.04 0.80 -0.82 -1.01 -0.57 0.00 0.00 179.45 177.89 1k7f s HIS 92 N -2.81 0.52 0.34 -1.35 3.76 -0.49 -5.01 115.29 110.25 1k7f s HIS 92 Ca 0.02 -1.26 0.12 0.00 -0.15 0.00 0.00 55.06 53.79 1k7f s HIS 92 Cb 0.09 -0.90 0.61 0.00 1.11 0.00 0.00 32.58 33.49 1k7f s HIS 92 CO 0.79 -0.83 1.76 -1.00 -0.85 0.00 0.00 174.74 174.61 1k7f h PRO 93 N 7.69 0.00 0.00 8.40 0.13 -1.84 -3.35 132.00 143.02 1k7f h PRO 93 Ca -0.06 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.03 1k7f h PRO 93 Cb 0.99 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 1k7f h PRO 93 CO 0.35 0.44 -1.86 0.25 -0.23 0.00 0.00 178.00 176.95 1k7f n THR 94 N -4.01 0.13 -1.88 1.56 -2.24 -1.26 -4.98 114.28 101.60 1k7f n THR 94 Ca -0.02 -0.45 -0.42 0.00 -2.27 0.00 0.00 64.05 60.90 1k7f n THR 94 Cb 0.47 0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.68 1k7f n THR 94 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1k7f s ILE 95 N -3.16 2.46 0.27 2.28 2.07 -1.26 -4.91 121.20 118.96 1k7f s ILE 95 Ca -0.07 0.33 -0.29 0.00 -1.41 0.00 0.00 60.65 59.21 1k7f s ILE 95 Cb 0.11 -3.21 -0.09 0.00 0.13 0.00 0.00 42.46 39.39 1k7f s ILE 95 CO 0.74 0.03 1.26 -2.84 -1.91 0.00 0.00 174.94 172.21 1k7f s PRO 96 N 1.17 4.44 -0.17 3.50 0.02 -1.26 -4.90 135.00 137.80 1k7f s PRO 96 Ca 0.71 2.05 0.01 0.00 0.02 0.00 0.00 61.00 63.79 1k7f s PRO 96 Cb -0.45 -3.15 0.01 0.00 0.02 0.00 0.00 34.50 30.93 1k7f s PRO 96 CO 0.31 -0.11 -0.18 0.42 -0.33 0.00 0.00 177.00 177.10 1k7f s ILE 97 N -0.65 2.27 -0.12 2.83 1.01 -1.26 -1.45 121.20 123.83 1k7f s ILE 97 Ca 0.51 -0.89 0.02 0.00 0.00 0.00 0.00 60.65 60.29 1k7f s ILE 97 Cb -0.36 -1.95 -0.00 0.00 0.01 0.00 0.00 42.46 40.15 1k7f s ILE 97 CO 0.44 0.53 -0.19 -0.83 0.00 0.00 0.00 174.94 174.89 1k7f s GLY 98 N 1.10 1.42 0.01 6.18 0.00 -0.01 0.44 107.32 116.46 1k7f s GLY 98 Ca 0.00 -0.97 -0.12 0.00 0.00 0.00 0.00 44.72 43.63 1k7f s GLY 98 CO -0.07 -0.19 0.37 1.08 0.00 0.00 0.00 173.10 174.29 1k7f s LEU 99 N 0.48 4.43 -0.23 0.66 1.43 -0.23 0.64 118.68 125.86 1k7f s LEU 99 Ca -0.13 0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 53.79 1k7f s LEU 99 Cb -0.17 -2.64 0.02 0.00 0.03 0.00 0.00 46.19 43.43 1k7f s LEU 99 CO 0.05 0.29 -0.08 -0.76 0.23 0.00 0.00 176.35 176.08 1k7f s LEU 100 N -1.34 2.93 0.25 1.79 1.43 -0.52 -0.57 118.68 122.66 1k7f s LEU 100 Ca 0.25 -0.71 0.03 0.00 -1.03 0.00 0.00 54.13 52.68 1k7f s LEU 100 Cb -0.15 -1.65 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 1k7f s LEU 100 CO 0.14 -0.08 0.03 -0.04 0.23 0.00 0.00 176.35 176.63 1k7f s MET 101 N 1.36 1.40 0.27 1.70 -1.94 0.25 -3.84 119.30 118.51 1k7f s MET 101 Ca 0.02 -1.73 0.11 0.00 -1.71 0.00 0.00 55.69 52.38 1k7f s MET 101 Cb -0.15 -0.57 -0.05 0.00 2.01 0.00 0.00 34.83 36.07 1k7f s MET 101 CO -0.06 -0.16 -0.09 0.71 -0.01 0.00 0.00 175.02 175.41 1k7f s TYR 102 N -3.48 2.51 0.18 -0.03 2.02 -1.26 -1.47 117.35 115.82 1k7f s TYR 102 Ca 0.32 -0.27 -0.13 0.00 -0.37 0.00 0.00 57.07 56.62 1k7f s TYR 102 Cb 0.07 -1.10 0.09 0.00 -0.40 0.00 0.00 41.96 40.61 1k7f s TYR 102 CO 0.11 0.66 1.84 0.00 -1.57 0.00 0.00 175.55 176.59 1k7f h ALA 103 N 2.08 0.75 -0.09 3.71 0.00 -1.92 -2.96 119.26 120.82 1k7f h ALA 103 Ca -0.42 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.46 1k7f h ALA 103 Cb 1.25 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1k7f h ALA 103 CO 0.60 0.20 0.07 -0.97 0.00 0.00 0.00 179.25 179.14 1k7f h ASN 104 N 0.79 0.00 1.07 0.00 -1.24 -1.98 0.88 115.58 115.11 1k7f h ASN 104 Ca 0.21 0.00 -0.07 0.00 0.71 0.00 0.00 56.30 57.15 1k7f h ASN 104 Cb -0.07 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 38.97 1k7f h ASN 104 CO -0.04 0.00 -0.33 -0.07 -1.29 0.00 0.00 177.43 175.70 1k7f h LEU 105 N 0.00 0.00 0.00 0.34 3.38 -1.96 -0.59 115.31 116.48 1k7f h LEU 105 Ca 0.04 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.85 1k7f h LEU 105 Cb 0.17 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 1k7f h LEU 105 CO -0.00 0.33 -1.19 0.58 0.09 0.00 0.00 178.44 178.25 1k7f h VAL 106 N 0.00 0.71 0.08 1.22 2.07 -0.96 -3.35 116.25 116.02 1k7f h VAL 106 Ca -0.00 -2.22 -0.28 0.00 0.82 0.00 0.00 66.70 65.02 1k7f h VAL 106 Cb 0.95 2.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.93 1k7f h VAL 106 CO 0.04 0.40 -1.39 0.15 0.02 0.00 0.00 177.57 176.80 1k7f h PHE 107 N 0.00 0.32 -0.50 1.57 3.57 -0.78 -3.10 116.94 118.01 1k7f h PHE 107 Ca -0.12 -0.23 0.05 0.00 3.53 0.00 0.00 57.97 61.19 1k7f h PHE 107 Cb 1.59 -0.01 -0.06 0.00 2.79 0.00 0.00 35.95 40.26 1k7f h PHE 107 CO 0.00 1.24 -0.30 -1.71 -2.23 0.00 0.00 178.31 175.32 1k7f n ASN 108 N -3.40 -0.53 -1.75 0.41 5.15 -0.26 -1.65 115.26 113.23 1k7f n ASN 108 Ca -0.12 1.29 0.05 0.00 -0.60 0.00 0.00 54.58 55.20 1k7f n ASN 108 Cb 1.02 -0.31 0.36 0.00 -0.53 0.00 0.00 39.78 40.31 1k7f n ASN 108 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 1k7f n ASN 109 N -4.14 5.18 0.00 1.20 6.94 -1.26 -4.99 115.26 118.19 1k7f n ASN 109 Ca 0.01 -2.84 0.00 0.00 -0.02 0.00 0.00 54.58 51.73 1k7f n ASN 109 Cb 0.13 -0.67 0.00 0.00 -2.36 0.00 0.00 39.78 36.88 1k7f n ASN 109 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1k7f n GLY 110 N 0.52 2.17 0.28 4.83 0.00 -0.66 -4.60 105.19 107.73 1k7f n GLY 110 Ca 0.25 -1.34 -0.16 0.00 0.00 0.00 0.00 46.02 44.78 1k7f n GLY 110 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1k7f h ILE 111 N 0.00 0.52 -0.81 -0.61 2.04 -1.70 -1.70 117.51 115.25 1k7f h ILE 111 Ca 0.00 -0.07 0.19 0.00 1.00 0.00 0.00 64.86 65.98 1k7f h ILE 111 Cb 0.00 0.56 -0.12 0.00 -0.74 0.00 0.00 36.82 36.52 1k7f h ILE 111 CO 0.00 0.01 0.27 -0.78 0.00 0.00 0.00 178.15 177.66 1k7f h ASP 112 N -0.69 0.15 0.71 1.72 3.58 -1.92 -0.07 116.42 119.90 1k7f h ASP 112 Ca -0.07 0.15 -0.08 0.00 0.42 0.00 0.00 57.03 57.46 1k7f h ASP 112 Cb 0.52 0.17 -0.01 0.00 1.72 0.00 0.00 39.33 41.73 1k7f h ASP 112 CO 0.11 -0.02 -0.37 0.00 -2.88 0.00 0.00 179.24 176.08 1k7f h ALA 113 N 1.66 1.08 -0.12 -0.78 0.00 -1.73 0.02 119.26 119.39 1k7f h ALA 113 Ca 0.48 -0.33 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 1k7f h ALA 113 Cb 0.86 -0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.60 1k7f h ALA 113 CO -0.52 0.46 -0.47 0.35 0.00 0.00 0.00 179.25 179.06 1k7f h PHE 114 N 0.00 0.71 0.00 0.00 3.57 -0.11 -1.76 116.94 119.35 1k7f h PHE 114 Ca -0.00 -0.30 -0.09 0.00 3.53 0.00 0.00 57.97 61.11 1k7f h PHE 114 Cb 0.82 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 1k7f h PHE 114 CO 0.00 1.07 -0.44 1.88 -2.23 0.00 0.00 178.31 178.59 1k7f h TYR 115 N 0.15 0.00 -0.49 0.41 0.05 -1.11 -1.18 116.97 114.80 1k7f h TYR 115 Ca -0.02 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.73 1k7f h TYR 115 Cb 1.10 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.82 1k7f h TYR 115 CO 0.11 0.44 0.22 0.00 -1.05 0.00 0.00 178.16 177.87 1k7f h ALA 116 N 1.56 0.63 -0.59 3.88 0.00 -0.88 -2.27 119.26 121.59 1k7f h ALA 116 Ca -0.00 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 1k7f h ALA 116 Cb 0.95 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1k7f h ALA 116 CO 0.06 0.21 0.29 -0.09 0.00 0.00 0.00 179.25 179.72 1k7f h ARG 117 N 0.64 0.83 -0.33 0.00 9.65 -0.68 -1.28 114.38 123.21 1k7f h ARG 117 Ca 0.17 -0.10 -0.07 0.00 -1.10 0.00 0.00 59.98 58.88 1k7f h ARG 117 Cb 0.15 -0.16 -0.01 0.00 -1.39 0.00 0.00 29.97 28.55 1k7f h ARG 117 CO -0.02 0.63 -0.05 0.00 2.80 0.00 0.00 179.97 183.33 1k7f h GLU 119 N 0.41 1.12 -0.24 0.00 4.81 -1.32 -0.18 114.58 119.18 1k7f h GLU 119 Ca 0.09 -0.09 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 1k7f h GLU 119 Cb 0.54 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1k7f h GLU 119 CO 0.03 0.77 -0.27 0.37 -0.73 0.00 0.00 179.01 179.18 1k7f h GLN 120 N 1.15 0.47 -0.00 1.92 4.15 -0.48 -2.51 115.11 119.81 1k7f h GLN 120 Ca 0.30 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.54 1k7f h GLN 120 Cb -0.08 -0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.59 1k7f h GLN 120 CO -0.06 0.70 -0.25 1.33 -1.93 0.00 0.00 178.83 178.62 1k7f n VAL 121 N -4.11 0.00 -0.40 2.39 0.24 -0.96 -4.97 118.33 110.52 1k7f n VAL 121 Ca -0.01 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.25 1k7f n VAL 121 Cb 0.42 0.05 0.00 0.00 -1.47 0.00 0.00 33.84 32.84 1k7f n VAL 121 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1k7f n GLY 122 N 1.40 0.86 3.77 7.63 0.00 -0.24 -4.23 105.19 114.39 1k7f n GLY 122 Ca 0.10 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.33 1k7f n GLY 122 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k7f s VAL 123 N -2.00 2.09 -0.16 1.61 1.01 -0.29 -4.76 120.40 117.91 1k7f s VAL 123 Ca 0.00 0.09 0.18 0.00 0.00 0.00 0.00 61.98 62.25 1k7f s VAL 123 Cb 0.00 -3.06 -0.26 0.00 0.00 0.00 0.00 36.38 33.07 1k7f s VAL 123 CO 0.00 0.02 0.22 0.47 0.00 0.00 0.00 175.10 175.81 1k7f n ASP 124 N 0.77 0.10 -3.89 3.32 8.00 0.17 -4.63 116.55 120.40 1k7f n ASP 124 Ca 0.02 0.05 -0.09 0.00 0.71 0.00 0.00 54.79 55.48 1k7f n ASP 124 Cb 0.39 1.07 -0.07 0.00 -0.02 0.00 0.00 41.12 42.49 1k7f n ASP 124 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1k7f s SER 125 N -5.37 0.07 -0.04 -2.24 1.04 -0.95 -0.94 113.70 105.26 1k7f s SER 125 Ca -0.09 -0.72 -0.01 0.00 0.48 0.00 0.00 55.95 55.60 1k7f s SER 125 Cb 0.08 0.39 0.03 0.00 0.10 0.00 0.00 66.02 66.62 1k7f s SER 125 CO 0.84 -0.81 0.07 -0.69 0.98 0.00 0.00 173.24 173.63 1k7f s VAL 126 N -3.90 -0.10 -0.25 5.02 1.01 -0.67 -1.07 120.40 120.44 1k7f s VAL 126 Ca 0.10 0.30 -0.08 0.00 0.00 0.00 0.00 61.98 62.30 1k7f s VAL 126 Cb 0.04 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.24 1k7f s VAL 126 CO -0.06 0.12 0.09 -0.22 0.00 0.00 0.00 175.10 175.03 1k7f s LEU 127 N 1.58 3.60 -0.65 3.92 0.20 0.27 -1.54 118.68 126.06 1k7f s LEU 127 Ca -0.03 -0.14 -0.18 0.00 0.69 0.00 0.00 54.13 54.47 1k7f s LEU 127 Cb -0.12 -1.97 0.12 0.00 -0.43 0.00 0.00 46.19 43.79 1k7f s LEU 127 CO -0.04 -0.02 0.75 -0.69 -0.29 0.00 0.00 176.35 176.07 1k7f s VAL 128 N 1.52 4.89 0.50 1.68 1.01 -1.26 -0.58 120.40 128.15 1k7f s VAL 128 Ca 0.06 -1.20 0.20 0.00 0.00 0.00 0.00 61.98 61.03 1k7f s VAL 128 Cb -0.15 -4.52 0.26 0.00 0.00 0.00 0.00 36.38 31.97 1k7f s VAL 128 CO 0.05 -1.16 2.11 0.00 0.00 0.00 0.00 175.10 176.10 1k7f h ALA 129 N 9.01 1.72 -0.70 5.51 0.00 -1.62 -2.53 119.26 130.66 1k7f h ALA 129 Ca -0.21 -0.07 -0.37 0.00 0.00 0.00 0.00 54.91 54.26 1k7f h ALA 129 Cb 1.08 -0.01 -0.22 0.00 0.00 0.00 0.00 17.79 18.63 1k7f h ALA 129 CO 1.07 0.09 0.29 -0.40 0.00 0.00 0.00 179.25 180.30 1k7f n ASP 130 N -4.23 3.37 -4.09 0.00 5.75 -1.26 -4.81 116.55 111.28 1k7f n ASP 130 Ca -0.03 -3.71 -0.33 0.00 -0.01 0.00 0.00 54.79 50.71 1k7f n ASP 130 Cb 0.16 -0.74 -0.14 0.00 -1.03 0.00 0.00 41.12 39.36 1k7f n ASP 130 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1k7f s VAL 131 N -3.39 2.48 0.89 2.12 1.01 -0.95 -4.88 120.40 117.68 1k7f s VAL 131 Ca 0.52 -1.74 -0.12 0.00 0.00 0.00 0.00 61.98 60.64 1k7f s VAL 131 Cb 0.45 -2.54 0.13 0.00 0.00 0.00 0.00 36.38 34.42 1k7f s VAL 131 CO 0.05 -0.20 1.14 -2.16 0.00 0.00 0.00 175.10 173.92 1k7f s PRO 132 N 1.10 1.29 0.45 2.72 0.04 -1.26 -4.85 135.00 134.49 1k7f s PRO 132 Ca -0.03 0.30 0.17 0.00 0.04 0.00 0.00 61.00 61.47 1k7f s PRO 132 Cb -0.20 -1.86 1.04 0.00 0.04 0.00 0.00 34.50 33.53 1k7f s PRO 132 CO -0.05 -2.10 1.98 -0.39 0.04 0.00 0.00 177.00 176.48 1k7f h VAL 133 N -1.43 1.04 -0.02 -0.36 -1.51 -1.98 -2.16 116.25 109.83 1k7f h VAL 133 Ca -0.50 -0.72 0.00 0.00 -1.23 0.00 0.00 66.70 64.25 1k7f h VAL 133 Cb 1.33 1.40 -0.00 0.00 -2.13 0.00 0.00 31.29 31.89 1k7f h VAL 133 CO 0.62 0.20 0.01 -0.33 -1.23 0.00 0.00 177.57 176.85 1k7f h GLU 134 N 0.00 0.00 -0.22 5.19 3.07 -2.02 -2.05 114.58 118.55 1k7f h GLU 134 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1k7f h GLU 134 Cb 0.38 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.29 1k7f h GLU 134 CO 0.03 0.00 0.00 0.39 -1.40 0.00 0.00 179.01 178.03 1k7f n GLU 135 N -4.25 2.66 0.00 2.33 -0.58 -0.83 -4.74 120.64 115.22 1k7f n GLU 135 Ca -0.03 -2.56 0.12 0.00 -0.42 0.00 0.00 57.16 54.27 1k7f n GLU 135 Cb 0.10 -1.63 0.23 0.00 -0.57 0.00 0.00 31.44 29.57 1k7f n GLU 135 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1k7f n SER 136 N -0.46 1.25 -0.20 1.62 3.41 -0.77 -4.57 113.62 113.90 1k7f n SER 136 Ca 0.17 -1.01 -0.06 0.00 -0.26 0.00 0.00 58.87 57.72 1k7f n SER 136 Cb 0.72 0.30 -0.01 0.00 -0.26 0.00 0.00 64.21 64.97 1k7f n SER 136 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k7f h ALA 137 N 3.62 -0.13 -0.02 7.33 0.00 -1.85 -0.86 119.26 127.36 1k7f h ALA 137 Ca 0.00 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1k7f h ALA 137 Cb 0.58 0.83 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 1k7f h ALA 137 CO 0.00 -0.72 -0.15 -1.00 0.00 0.00 0.00 179.25 177.38 1k7f h PRO 138 N -0.19 0.02 -0.03 0.00 0.14 -2.00 -1.03 132.00 128.93 1k7f h PRO 138 Ca 0.22 -0.00 -0.08 0.00 0.14 0.00 0.00 66.00 66.27 1k7f h PRO 138 Cb 0.56 -0.00 0.01 0.00 0.14 0.00 0.00 31.00 31.70 1k7f h PRO 138 CO -0.68 0.18 -0.31 0.74 0.14 0.00 0.00 178.00 178.07 1k7f h PHE 139 N 0.02 0.36 -0.13 1.56 -1.00 -1.51 -2.51 116.94 113.74 1k7f h PHE 139 Ca 0.00 -0.18 -0.03 0.00 2.81 0.00 0.00 57.97 60.58 1k7f h PHE 139 Cb 0.28 -0.05 -0.01 0.00 3.61 0.00 0.00 35.95 39.79 1k7f h PHE 139 CO 0.00 0.95 -0.05 0.07 -1.61 0.00 0.00 178.31 177.67 1k7f h ARG 140 N -0.33 0.19 0.11 1.51 0.11 -0.94 -0.85 114.38 114.18 1k7f h ARG 140 Ca -0.03 -0.03 -0.01 0.00 0.10 0.00 0.00 59.98 60.01 1k7f h ARG 140 Cb 1.01 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.06 1k7f h ARG 140 CO 0.06 0.26 -0.05 1.96 0.10 0.00 0.00 179.97 182.30 1k7f h GLN 141 N 0.19 -0.14 -0.72 0.08 4.20 -1.24 -1.71 115.11 115.77 1k7f h GLN 141 Ca 0.04 0.01 0.16 0.00 0.06 0.00 0.00 58.65 58.92 1k7f h GLN 141 Cb 0.22 0.03 -0.11 0.00 0.30 0.00 0.00 27.48 27.91 1k7f h GLN 141 CO 0.01 0.36 0.12 0.00 -0.67 0.00 0.00 178.83 178.65 1k7f h ALA 142 N -0.22 0.87 0.43 3.87 0.00 -1.29 -0.70 119.26 122.21 1k7f h ALA 142 Ca -0.01 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1k7f h ALA 142 Cb 0.56 0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1k7f h ALA 142 CO 0.02 -0.37 -0.24 0.00 0.00 0.00 0.00 179.25 178.66 1k7f h ALA 143 N 1.62 -0.63 -0.62 0.00 0.00 -0.99 -2.89 119.26 115.76 1k7f h ALA 143 Ca 0.40 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 55.11 1k7f h ALA 143 Cb 0.69 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 1k7f h ALA 143 CO -0.54 -0.86 0.11 -0.07 0.00 0.00 0.00 179.25 177.89 1k7f h LEU 144 N -0.63 0.95 -2.75 0.00 3.38 -1.21 0.42 115.31 115.47 1k7f h LEU 144 Ca -0.05 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1k7f h LEU 144 Cb 0.51 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1k7f h LEU 144 CO 0.07 0.95 0.06 0.03 0.09 0.00 0.00 178.44 179.63 1k7f h ARG 145 N 0.94 0.00 -0.24 1.13 3.08 -0.95 -1.39 114.38 116.96 1k7f h ARG 145 Ca 0.19 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.23 1k7f h ARG 145 Cb 0.40 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 1k7f h ARG 145 CO 0.01 0.00 -0.00 0.72 -1.07 0.00 0.00 179.97 179.62 1k7f n HIS 146 N -3.19 0.85 -2.25 3.04 8.25 -0.20 -4.93 115.22 116.79 1k7f n HIS 146 Ca -0.03 -0.95 -0.15 0.00 -0.26 0.00 0.00 57.72 56.34 1k7f n HIS 146 Cb 0.13 -0.31 -0.01 0.00 1.12 0.00 0.00 29.99 30.92 1k7f n HIS 146 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1k7f n ASN 147 N -0.67 -4.50 -4.64 0.41 3.02 -0.52 -4.63 115.26 103.72 1k7f n ASN 147 Ca 0.22 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.42 1k7f n ASN 147 Cb 0.88 -3.64 -0.10 0.00 -0.61 0.00 0.00 39.78 36.31 1k7f n ASN 147 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1k7f s ILE 148 N -2.73 4.31 -0.14 2.41 -1.09 0.13 -4.91 121.20 119.18 1k7f s ILE 148 Ca 0.00 -0.23 -0.29 0.00 -2.23 0.00 0.00 60.65 57.89 1k7f s ILE 148 Cb 0.00 -2.85 -0.01 0.00 -1.58 0.00 0.00 42.46 38.02 1k7f s ILE 148 CO 0.00 0.56 1.07 0.00 -1.23 0.00 0.00 174.94 175.34 1k7f s ALA 149 N -0.46 3.52 -0.07 9.38 0.00 -0.12 -3.38 121.76 130.64 1k7f s ALA 149 Ca 0.08 0.37 -0.30 0.00 0.00 0.00 0.00 51.96 52.11 1k7f s ALA 149 Cb -0.12 -3.50 -0.02 0.00 0.00 0.00 0.00 23.12 19.48 1k7f s ALA 149 CO 0.02 -0.81 1.04 -1.25 0.00 0.00 0.00 175.76 174.77 1k7f s PRO 150 N 2.51 4.44 -0.11 0.00 0.04 -1.26 -1.67 135.00 138.95 1k7f s PRO 150 Ca 0.49 1.47 -0.04 0.00 0.04 0.00 0.00 61.00 62.95 1k7f s PRO 150 Cb -0.19 -3.52 -0.04 0.00 0.04 0.00 0.00 34.50 30.80 1k7f s PRO 150 CO 0.15 -0.28 0.07 0.42 0.04 0.00 0.00 177.00 177.40 1k7f s ILE 151 N 1.80 4.89 -0.02 0.56 -1.09 -0.59 -2.42 121.20 124.34 1k7f s ILE 151 Ca 0.51 -0.02 0.07 0.00 -2.23 0.00 0.00 60.65 58.98 1k7f s ILE 151 Cb -0.20 -3.10 -0.02 0.00 -1.58 0.00 0.00 42.46 37.55 1k7f s ILE 151 CO 0.21 0.61 -0.23 -0.36 -1.23 0.00 0.00 174.94 173.94 1k7f s PHE 152 N -0.91 2.42 -0.07 3.97 0.08 -1.26 -4.38 117.98 117.83 1k7f s PHE 152 Ca 0.14 -0.37 -0.28 0.00 0.12 0.00 0.00 56.93 56.54 1k7f s PHE 152 Cb -0.12 -1.52 -0.02 0.00 -0.57 0.00 0.00 43.02 40.79 1k7f s PHE 152 CO 0.03 0.04 0.93 0.42 -0.10 0.00 0.00 175.22 176.54 1k7f s ILE 153 N -0.67 4.86 -0.43 0.64 1.01 -1.26 -1.54 121.20 123.82 1k7f s ILE 153 Ca 0.11 1.92 -0.12 0.00 0.00 0.00 0.00 60.65 62.55 1k7f s ILE 153 Cb -0.10 -4.26 0.06 0.00 0.01 0.00 0.00 42.46 38.17 1k7f s ILE 153 CO -0.00 0.09 0.29 0.00 0.00 0.00 0.00 174.94 175.33 1k7f s PRO 155 N 1.54 1.95 0.18 0.00 0.04 -1.26 -2.87 135.00 134.57 1k7f s PRO 155 Ca 0.03 0.82 -0.11 0.00 0.04 0.00 0.00 61.00 61.79 1k7f s PRO 155 Cb -0.22 -1.89 0.09 0.00 0.04 0.00 0.00 34.50 32.52 1k7f s PRO 155 CO 0.05 -1.76 1.73 -1.35 0.04 0.00 0.00 177.00 175.70 1k7f h PRO 156 N -1.20 0.96 -0.63 0.56 0.11 -1.90 -2.78 132.00 127.12 1k7f h PRO 156 Ca -0.47 -0.19 0.00 0.00 0.11 0.00 0.00 66.00 65.45 1k7f h PRO 156 Cb 1.26 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1k7f h PRO 156 CO 0.56 0.83 0.00 0.27 -0.21 0.00 0.00 178.00 179.45 1k7f n ASN 157 N -4.41 0.63 -4.75 -2.05 0.23 -1.26 -4.91 115.26 98.75 1k7f n ASN 157 Ca 0.04 -1.52 -0.38 0.00 -0.53 0.00 0.00 54.58 52.20 1k7f n ASN 157 Cb 0.19 -0.32 0.03 0.00 -2.08 0.00 0.00 39.78 37.60 1k7f n ASN 157 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1k7f s ALA 158 N -1.16 2.79 0.43 -2.53 0.00 -1.05 -5.05 121.76 115.19 1k7f s ALA 158 Ca 0.00 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.20 1k7f s ALA 158 Cb 0.00 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1k7f s ALA 158 CO 0.00 -1.26 0.02 -0.40 0.00 0.00 0.00 175.76 174.12 1k7f n ASP 159 N -1.05 3.16 -0.11 0.00 5.75 -1.26 -5.02 116.55 118.02 1k7f n ASP 159 Ca 0.11 -2.87 -0.08 0.00 -0.01 0.00 0.00 54.79 51.93 1k7f n ASP 159 Cb 0.46 0.28 -0.00 0.00 -1.03 0.00 0.00 41.12 40.83 1k7f n ASP 159 CO 0.00 0.00 0.00 -0.78 -0.11 0.00 0.00 177.20 176.31 1k7f h ASP 160 N 1.01 0.40 -0.81 -1.12 3.58 -2.00 -2.53 116.42 114.95 1k7f h ASP 160 Ca -0.35 -0.01 0.05 0.00 0.42 0.00 0.00 57.03 57.14 1k7f h ASP 160 Cb 1.08 -0.09 -0.06 0.00 1.72 0.00 0.00 39.33 41.98 1k7f h ASP 160 CO 0.59 0.29 0.50 0.44 -2.88 0.00 0.00 179.24 178.18 1k7f h ASP 161 N 0.48 0.80 -0.12 2.28 3.32 -1.99 -1.68 116.42 119.51 1k7f h ASP 161 Ca 0.14 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.23 1k7f h ASP 161 Cb -0.04 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.32 1k7f h ASP 161 CO -0.04 0.53 -0.10 0.25 -1.72 0.00 0.00 179.24 178.16 1k7f h LEU 162 N 0.94 -0.31 -0.52 1.55 5.85 -1.95 -2.14 115.31 118.72 1k7f h LEU 162 Ca 0.34 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 59.10 1k7f h LEU 162 Cb 0.11 0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1k7f h LEU 162 CO -0.15 -0.13 0.23 -0.07 -0.34 0.00 0.00 178.44 177.97 1k7f h LEU 163 N -0.11 0.71 -0.90 2.25 3.38 -1.01 0.11 115.31 119.74 1k7f h LEU 163 Ca 0.08 -0.15 0.07 0.00 0.09 0.00 0.00 57.88 57.97 1k7f h LEU 163 Cb 0.23 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.73 1k7f h LEU 163 CO -0.19 0.67 0.56 0.03 0.09 0.00 0.00 178.44 179.60 1k7f h ARG 164 N 0.70 0.97 -0.30 1.13 3.08 -1.24 0.50 114.38 119.22 1k7f h ARG 164 Ca 0.18 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.09 1k7f h ARG 164 Cb 0.17 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1k7f h ARG 164 CO -0.02 0.64 -0.13 1.96 -1.07 0.00 0.00 179.97 181.35 1k7f h GLN 165 N 1.00 0.62 -0.70 0.04 4.20 -0.76 -0.85 115.11 118.65 1k7f h GLN 165 Ca 0.40 -0.26 0.04 0.00 0.06 0.00 0.00 58.65 58.89 1k7f h GLN 165 Cb 0.23 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 27.94 1k7f h GLN 165 CO -0.19 0.84 0.42 0.28 -0.67 0.00 0.00 178.83 179.51 1k7f h VAL 166 N 0.37 1.05 -0.38 -0.54 2.07 -0.31 -0.15 116.25 118.36 1k7f h VAL 166 Ca 0.07 -0.28 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1k7f h VAL 166 Cb 0.65 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1k7f h VAL 166 CO 0.04 0.15 0.17 0.00 0.02 0.00 0.00 177.57 177.94 1k7f h ALA 167 N 1.32 0.49 -0.25 1.67 0.00 -0.77 -1.65 119.26 120.07 1k7f h ALA 167 Ca 0.29 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 1k7f h ALA 167 Cb 0.08 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1k7f h ALA 167 CO -0.13 0.08 -0.35 1.03 0.00 0.00 0.00 179.25 179.87 1k7f h SER 168 N 0.47 0.57 0.14 0.00 0.87 -0.77 -3.38 113.55 111.45 1k7f h SER 168 Ca 0.13 -0.24 -0.26 0.00 -1.23 0.00 0.00 61.79 60.19 1k7f h SER 168 Cb 0.16 -0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 61.91 1k7f h SER 168 CO -0.01 0.88 -2.12 -1.22 -0.53 0.00 0.00 176.83 173.83 1k7f n TYR 169 N -4.06 0.23 -1.94 2.24 4.01 -0.10 -4.99 117.16 112.55 1k7f n TYR 169 Ca -0.01 0.08 -0.31 0.00 -0.16 0.00 0.00 57.90 57.50 1k7f n TYR 169 Cb 0.48 -0.93 0.00 0.00 -0.31 0.00 0.00 39.34 38.58 1k7f n TYR 169 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1k7f s GLY 170 N -5.17 1.72 0.10 2.72 0.00 -0.64 -4.83 107.32 101.22 1k7f s GLY 170 Ca -0.08 -0.05 -0.03 0.00 0.00 0.00 0.00 44.72 44.55 1k7f s GLY 170 CO 0.84 0.22 0.08 0.50 0.00 0.00 0.00 173.10 174.74 1k7f s ARG 171 N -5.03 0.85 0.00 2.90 1.81 -1.02 -4.57 118.95 113.89 1k7f s ARG 171 Ca 0.56 -1.26 0.00 0.00 -1.72 0.00 0.00 55.73 53.30 1k7f s ARG 171 Cb -0.11 0.27 0.00 0.00 -0.45 0.00 0.00 34.95 34.66 1k7f s ARG 171 CO 0.51 -0.24 0.00 0.41 -0.68 0.00 0.00 175.30 175.30 1k7f n GLY 172 N -0.04 1.34 3.36 -3.53 0.00 -1.26 -4.48 105.19 100.58 1k7f n GLY 172 Ca -0.10 -0.02 -0.11 0.00 0.00 0.00 0.00 46.02 45.80 1k7f n GLY 172 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1k7f s TYR 173 N 0.00 -0.29 -0.15 1.61 -0.85 -1.26 -4.30 117.35 112.11 1k7f s TYR 173 Ca 0.00 -0.00 -0.07 0.00 -0.52 0.00 0.00 57.07 56.47 1k7f s TYR 173 Cb 0.00 0.35 -0.04 0.00 0.38 0.00 0.00 41.96 42.65 1k7f s TYR 173 CO 0.00 -0.76 0.09 0.99 -1.52 0.00 0.00 175.55 174.35 1k7f s THR 174 N -3.80 5.07 -0.63 -3.49 2.01 0.54 -4.54 115.64 110.81 1k7f s THR 174 Ca 0.03 0.06 -0.24 0.00 0.31 0.00 0.00 61.69 61.84 1k7f s THR 174 Cb 0.01 -3.25 0.05 0.00 0.01 0.00 0.00 72.50 69.32 1k7f s THR 174 CO -0.12 0.52 1.03 -0.47 -0.69 0.00 0.00 174.62 174.90 1k7f s TYR 175 N -0.23 2.64 -0.65 4.92 6.14 -0.59 -0.91 117.35 128.67 1k7f s TYR 175 Ca 0.09 -0.18 -0.20 0.00 0.64 0.00 0.00 57.07 57.43 1k7f s TYR 175 Cb -0.12 -4.29 0.10 0.00 0.42 0.00 0.00 41.96 38.08 1k7f s TYR 175 CO 0.01 -1.61 0.81 -1.17 0.64 0.00 0.00 175.55 174.24 1k7f s LEU 176 N 4.40 5.16 0.02 6.97 2.96 0.09 -0.19 118.68 138.08 1k7f s LEU 176 Ca 0.29 -1.43 -0.30 0.00 -0.22 0.00 0.00 54.13 52.47 1k7f s LEU 176 Cb -0.13 -2.34 -0.06 0.00 0.50 0.00 0.00 46.19 44.17 1k7f s LEU 176 CO 0.16 -1.17 1.35 -0.22 -1.32 0.00 0.00 176.35 175.15 1k7f s LEU 177 N 2.93 4.33 -0.03 -0.68 2.96 -1.14 -0.34 118.68 126.71 1k7f s LEU 177 Ca 0.16 2.10 -0.30 0.00 -0.22 0.00 0.00 54.13 55.87 1k7f s LEU 177 Cb -0.20 -3.57 -0.05 0.00 0.50 0.00 0.00 46.19 42.88 1k7f s LEU 177 CO 0.05 -0.67 1.36 -0.44 -1.32 0.00 0.00 176.35 175.34 1k7f s SER 178 N 1.64 6.89 0.00 3.68 0.01 0.23 -4.39 113.70 121.76 1k7f s SER 178 Ca 0.62 2.02 0.00 0.00 1.31 0.00 0.00 55.95 59.91 1k7f s SER 178 Cb -0.31 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.36 1k7f s SER 178 CO 0.27 -0.71 0.00 0.18 0.41 0.00 0.00 173.24 173.39 1k7f n LEU 193 N 5.58 0.00 -0.14 2.44 4.77 -1.26 -4.88 117.00 123.50 1k7f n LEU 193 Ca 0.13 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 56.07 1k7f n LEU 193 Cb 0.44 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.56 1k7f n LEU 193 CO 0.58 0.00 0.74 0.45 -1.33 0.00 0.00 177.39 177.83 1k7f h HIS 194 N 0.00 -0.38 -0.89 -1.77 3.86 -1.99 0.17 115.15 114.15 1k7f h HIS 194 Ca 0.00 0.05 -0.01 0.00 -1.16 0.00 0.00 60.37 59.24 1k7f h HIS 194 Cb 0.00 0.24 -0.04 0.00 1.06 0.00 0.00 27.41 28.67 1k7f h HIS 194 CO 0.00 -0.25 0.51 1.25 0.86 0.00 0.00 177.93 180.30 1k7f h HIS 195 N -0.06 1.20 -0.38 2.45 -0.00 -2.00 0.51 115.15 116.88 1k7f h HIS 195 Ca 0.22 -0.02 -0.09 0.00 -0.00 0.00 0.00 60.37 60.49 1k7f h HIS 195 Cb 0.40 -0.39 -0.02 0.00 -0.00 0.00 0.00 27.41 27.40 1k7f h HIS 195 CO -0.44 0.82 -0.13 1.25 -0.00 0.00 0.00 177.93 179.43 1k7f h LEU 196 N 1.24 0.68 -0.60 0.26 5.85 -1.53 -1.60 115.31 119.60 1k7f h LEU 196 Ca 0.32 -0.20 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 1k7f h LEU 196 Cb -0.01 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 40.81 1k7f h LEU 196 CO -0.05 0.83 0.31 0.40 -0.34 0.00 0.00 178.44 179.59 1k7f h ILE 197 N 0.62 1.20 -0.50 4.05 2.04 0.33 -1.93 117.51 123.32 1k7f h ILE 197 Ca 0.10 -0.55 -0.02 0.00 1.00 0.00 0.00 64.86 65.40 1k7f h ILE 197 Cb 0.59 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1k7f h ILE 197 CO 0.04 0.23 0.24 -0.33 0.00 0.00 0.00 178.15 178.32 1k7f h GLU 198 N 0.82 0.72 -0.37 2.37 4.39 -0.16 -2.22 114.58 120.13 1k7f h GLU 198 Ca 0.21 -0.11 0.05 0.00 0.34 0.00 0.00 59.36 59.85 1k7f h GLU 198 Cb 0.08 -0.13 -0.04 0.00 -0.10 0.00 0.00 28.75 28.56 1k7f h GLU 198 CO -0.03 0.60 0.10 0.87 -1.16 0.00 0.00 179.01 179.40 1k7f h LYS 199 N 0.66 0.23 -0.38 2.33 1.79 -1.24 0.31 116.57 120.27 1k7f h LYS 199 Ca 0.17 -0.01 0.07 0.00 -2.18 0.00 0.00 60.65 58.69 1k7f h LYS 199 Cb 0.12 -0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 30.66 1k7f h LYS 199 CO -0.02 0.16 0.02 -0.07 -1.08 0.00 0.00 179.45 178.45 1k7f h LEU 200 N 0.24 -0.12 -0.48 2.94 3.38 -1.23 0.16 115.31 120.20 1k7f h LEU 200 Ca 0.17 0.08 -0.05 0.00 0.09 0.00 0.00 57.88 58.17 1k7f h LEU 200 Cb 0.17 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 1k7f h LEU 200 CO -0.20 -0.02 0.10 0.11 0.09 0.00 0.00 178.44 178.52 1k7f h LYS 201 N 0.13 0.78 -0.96 1.13 1.57 -1.08 -0.15 116.57 117.98 1k7f h LYS 201 Ca 0.19 -0.20 0.17 0.00 -1.87 0.00 0.00 60.65 58.94 1k7f h LYS 201 Cb 0.26 -0.10 -0.09 0.00 0.08 0.00 0.00 32.23 32.38 1k7f h LYS 201 CO -0.30 0.77 0.61 1.49 -0.57 0.00 0.00 179.45 181.45 1k7f h GLU 202 N 0.66 0.69 -0.44 3.15 4.81 0.46 0.17 114.58 124.07 1k7f h GLU 202 Ca 0.15 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1k7f h GLU 202 Cb 0.36 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1k7f h GLU 202 CO 0.01 0.46 0.00 0.66 -0.73 0.00 0.00 179.01 179.40 1k7f n TYR 203 N -4.64 0.60 -2.26 0.92 4.01 0.48 -4.93 117.16 111.34 1k7f n TYR 203 Ca 0.21 -0.29 -0.15 0.00 -0.16 0.00 0.00 57.90 57.51 1k7f n TYR 203 Cb 0.54 -0.03 -0.01 0.00 -0.31 0.00 0.00 39.34 39.54 1k7f n TYR 203 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1k7f n HIS 204 N 0.69 -0.69 -1.17 -0.72 8.25 0.58 -4.78 115.22 117.38 1k7f n HIS 204 Ca 0.14 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.27 1k7f n HIS 204 Cb 0.38 -3.10 0.12 0.00 1.12 0.00 0.00 29.99 28.51 1k7f n HIS 204 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1k7f s ALA 205 N -2.74 1.92 0.40 -1.41 0.00 -0.16 -4.94 121.76 114.84 1k7f s ALA 205 Ca 0.00 0.73 -0.25 0.00 0.00 0.00 0.00 51.96 52.44 1k7f s ALA 205 Cb 0.00 -3.45 -0.11 0.00 0.00 0.00 0.00 23.12 19.56 1k7f s ALA 205 CO 0.00 -2.16 1.03 0.00 0.00 0.00 0.00 175.76 174.63 1k7f n ALA 206 N -3.29 0.24 -1.59 0.00 0.00 -1.26 -4.86 120.51 109.75 1k7f n ALA 206 Ca 0.13 0.25 -0.49 0.00 0.00 0.00 0.00 53.44 53.33 1k7f n ALA 206 Cb 0.51 -2.09 -0.04 0.00 0.00 0.00 0.00 19.45 17.83 1k7f n ALA 206 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1k7f n PRO 207 N 0.22 1.23 -2.89 0.00 -0.02 -1.26 -3.16 135.00 129.12 1k7f n PRO 207 Ca 0.09 0.44 -0.41 0.00 -2.02 0.00 0.00 63.50 61.60 1k7f n PRO 207 Cb 0.38 -1.97 -0.04 0.00 -0.02 0.00 0.00 33.50 31.85 1k7f n PRO 207 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k7f s ALA 208 N -0.10 3.29 -0.20 3.55 0.00 -1.26 -0.34 121.76 126.70 1k7f s ALA 208 Ca 0.74 0.36 -0.06 0.00 0.00 0.00 0.00 51.96 53.01 1k7f s ALA 208 Cb -0.85 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 19.13 1k7f s ALA 208 CO 0.51 -0.06 0.02 -0.51 0.00 0.00 0.00 175.76 175.72 1k7f s LEU 209 N 0.39 3.37 -0.13 0.00 1.43 -0.09 0.12 118.68 123.77 1k7f s LEU 209 Ca 0.43 -0.15 -0.23 0.00 -1.03 0.00 0.00 54.13 53.15 1k7f s LEU 209 Cb -0.21 -1.86 -0.03 0.00 0.03 0.00 0.00 46.19 44.13 1k7f s LEU 209 CO 0.24 0.07 0.71 -1.58 0.23 0.00 0.00 176.35 176.02 1k7f s GLN 210 N 0.95 4.34 0.08 1.70 0.74 -0.38 -0.73 119.66 126.35 1k7f s GLN 210 Ca 0.02 0.83 0.05 0.00 0.05 0.00 0.00 55.36 56.31 1k7f s GLN 210 Cb -0.14 -3.52 -0.03 0.00 1.10 0.00 0.00 33.01 30.42 1k7f s GLN 210 CO 0.02 -0.12 -0.14 0.20 -0.55 0.00 0.00 175.29 174.70 1k7f s GLY 211 N 0.99 0.91 0.00 2.59 0.00 0.54 -0.38 107.32 111.98 1k7f s GLY 211 Ca 0.35 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 44.01 1k7f s GLY 211 CO 0.14 -1.09 0.00 0.33 0.00 0.00 0.00 173.10 172.49 1k7f n PHE 212 N 1.16 0.00 -0.96 1.90 7.35 -1.26 0.78 117.46 126.43 1k7f n PHE 212 Ca -0.20 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.49 1k7f n PHE 212 Cb 0.54 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.37 1k7f n PHE 212 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1k7f n GLY 213 N 2.91 0.57 3.52 7.13 0.00 -1.26 -4.47 105.19 113.58 1k7f n GLY 213 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1k7f n GLY 213 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k7f s ILE 214 N -2.20 4.76 0.00 -0.61 -1.09 -1.26 -4.84 121.20 115.96 1k7f s ILE 214 Ca 0.00 0.13 0.00 0.00 -2.23 0.00 0.00 60.65 58.55 1k7f s ILE 214 Cb 0.00 -4.26 0.00 0.00 -1.58 0.00 0.00 42.46 36.62 1k7f s ILE 214 CO 0.00 -0.68 0.40 -1.54 -1.23 0.00 0.00 174.94 171.89 1k7f n SER 215 N 6.43 0.20 -3.99 3.58 3.41 -1.26 -4.55 113.62 117.45 1k7f n SER 215 Ca -0.01 -1.08 -0.09 0.00 -0.26 0.00 0.00 58.87 57.43 1k7f n SER 215 Cb 0.48 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.32 1k7f n SER 215 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1k7f s SER 216 N -0.08 0.26 0.37 4.04 1.04 -1.26 -5.02 113.70 113.04 1k7f s SER 216 Ca 0.00 -0.54 0.13 0.00 0.48 0.00 0.00 55.95 56.01 1k7f s SER 216 Cb 0.00 0.12 0.94 0.00 0.10 0.00 0.00 66.02 67.18 1k7f s SER 216 CO 0.00 -0.34 1.81 -0.65 0.98 0.00 0.00 173.24 175.04 1k7f h PRO 217 N 4.43 0.55 -0.12 4.02 0.11 -1.93 -1.94 132.00 137.11 1k7f h PRO 217 Ca -0.32 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 65.71 1k7f h PRO 217 Cb 1.20 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1k7f h PRO 217 CO 0.44 0.36 -0.15 1.05 -0.21 0.00 0.00 178.00 179.50 1k7f h GLU 218 N 0.56 0.20 -0.10 1.05 4.11 -1.96 -1.98 114.58 116.46 1k7f h GLU 218 Ca 0.53 -0.05 -0.12 0.00 0.07 0.00 0.00 59.36 59.80 1k7f h GLU 218 Cb 1.10 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.31 1k7f h GLU 218 CO -0.28 0.35 -0.47 1.96 0.07 0.00 0.00 179.01 180.65 1k7f h GLN 219 N 0.19 0.23 -0.57 1.06 4.20 -1.77 -1.17 115.11 117.28 1k7f h GLN 219 Ca 0.04 -0.12 -0.03 0.00 0.06 0.00 0.00 58.65 58.59 1k7f h GLN 219 Cb 0.38 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.14 1k7f h GLN 219 CO 0.02 0.66 0.22 0.28 -0.67 0.00 0.00 178.83 179.35 1k7f h VAL 220 N 0.19 1.23 -0.48 -0.54 2.07 -1.34 -2.32 116.25 115.06 1k7f h VAL 220 Ca 0.01 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 1k7f h VAL 220 Cb 0.90 0.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1k7f h VAL 220 CO 0.07 0.27 0.22 0.77 0.02 0.00 0.00 177.57 178.93 1k7f h SER 221 N 0.79 0.65 -0.65 0.57 4.64 -1.35 -1.52 113.55 116.68 1k7f h SER 221 Ca 0.19 -0.14 0.08 0.00 -0.47 0.00 0.00 61.79 61.45 1k7f h SER 221 Cb 0.21 -0.17 -0.07 0.00 -0.31 0.00 0.00 62.40 62.07 1k7f h SER 221 CO -0.01 0.61 0.31 0.00 -0.87 0.00 0.00 176.83 176.86 1k7f h ALA 222 N 1.06 0.87 -0.40 5.18 0.00 -1.14 0.23 119.26 125.07 1k7f h ALA 222 Ca 0.16 0.05 0.05 0.00 0.00 0.00 0.00 54.91 55.18 1k7f h ALA 222 Cb 0.15 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 1k7f h ALA 222 CO -0.02 -0.08 0.12 0.00 0.00 0.00 0.00 179.25 179.26 1k7f h ALA 223 N 1.40 0.45 -0.57 0.00 0.00 -1.14 -1.14 119.26 118.26 1k7f h ALA 223 Ca 0.32 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 55.18 1k7f h ALA 223 Cb 0.32 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1k7f h ALA 223 CO -0.26 -0.28 -0.05 0.28 0.00 0.00 0.00 179.25 178.95 1k7f h VAL 224 N 0.26 1.27 -0.43 0.00 2.07 -0.78 -2.21 116.25 116.42 1k7f h VAL 224 Ca 0.19 -1.20 -0.05 0.00 0.82 0.00 0.00 66.70 66.46 1k7f h VAL 224 Cb 0.19 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1k7f h VAL 224 CO -0.21 0.43 0.07 -0.09 0.02 0.00 0.00 177.57 177.78 1k7f h ARG 225 N 0.92 0.67 0.00 1.57 2.43 -0.17 -1.19 114.38 118.61 1k7f h ARG 225 Ca 0.15 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1k7f h ARG 225 Cb 0.61 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1k7f h ARG 225 CO 0.04 0.64 0.00 0.00 -1.51 0.00 0.00 179.97 179.14 1k7f n ALA 226 N -2.47 1.89 0.00 2.80 0.00 -0.47 -4.90 120.51 117.36 1k7f n ALA 226 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1k7f n ALA 226 Cb 0.23 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1k7f n ALA 226 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k7f n GLY 227 N 0.23 1.57 3.70 0.00 0.00 -0.45 -4.80 105.19 105.44 1k7f n GLY 227 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1k7f n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k7f n ALA 228 N -1.11 0.91 1.06 4.61 0.00 -0.86 -4.87 120.51 120.25 1k7f n ALA 228 Ca 0.00 -0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.56 1k7f n ALA 228 Cb 0.00 -2.27 0.34 0.00 0.00 0.00 0.00 19.45 17.51 1k7f n ALA 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k7f n ALA 229 N -1.90 3.28 0.00 0.00 0.00 0.32 -4.40 120.51 117.82 1k7f n ALA 229 Ca 0.16 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1k7f n ALA 229 Cb 0.48 -1.18 0.00 0.00 0.00 0.00 0.00 19.45 18.75 1k7f n ALA 229 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k7f n GLY 230 N 1.46 -0.95 2.98 0.00 0.00 -1.12 -1.66 105.19 105.91 1k7f n GLY 230 Ca 0.07 -0.85 -0.12 0.00 0.00 0.00 0.00 46.02 45.12 1k7f n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k7f s ALA 231 N -1.00 -0.23 -0.19 4.61 0.00 -0.79 -1.25 121.76 122.91 1k7f s ALA 231 Ca 0.00 0.19 -0.05 0.00 0.00 0.00 0.00 51.96 52.10 1k7f s ALA 231 Cb 0.00 -0.12 -0.03 0.00 0.00 0.00 0.00 23.12 22.97 1k7f s ALA 231 CO 0.00 -0.07 0.01 0.42 0.00 0.00 0.00 175.76 176.13 1k7f s ILE 232 N -0.15 4.15 -0.22 0.00 1.01 0.48 -0.92 121.20 125.55 1k7f s ILE 232 Ca -0.02 -0.25 0.01 0.00 0.00 0.00 0.00 60.65 60.39 1k7f s ILE 232 Cb -0.02 -2.87 0.03 0.00 0.01 0.00 0.00 42.46 39.61 1k7f s ILE 232 CO 0.00 0.44 -0.14 -0.55 0.00 0.00 0.00 174.94 174.69 1k7f s SER 233 N 0.81 3.79 0.12 3.58 0.15 -0.38 -4.14 113.70 117.63 1k7f s SER 233 Ca 0.01 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 55.76 1k7f s SER 233 Cb -0.14 -1.55 0.00 0.00 -1.71 0.00 0.00 66.02 62.62 1k7f s SER 233 CO 0.02 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 174.99 1k7f n GLY 234 N 4.58 -0.08 0.33 9.45 0.00 -1.26 -0.58 105.19 117.63 1k7f n GLY 234 Ca -0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 45.94 1k7f n GLY 234 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1k7f h SER 235 N 0.00 0.67 -0.44 1.61 0.02 -1.90 -1.88 113.55 111.63 1k7f h SER 235 Ca 0.00 0.09 0.01 0.00 -0.84 0.00 0.00 61.79 61.05 1k7f h SER 235 Cb 0.00 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 62.49 1k7f h SER 235 CO 0.00 0.26 0.28 0.00 -1.14 0.00 0.00 176.83 176.24 1k7f h ALA 236 N 1.60 0.56 0.72 3.77 0.00 -1.88 -0.22 119.26 123.80 1k7f h ALA 236 Ca 0.52 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.37 1k7f h ALA 236 Cb 0.75 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.38 1k7f h ALA 236 CO -0.37 -0.01 -0.36 0.82 0.00 0.00 0.00 179.25 179.34 1k7f h ILE 237 N 0.58 0.27 -0.58 0.00 1.08 -1.63 -2.38 117.51 114.85 1k7f h ILE 237 Ca 0.17 0.00 0.16 0.00 -0.39 0.00 0.00 64.86 64.80 1k7f h ILE 237 Cb -0.05 0.27 -0.03 0.00 -3.07 0.00 0.00 36.82 33.95 1k7f h ILE 237 CO -0.05 0.00 0.41 0.58 -0.69 0.00 0.00 178.15 178.41 1k7f h VAL 238 N -0.98 0.73 0.02 1.67 2.07 -1.32 -0.08 116.25 118.35 1k7f h VAL 238 Ca -0.10 -0.01 -0.24 0.00 0.82 0.00 0.00 66.70 67.17 1k7f h VAL 238 Cb 0.76 0.68 0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1k7f h VAL 238 CO 0.15 0.01 -1.00 0.11 0.02 0.00 0.00 177.57 176.86 1k7f h LYS 239 N 0.04 0.44 -0.93 1.57 1.57 -0.56 -1.17 116.57 117.54 1k7f h LYS 239 Ca 0.28 -0.50 0.06 0.00 -1.87 0.00 0.00 60.65 58.61 1k7f h LYS 239 Cb 1.05 0.15 -0.06 0.00 0.08 0.00 0.00 32.23 33.45 1k7f h LYS 239 CO -0.01 1.16 0.60 0.82 -0.57 0.00 0.00 179.45 181.45 1k7f h ILE 240 N 0.24 1.09 0.14 1.86 2.04 -0.55 -1.42 117.51 120.91 1k7f h ILE 240 Ca -0.10 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 1k7f h ILE 240 Cb 1.65 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 1k7f h ILE 240 CO 0.18 0.20 -0.07 0.40 0.00 0.00 0.00 178.15 178.86 1k7f h ILE 241 N 1.09 1.02 -0.57 -0.67 2.04 -0.87 -3.08 117.51 116.47 1k7f h ILE 241 Ca 0.39 -0.90 0.10 0.00 1.00 0.00 0.00 64.86 65.45 1k7f h ILE 241 Cb 0.15 1.56 -0.11 0.00 -0.74 0.00 0.00 36.82 37.68 1k7f h ILE 241 CO -0.14 0.21 -0.34 -0.08 0.00 0.00 0.00 178.15 177.80 1k7f h GLU 242 N -0.64 -0.17 0.00 2.37 4.81 -1.04 -0.03 114.58 119.89 1k7f h GLU 242 Ca -0.02 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1k7f h GLU 242 Cb 0.48 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.90 1k7f h GLU 242 CO 0.03 -0.11 0.00 -0.22 -0.73 0.00 0.00 179.01 177.98 1k7f h LYS 243 N -0.17 0.00 0.00 1.92 3.64 -1.31 -3.04 116.57 117.60 1k7f h LYS 243 Ca 0.22 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1k7f h LYS 243 Cb 0.55 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 1k7f h LYS 243 CO -0.66 0.00 -0.12 0.09 -2.27 0.00 0.00 179.45 176.48 1k7f n ASN 244 N -2.39 1.20 -0.44 4.20 3.02 -0.06 -4.81 115.26 115.99 1k7f n ASN 244 Ca -0.02 -2.12 0.41 0.00 -0.03 0.00 0.00 54.58 52.82 1k7f n ASN 244 Cb 0.04 -0.18 0.73 0.00 -0.61 0.00 0.00 39.78 39.76 1k7f n ASN 244 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1k7f h LEU 245 N 0.00 0.00 -2.85 3.41 3.38 -1.34 -0.44 115.31 117.47 1k7f h LEU 245 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1k7f h LEU 245 Cb 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 1k7f h LEU 245 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 1k7f n ALA 246 N -2.71 2.35 -3.09 1.53 0.00 -1.26 -4.50 120.51 112.83 1k7f n ALA 246 Ca 0.32 -1.28 -0.20 0.00 0.00 0.00 0.00 53.44 52.28 1k7f n ALA 246 Cb 1.58 -0.72 -0.04 0.00 0.00 0.00 0.00 19.45 20.28 1k7f n ALA 246 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1k7f n SER 247 N 1.08 -0.42 -0.30 0.00 7.64 -0.17 -4.95 113.62 116.51 1k7f n SER 247 Ca 0.19 -2.89 0.16 0.00 1.01 0.00 0.00 58.87 57.35 1k7f n SER 247 Cb 0.56 -0.07 0.31 0.00 -1.01 0.00 0.00 64.21 64.00 1k7f n SER 247 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1k7f n PRO 248 N 1.27 -0.07 -0.24 1.43 -0.02 -1.25 -0.05 135.00 136.07 1k7f n PRO 248 Ca 0.19 1.28 -0.06 0.00 -2.02 0.00 0.00 63.50 62.89 1k7f n PRO 248 Cb 0.57 -2.08 0.05 0.00 -0.02 0.00 0.00 33.50 32.02 1k7f n PRO 248 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1k7f h LYS 249 N 0.00 0.93 -0.08 -0.52 1.57 -1.92 -1.32 116.57 115.23 1k7f h LYS 249 Ca 0.57 -0.09 -0.23 0.00 -1.87 0.00 0.00 60.65 59.03 1k7f h LYS 249 Cb 1.27 -0.19 0.01 0.00 0.08 0.00 0.00 32.23 33.40 1k7f h LYS 249 CO -0.78 0.67 -0.87 0.37 -0.57 0.00 0.00 179.45 178.26 1k7f h GLN 250 N 0.92 0.67 -0.64 3.15 4.15 -0.84 -0.68 115.11 121.84 1k7f h GLN 250 Ca 0.24 -0.62 0.04 0.00 0.77 0.00 0.00 58.65 59.09 1k7f h GLN 250 Cb -0.02 0.15 -0.05 0.00 0.21 0.00 0.00 27.48 27.78 1k7f h GLN 250 CO -0.04 1.22 0.38 1.98 -1.93 0.00 0.00 178.83 180.44 1k7f h MET 251 N 0.43 0.70 -0.32 1.69 4.05 -0.50 0.68 114.93 121.66 1k7f h MET 251 Ca -0.08 -0.04 -0.14 0.00 -0.28 0.00 0.00 59.70 59.16 1k7f h MET 251 Cb 1.50 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 32.13 1k7f h MET 251 CO 0.17 0.47 -0.37 -0.07 0.23 0.00 0.00 176.91 177.33 1k7f h LEU 252 N 0.73 0.79 -0.78 3.39 3.38 -1.05 -1.17 115.31 120.59 1k7f h LEU 252 Ca 0.27 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 1k7f h LEU 252 Cb 0.09 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1k7f h LEU 252 CO -0.14 1.08 0.24 0.00 0.09 0.00 0.00 178.44 179.71 1k7f h ALA 253 N 0.96 1.02 -0.38 1.53 0.00 0.26 -2.05 119.26 120.59 1k7f h ALA 253 Ca 0.06 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 1k7f h ALA 253 Cb 0.91 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1k7f h ALA 253 CO 0.08 0.66 0.05 0.93 0.00 0.00 0.00 179.25 180.97 1k7f h GLU 254 N 1.11 0.65 -0.43 0.00 5.08 0.57 -2.35 114.58 119.21 1k7f h GLU 254 Ca 0.24 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 1k7f h GLU 254 Cb 0.29 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1k7f h GLU 254 CO -0.01 0.71 0.28 -0.07 -1.00 0.00 0.00 179.01 178.92 1k7f h LEU 255 N 0.49 0.49 -0.51 1.33 3.38 -1.08 -0.38 115.31 119.04 1k7f h LEU 255 Ca 0.11 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1k7f h LEU 255 Cb 0.39 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 1k7f h LEU 255 CO 0.01 0.37 0.29 -0.09 0.09 0.00 0.00 178.44 179.11 1k7f h ARG 256 N 0.57 0.70 -0.45 1.13 2.43 -1.27 0.37 114.38 117.87 1k7f h ARG 256 Ca 0.16 -0.07 -0.07 0.00 -0.81 0.00 0.00 59.98 59.18 1k7f h ARG 256 Cb -0.05 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 1k7f h ARG 256 CO -0.03 0.52 -0.00 0.77 -1.51 0.00 0.00 179.97 179.72 1k7f h SER 257 N 0.68 0.78 0.82 -3.80 0.02 -0.86 -1.63 113.55 109.55 1k7f h SER 257 Ca 0.18 -0.31 -0.04 0.00 -0.84 0.00 0.00 61.79 60.79 1k7f h SER 257 Cb 0.01 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 62.34 1k7f h SER 257 CO -0.03 0.90 -0.48 0.15 -1.14 0.00 0.00 176.83 176.22 1k7f h PHE 258 N 0.64 -1.28 -0.77 3.45 3.57 -0.64 -2.00 116.94 119.92 1k7f h PHE 258 Ca 0.13 -0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.74 1k7f h PHE 258 Cb 0.50 0.45 -0.09 0.00 2.79 0.00 0.00 35.95 39.60 1k7f h PHE 258 CO 0.04 -0.73 0.36 0.28 -2.23 0.00 0.00 178.31 176.03 1k7f h VAL 259 N -1.22 0.75 -0.48 1.41 2.07 -0.31 -0.84 116.25 117.63 1k7f h VAL 259 Ca -0.11 -0.19 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 1k7f h VAL 259 Cb 0.97 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1k7f h VAL 259 CO 0.13 0.10 0.17 -1.28 0.02 0.00 0.00 177.57 176.71 1k7f h SER 260 N 0.56 0.64 0.04 0.57 0.87 -1.11 -0.92 113.55 114.19 1k7f h SER 260 Ca 0.41 -0.08 -0.11 0.00 -1.23 0.00 0.00 61.79 60.77 1k7f h SER 260 Cb 0.54 -0.16 0.01 0.00 -0.44 0.00 0.00 62.40 62.34 1k7f h SER 260 CO -0.34 0.59 -0.46 0.00 -0.53 0.00 0.00 176.83 176.09 1k7f h ALA 261 N 1.50 0.00 -0.97 6.23 0.00 -0.65 0.97 119.26 126.35 1k7f h ALA 261 Ca 0.16 -0.56 0.11 0.00 0.00 0.00 0.00 54.91 54.63 1k7f h ALA 261 Cb 0.17 0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 1k7f h ALA 261 CO -0.01 0.22 0.62 0.52 0.00 0.00 0.00 179.25 180.59 1k7f h MET 262 N -0.44 0.93 -0.13 0.00 2.86 -1.05 -1.99 114.93 115.10 1k7f h MET 262 Ca -0.07 -0.06 -0.22 0.00 -2.06 0.00 0.00 59.70 57.30 1k7f h MET 262 Cb 1.26 -0.21 0.01 0.00 0.06 0.00 0.00 31.60 32.72 1k7f h MET 262 CO 0.09 0.62 -0.78 -0.22 1.06 0.00 0.00 176.91 177.68 1k7f h LYS 263 N 0.96 0.76 -1.00 1.72 1.63 -1.00 -2.86 116.57 116.79 1k7f h LYS 263 Ca 0.47 -0.64 0.19 0.00 -0.85 0.00 0.00 60.65 59.82 1k7f h LYS 263 Cb 0.46 0.14 -0.10 0.00 -0.60 0.00 0.00 32.23 32.13 1k7f h LYS 263 CO -0.23 1.24 0.61 0.00 -3.45 0.00 0.00 179.45 177.63 1k7f h ALA 264 N 0.52 1.75 0.00 5.00 0.00 -0.19 -0.98 119.26 125.36 1k7f h ALA 264 Ca -0.06 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1k7f h ALA 264 Cb 1.41 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1k7f h ALA 264 CO 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.29 1k7f n ALA 265 N -2.35 1.74 1.41 0.00 0.00 -0.81 -2.33 120.51 118.16 1k7f n ALA 265 Ca 0.23 -0.06 0.15 0.00 0.00 0.00 0.00 53.44 53.76 1k7f n ALA 265 Cb 0.60 -1.24 0.75 0.00 0.00 0.00 0.00 19.45 19.56 1k7f n ALA 265 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1k7f n SER 266 N -1.44 0.00 0.00 0.00 3.41 -0.37 -3.69 113.62 111.53 1k7f n SER 266 Ca 0.05 -0.13 0.06 0.00 -0.26 0.00 0.00 58.87 58.59 1k7f n SER 266 Cb 0.16 -0.29 0.36 0.00 -0.26 0.00 0.00 64.21 64.18 1k7f n SER 266 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42