#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k7x n GLU 2 N 0.00 -0.04 0.09 0.03 1.02 -1.26 0.36 120.64 120.84 1k7x n GLU 2 Ca 0.00 0.71 -0.05 0.00 -0.02 0.00 0.00 57.16 57.80 1k7x n GLU 2 Cb 0.00 -1.18 0.11 0.00 -0.02 0.00 0.00 31.44 30.35 1k7x n GLU 2 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1k7x h ARG 3 N 0.00 0.21 -0.01 3.49 3.08 -1.96 0.08 114.38 119.27 1k7x h ARG 3 Ca 0.33 -0.16 -0.17 0.00 0.07 0.00 0.00 59.98 60.05 1k7x h ARG 3 Cb 0.76 0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.82 1k7x h ARG 3 CO -0.43 0.78 -0.79 1.88 -1.07 0.00 0.00 179.97 180.34 1k7x h TYR 4 N 0.15 0.18 -0.49 3.04 0.05 -0.46 -1.46 116.97 117.99 1k7x h TYR 4 Ca -0.01 -0.09 -0.05 0.00 0.05 0.00 0.00 58.73 58.63 1k7x h TYR 4 Cb 1.16 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.85 1k7x h TYR 4 CO 0.02 0.86 0.11 0.93 -1.05 0.00 0.00 178.16 179.03 1k7x h GLU 5 N 0.08 0.79 -0.26 4.88 5.08 -1.22 0.23 114.58 124.16 1k7x h GLU 5 Ca -0.02 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 58.13 1k7x h GLU 5 Cb 1.38 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 1k7x h GLU 5 CO 0.11 0.77 0.10 -0.91 -1.00 0.00 0.00 179.01 178.09 1k7x h ASN 6 N 0.67 0.35 -0.59 1.42 2.35 -1.01 -2.05 115.58 116.73 1k7x h ASN 6 Ca 0.15 -0.16 0.10 0.00 -0.55 0.00 0.00 56.30 55.84 1k7x h ASN 6 Cb 0.34 -0.09 -0.08 0.00 0.05 0.00 0.00 38.32 38.55 1k7x h ASN 6 CO 0.00 0.42 0.18 0.25 -1.65 0.00 0.00 177.43 176.63 1k7x h LEU 7 N 0.26 0.13 -0.44 1.61 5.85 -0.86 -2.30 115.31 119.56 1k7x h LEU 7 Ca 0.09 0.09 -0.14 0.00 0.84 0.00 0.00 57.88 58.75 1k7x h LEU 7 Cb 0.17 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.28 1k7x h LEU 7 CO -0.01 0.08 -0.67 -0.26 -0.34 0.00 0.00 178.44 177.24 1k7x h PHE 8 N 0.34 0.00 -0.47 1.25 0.04 -0.83 -1.12 116.94 116.15 1k7x h PHE 8 Ca 0.30 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.96 1k7x h PHE 8 Cb 0.40 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.53 1k7x h PHE 8 CO -0.20 0.67 -0.17 0.00 -0.60 0.00 0.00 178.31 178.02 1k7x h ALA 9 N 1.33 0.82 -0.19 2.45 0.00 -1.26 0.52 119.26 122.93 1k7x h ALA 9 Ca -0.01 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.46 1k7x h ALA 9 Cb 1.31 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 1k7x h ALA 9 CO 0.09 0.65 -0.19 1.96 0.00 0.00 0.00 179.25 181.75 1k7x h GLN 10 N 0.80 0.46 -0.89 0.00 4.20 -0.91 -1.31 115.11 117.46 1k7x h GLN 10 Ca 0.12 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 1k7x h GLN 10 Cb 0.71 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.46 1k7x h GLN 10 CO 0.05 0.82 0.52 -0.07 -0.67 0.00 0.00 178.83 179.48 1k7x h LEU 11 N 0.12 1.09 -0.24 1.46 3.38 -1.15 -2.76 115.31 117.21 1k7x h LEU 11 Ca 0.03 -0.08 -0.21 0.00 0.09 0.00 0.00 57.88 57.71 1k7x h LEU 11 Cb 0.74 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1k7x h LEU 11 CO 0.05 0.85 -0.90 -1.13 0.09 0.00 0.00 178.44 177.40 1k7x h ASN 12 N 1.24 0.36 -0.09 -0.43 -1.24 -0.38 0.25 115.58 115.29 1k7x h ASN 12 Ca 0.32 -0.29 0.03 0.00 0.71 0.00 0.00 56.30 57.06 1k7x h ASN 12 Cb -0.02 -0.11 -0.00 0.00 0.73 0.00 0.00 38.32 38.92 1k7x h ASN 12 CO -0.06 1.09 0.09 -0.78 -1.29 0.00 0.00 177.43 176.49 1k7x h ASP 13 N 0.16 0.00 -0.08 1.15 3.58 -0.97 -0.58 116.42 119.67 1k7x h ASP 13 Ca -0.06 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.39 1k7x h ASP 13 Cb 1.53 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.58 1k7x h ASP 13 CO 0.14 0.00 0.00 0.54 -2.88 0.00 0.00 179.24 177.04 1k7x n ARG 14 N -4.01 2.35 -3.80 0.28 1.74 -0.48 -4.95 116.66 107.79 1k7x n ARG 14 Ca -0.01 -1.97 -0.34 0.00 -0.77 0.00 0.00 57.85 54.76 1k7x n ARG 14 Cb 0.20 -1.47 0.03 0.00 -1.02 0.00 0.00 32.46 30.20 1k7x n ARG 14 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1k7x n ARG 15 N 1.36 -0.93 -4.14 5.56 1.74 -0.23 -4.62 116.66 115.41 1k7x n ARG 15 Ca 0.15 0.42 -0.15 0.00 -0.77 0.00 0.00 57.85 57.49 1k7x n ARG 15 Cb 0.60 -3.43 -0.13 0.00 -1.02 0.00 0.00 32.46 28.48 1k7x n ARG 15 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 1k7x s GLU 16 N -6.19 0.54 0.67 5.56 2.12 0.75 -3.50 118.70 118.65 1k7x s GLU 16 Ca 0.40 -0.52 -0.10 0.00 0.36 0.00 0.00 54.97 55.11 1k7x s GLU 16 Cb -0.18 -0.42 0.01 0.00 0.26 0.00 0.00 34.13 33.80 1k7x s GLU 16 CO 0.90 0.10 1.04 0.20 -0.54 0.00 0.00 175.26 176.96 1k7x s GLY 17 N -0.93 1.62 0.16 -1.50 0.00 -0.02 -4.44 107.32 102.22 1k7x s GLY 17 Ca -0.04 -0.44 -0.07 0.00 0.00 0.00 0.00 44.72 44.17 1k7x s GLY 17 CO 0.00 -0.10 0.44 0.00 0.00 0.00 0.00 173.10 173.45 1k7x s ALA 18 N -3.26 3.70 -0.14 3.20 0.00 0.02 -4.80 121.76 120.48 1k7x s ALA 18 Ca 0.57 -0.43 0.02 0.00 0.00 0.00 0.00 51.96 52.12 1k7x s ALA 18 Cb -0.11 -2.26 0.01 0.00 0.00 0.00 0.00 23.12 20.76 1k7x s ALA 18 CO 0.50 0.60 -0.21 0.12 0.00 0.00 0.00 175.76 176.77 1k7x s PHE 19 N -1.67 2.58 -0.24 0.00 5.36 -1.26 -1.13 117.98 121.63 1k7x s PHE 19 Ca 0.42 -1.32 -0.02 0.00 -0.96 0.00 0.00 56.93 55.05 1k7x s PHE 19 Cb -0.12 -1.77 0.07 0.00 -0.34 0.00 0.00 43.02 40.86 1k7x s PHE 19 CO 0.22 -0.62 0.04 0.08 -1.46 0.00 0.00 175.22 173.48 1k7x s VAL 20 N 0.91 0.83 0.34 3.12 1.01 -0.62 -1.66 120.40 124.33 1k7x s VAL 20 Ca -0.05 -0.94 -0.21 0.00 0.00 0.00 0.00 61.98 60.79 1k7x s VAL 20 Cb -0.15 -1.37 -0.10 0.00 0.00 0.00 0.00 36.38 34.76 1k7x s VAL 20 CO -0.03 -0.32 0.86 -2.16 0.00 0.00 0.00 175.10 173.44 1k7x s PRO 21 N 1.70 4.28 -0.09 2.72 0.04 -1.25 -1.35 135.00 141.04 1k7x s PRO 21 Ca 0.01 1.03 -0.09 0.00 0.04 0.00 0.00 61.00 61.99 1k7x s PRO 21 Cb -0.17 -2.53 -0.04 0.00 0.04 0.00 0.00 34.50 31.79 1k7x s PRO 21 CO -0.13 0.17 0.22 0.12 0.04 0.00 0.00 177.00 177.42 1k7x s PHE 22 N -1.87 3.63 0.10 0.56 2.19 -0.86 -2.40 117.98 119.34 1k7x s PHE 22 Ca 0.54 0.66 -0.08 0.00 0.33 0.00 0.00 56.93 58.38 1k7x s PHE 22 Cb -0.13 -2.04 -0.01 0.00 -1.31 0.00 0.00 43.02 39.53 1k7x s PHE 22 CO 0.18 0.71 0.18 0.14 1.83 0.00 0.00 175.22 178.26 1k7x s VAL 23 N -1.02 0.14 -0.03 3.12 -7.23 -0.79 -4.39 120.40 110.19 1k7x s VAL 23 Ca 0.17 -1.28 -0.23 0.00 -1.81 0.00 0.00 61.98 58.84 1k7x s VAL 23 Cb -0.13 -1.44 -0.05 0.00 0.56 0.00 0.00 36.38 35.32 1k7x s VAL 23 CO 0.07 -0.63 0.67 -0.89 -0.31 0.00 0.00 175.10 174.01 1k7x s THR 24 N -3.88 4.95 0.16 5.32 2.01 -1.26 -1.61 115.64 121.33 1k7x s THR 24 Ca 0.07 1.40 -0.32 0.00 0.31 0.00 0.00 61.69 63.16 1k7x s THR 24 Cb 0.05 -4.01 -0.10 0.00 0.01 0.00 0.00 72.50 68.45 1k7x s THR 24 CO -0.09 0.33 1.56 -0.76 -0.69 0.00 0.00 174.62 174.97 1k7x s LEU 25 N 0.32 4.37 0.00 4.42 1.43 -0.61 -2.26 118.68 126.35 1k7x s LEU 25 Ca 0.35 2.60 0.00 0.00 -1.03 0.00 0.00 54.13 56.06 1k7x s LEU 25 Cb -0.18 -3.59 0.00 0.00 0.03 0.00 0.00 46.19 42.44 1k7x s LEU 25 CO 0.18 -0.82 0.00 0.61 0.23 0.00 0.00 176.35 176.56 1k7x n GLY 26 N 3.75 0.61 3.63 -3.19 0.00 -1.26 -4.65 105.19 104.09 1k7x n GLY 26 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 1k7x n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1k7x s ASP 27 N -2.43 6.37 0.00 1.61 2.15 -0.96 -1.02 116.67 122.39 1k7x s ASP 27 Ca 0.00 0.44 0.22 0.00 0.43 0.00 0.00 52.55 53.64 1k7x s ASP 27 Cb 0.00 -2.24 0.59 0.00 -0.30 0.00 0.00 42.92 40.97 1k7x s ASP 27 CO 0.00 -0.19 1.50 -0.81 -0.17 0.00 0.00 175.17 175.50 1k7x n PRO 28 N 5.14 2.68 -3.74 4.34 -0.04 -1.26 -4.35 135.00 137.78 1k7x n PRO 28 Ca -0.07 -2.57 -0.01 0.00 -0.04 0.00 0.00 63.50 60.81 1k7x n PRO 28 Cb 0.50 -1.55 -0.00 0.00 -0.04 0.00 0.00 33.50 32.41 1k7x n PRO 28 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1k7x s GLY 29 N -1.10 -0.25 -0.03 0.55 0.00 -0.19 -4.73 107.32 101.58 1k7x s GLY 29 Ca 0.46 0.27 -0.26 0.00 0.00 0.00 0.00 44.72 45.19 1k7x s GLY 29 CO 0.33 0.81 1.24 -2.22 0.00 0.00 0.00 173.10 173.25 1k7x h ILE 30 N 2.00 1.42 -0.18 0.90 2.04 -1.93 -0.87 117.51 120.88 1k7x h ILE 30 Ca -0.27 -1.24 -0.08 0.00 1.00 0.00 0.00 64.86 64.27 1k7x h ILE 30 Cb 1.21 2.24 -0.00 0.00 -0.74 0.00 0.00 36.82 39.53 1k7x h ILE 30 CO 0.29 0.32 -0.20 -0.33 0.00 0.00 0.00 178.15 178.23 1k7x h GLU 31 N -0.49 0.46 -0.86 2.37 4.39 -1.97 -1.49 114.58 116.99 1k7x h GLU 31 Ca 0.00 -0.25 0.09 0.00 0.34 0.00 0.00 59.36 59.54 1k7x h GLU 31 Cb 0.54 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.14 1k7x h GLU 31 CO 0.00 0.82 0.56 0.37 -1.16 0.00 0.00 179.01 179.60 1k7x h GLN 32 N 0.12 0.85 -0.17 2.33 5.75 -1.95 -2.04 115.11 120.00 1k7x h GLN 32 Ca 0.03 -0.05 -0.21 0.00 -0.15 0.00 0.00 58.65 58.27 1k7x h GLN 32 Cb 0.74 -0.19 0.01 0.00 1.07 0.00 0.00 27.48 29.11 1k7x h GLN 32 CO 0.05 0.56 -0.70 1.03 -2.65 0.00 0.00 178.83 177.11 1k7x h SER 33 N 0.87 0.91 -0.62 -0.69 0.87 -0.63 -0.40 113.55 113.87 1k7x h SER 33 Ca 0.39 -0.61 0.09 0.00 -1.23 0.00 0.00 61.79 60.43 1k7x h SER 33 Cb 0.35 -0.27 -0.07 0.00 -0.44 0.00 0.00 62.40 61.97 1k7x h SER 33 CO -0.15 1.38 0.24 -0.07 -0.53 0.00 0.00 176.83 177.69 1k7x h LEU 34 N 0.51 0.24 -0.47 2.23 3.38 -0.98 -0.03 115.31 120.19 1k7x h LEU 34 Ca -0.04 0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.84 1k7x h LEU 34 Cb 1.33 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 42.12 1k7x h LEU 34 CO 0.15 0.14 -0.74 0.11 0.09 0.00 0.00 178.44 178.19 1k7x h LYS 35 N 0.42 0.23 -0.54 1.13 1.57 -1.28 -1.75 116.57 116.35 1k7x h LYS 35 Ca 0.31 -0.19 -0.09 0.00 -1.87 0.00 0.00 60.65 58.81 1k7x h LYS 35 Cb 0.38 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1k7x h LYS 35 CO -0.30 0.86 -0.01 0.82 -0.57 0.00 0.00 179.45 180.25 1k7x h ILE 36 N 0.15 1.26 -0.08 1.86 2.04 -0.55 -1.33 117.51 120.85 1k7x h ILE 36 Ca -0.02 -1.10 -0.17 0.00 1.00 0.00 0.00 64.86 64.57 1k7x h ILE 36 Cb 1.30 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 1k7x h ILE 36 CO 0.11 0.39 -0.67 0.40 0.00 0.00 0.00 178.15 178.38 1k7x h ILE 37 N 0.85 1.38 -0.21 -0.67 2.04 -0.73 -0.83 117.51 119.34 1k7x h ILE 37 Ca 0.16 -2.07 -0.12 0.00 1.00 0.00 0.00 64.86 63.82 1k7x h ILE 37 Cb 0.52 2.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.64 1k7x h ILE 37 CO 0.03 0.62 -0.39 0.44 0.00 0.00 0.00 178.15 178.84 1k7x h ASP 38 N 0.25 0.51 -0.06 1.72 3.32 -1.09 -1.93 116.42 119.14 1k7x h ASP 38 Ca -0.02 -0.22 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 1k7x h ASP 38 Cb 1.22 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.63 1k7x h ASP 38 CO 0.11 0.85 0.04 0.74 -1.72 0.00 0.00 179.24 179.26 1k7x h THR 39 N 0.40 1.04 -0.95 0.35 2.02 -0.99 -0.40 112.91 114.38 1k7x h THR 39 Ca 0.04 -0.12 0.11 0.00 0.77 0.00 0.00 66.41 67.21 1k7x h THR 39 Cb 0.87 1.02 -0.08 0.00 -1.74 0.00 0.00 68.15 68.22 1k7x h THR 39 CO 0.07 0.04 0.59 -0.07 0.37 0.00 0.00 175.52 176.52 1k7x h LEU 40 N 0.04 0.87 -0.06 2.58 3.38 -0.85 -0.56 115.31 120.71 1k7x h LEU 40 Ca 0.02 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1k7x h LEU 40 Cb 0.03 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1k7x h LEU 40 CO -0.00 0.48 -0.06 0.40 0.09 0.00 0.00 178.44 179.35 1k7x h ILE 41 N 0.96 1.37 0.00 1.22 2.04 -1.29 -1.69 117.51 120.12 1k7x h ILE 41 Ca 0.46 -1.21 -0.04 0.00 1.00 0.00 0.00 64.86 65.07 1k7x h ILE 41 Cb 0.41 2.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.53 1k7x h ILE 41 CO -0.25 0.33 -0.21 -0.78 0.00 0.00 0.00 178.15 177.25 1k7x h ASP 42 N -0.29 0.00 0.62 1.72 3.58 -0.79 -0.47 116.42 120.79 1k7x h ASP 42 Ca 0.01 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.46 1k7x h ASP 42 Cb 0.56 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.61 1k7x h ASP 42 CO 0.01 0.21 0.00 0.00 -2.88 0.00 0.00 179.24 176.58 1k7x n ALA 43 N -2.35 2.46 0.00 -0.78 0.00 -0.24 -4.91 120.51 114.68 1k7x n ALA 43 Ca -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1k7x n ALA 43 Cb 0.31 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.27 1k7x n ALA 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k7x n GLY 44 N 1.30 1.19 3.63 0.00 0.00 -0.18 -3.86 105.19 107.26 1k7x n GLY 44 Ca 0.13 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.68 1k7x n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k7x n ALA 45 N -0.17 0.24 0.15 4.61 0.00 -0.65 -4.84 120.51 119.83 1k7x n ALA 45 Ca 0.00 0.45 0.09 0.00 0.00 0.00 0.00 53.44 53.97 1k7x n ALA 45 Cb 0.00 -2.17 0.06 0.00 0.00 0.00 0.00 19.45 17.34 1k7x n ALA 45 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1k7x h ASP 46 N 4.16 0.00 -5.07 0.00 3.32 -1.67 -3.45 116.42 113.71 1k7x h ASP 46 Ca -0.45 0.00 0.09 0.00 0.02 0.00 0.00 57.03 56.70 1k7x h ASP 46 Cb 1.30 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.78 1k7x h ASP 46 CO 0.76 0.15 0.31 0.00 -1.72 0.00 0.00 179.24 178.73 1k7x s ALA 47 N -3.19 -1.40 0.11 3.45 0.00 -1.26 -4.28 121.76 115.19 1k7x s ALA 47 Ca 0.03 -0.06 0.07 0.00 0.00 0.00 0.00 51.96 52.01 1k7x s ALA 47 Cb 0.07 0.78 -0.04 0.00 0.00 0.00 0.00 23.12 23.94 1k7x s ALA 47 CO 0.74 -1.00 -0.18 -0.51 0.00 0.00 0.00 175.76 174.81 1k7x s LEU 48 N -2.89 2.33 -0.14 0.00 1.43 -0.13 -3.89 118.68 115.40 1k7x s LEU 48 Ca 0.10 -0.72 0.00 0.00 -1.03 0.00 0.00 54.13 52.48 1k7x s LEU 48 Cb -0.04 -0.76 0.02 0.00 0.03 0.00 0.00 46.19 45.45 1k7x s LEU 48 CO 0.03 -0.01 -0.12 -0.70 0.23 0.00 0.00 176.35 175.78 1k7x s GLU 49 N -2.12 2.02 -0.07 1.70 2.12 -1.01 0.12 118.70 121.46 1k7x s GLU 49 Ca 0.06 -0.45 0.05 0.00 0.36 0.00 0.00 54.97 55.00 1k7x s GLU 49 Cb -0.09 -1.92 -0.00 0.00 0.26 0.00 0.00 34.13 32.38 1k7x s GLU 49 CO 0.04 -0.25 -0.22 -0.51 -0.54 0.00 0.00 175.26 173.78 1k7x s LEU 50 N 1.57 2.01 -0.14 2.70 1.43 -0.29 -1.89 118.68 124.07 1k7x s LEU 50 Ca 0.05 -0.47 -0.14 0.00 -1.03 0.00 0.00 54.13 52.54 1k7x s LEU 50 Cb -0.13 -1.26 -0.05 0.00 0.03 0.00 0.00 46.19 44.79 1k7x s LEU 50 CO -0.10 0.19 0.30 -0.83 0.23 0.00 0.00 176.35 176.14 1k7x s GLY 51 N 0.07 2.24 -0.20 -3.19 0.00 -0.63 -1.56 107.32 104.06 1k7x s GLY 51 Ca -0.08 -0.43 -0.16 0.00 0.00 0.00 0.00 44.72 44.04 1k7x s GLY 51 CO 0.05 0.35 0.43 0.14 0.00 0.00 0.00 173.10 174.06 1k7x s VAL 52 N 0.18 5.18 0.23 1.40 1.01 -1.14 -1.58 120.40 125.68 1k7x s VAL 52 Ca 0.18 0.77 -0.32 0.00 0.00 0.00 0.00 61.98 62.61 1k7x s VAL 52 Cb -0.13 -3.76 -0.14 0.00 0.00 0.00 0.00 36.38 32.35 1k7x s VAL 52 CO 0.05 0.24 1.37 -2.65 0.00 0.00 0.00 175.10 174.10 1k7x n PRO 53 N 4.53 1.88 -3.93 2.72 -0.02 -1.26 -4.82 135.00 134.10 1k7x n PRO 53 Ca -0.07 0.67 -0.10 0.00 -2.02 0.00 0.00 63.50 61.97 1k7x n PRO 53 Cb 0.51 -2.30 -0.12 0.00 -0.02 0.00 0.00 33.50 31.57 1k7x n PRO 53 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1k7x s PHE 54 N -0.06 0.15 0.37 6.00 5.36 -1.26 -4.83 117.98 123.70 1k7x s PHE 54 Ca 0.69 -0.30 0.07 0.00 -0.96 0.00 0.00 56.93 56.44 1k7x s PHE 54 Cb -0.69 -0.11 0.71 0.00 -0.34 0.00 0.00 43.02 42.60 1k7x s PHE 54 CO 0.50 -0.13 1.90 0.66 -1.46 0.00 0.00 175.22 176.69 1k7x h SER 55 N 5.17 0.34 -2.31 6.13 4.64 -1.98 -3.36 113.55 122.17 1k7x h SER 55 Ca -0.29 -0.06 -0.59 0.00 -0.47 0.00 0.00 61.79 60.38 1k7x h SER 55 Cb 1.21 -0.09 -0.40 0.00 -0.31 0.00 0.00 62.40 62.81 1k7x h SER 55 CO 0.44 0.45 -0.90 0.47 -0.87 0.00 0.00 176.83 176.43 1k7x n ASP 56 N -4.28 0.98 -4.07 4.97 8.00 -1.26 -5.05 116.55 115.83 1k7x n ASP 56 Ca 0.00 -2.79 -0.42 0.00 0.71 0.00 0.00 54.79 52.29 1k7x n ASP 56 Cb 0.25 -0.63 0.00 0.00 -0.02 0.00 0.00 41.12 40.72 1k7x n ASP 56 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1k7x n PRO 57 N 1.86 3.06 0.00 -0.24 -0.04 -1.26 -4.75 135.00 133.63 1k7x n PRO 57 Ca 0.25 -2.97 0.06 0.00 -0.04 0.00 0.00 63.50 60.81 1k7x n PRO 57 Cb 0.47 -3.32 0.37 0.00 -0.04 0.00 0.00 33.50 30.98 1k7x n PRO 57 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1k7x n LEU 58 N 6.71 0.00 -0.19 1.53 -0.00 -1.26 -1.23 117.00 122.56 1k7x n LEU 58 Ca 0.49 0.00 0.02 0.00 -0.00 0.00 0.00 56.01 56.52 1k7x n LEU 58 Cb 0.41 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 43.87 1k7x n LEU 58 CO 0.83 0.00 0.44 0.00 -0.00 0.00 0.00 177.39 178.66 1k7x n ALA 59 N -0.79 2.25 -2.83 1.47 0.00 -1.26 -5.04 120.51 114.31 1k7x n ALA 59 Ca 0.09 -0.82 -0.37 0.00 0.00 0.00 0.00 53.44 52.35 1k7x n ALA 59 Cb 0.04 -0.14 -0.06 0.00 0.00 0.00 0.00 19.45 19.29 1k7x n ALA 59 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1k7x s ASP 60 N -0.69 6.44 1.22 0.00 1.01 -0.36 -5.14 116.67 119.15 1k7x s ASP 60 Ca 0.06 0.52 -0.20 0.00 0.71 0.00 0.00 52.55 53.64 1k7x s ASP 60 Cb 0.04 -2.09 0.30 0.00 1.01 0.00 0.00 42.92 42.17 1k7x s ASP 60 CO 0.05 0.39 1.12 -0.83 0.21 0.00 0.00 175.17 176.11 1k7x s GLY 61 N -0.98 1.60 0.27 0.21 0.00 -1.26 -4.74 107.32 102.41 1k7x s GLY 61 Ca 0.16 -1.05 -0.00 0.00 0.00 0.00 0.00 44.72 43.83 1k7x s GLY 61 CO 0.05 -0.13 1.79 -2.55 0.00 0.00 0.00 173.10 172.26 1k7x h PRO 62 N -2.65 0.74 0.30 2.90 0.11 -1.99 -1.17 132.00 130.23 1k7x h PRO 62 Ca -0.43 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 1k7x h PRO 62 Cb 1.28 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1k7x h PRO 62 CO 0.30 0.49 -0.25 1.15 -0.21 0.00 0.00 178.00 179.48 1k7x h THR 63 N 0.76 0.47 -0.49 -1.15 2.02 -1.98 0.57 112.91 113.11 1k7x h THR 63 Ca 0.47 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.62 1k7x h THR 63 Cb 0.59 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 1k7x h THR 63 CO -0.32 0.00 0.18 0.40 0.37 0.00 0.00 175.52 176.15 1k7x h ILE 64 N -0.56 1.19 -0.62 3.11 2.04 -1.84 0.14 117.51 120.97 1k7x h ILE 64 Ca -0.02 -0.61 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 1k7x h ILE 64 Cb 0.50 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.17 1k7x h ILE 64 CO -0.02 0.23 0.24 1.56 0.00 0.00 0.00 178.15 180.16 1k7x h GLN 65 N 0.71 0.94 -0.18 2.37 4.20 -0.68 -0.90 115.11 121.57 1k7x h GLN 65 Ca 0.17 -0.18 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 1k7x h GLN 65 Cb 0.16 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 1k7x h GLN 65 CO -0.01 0.80 -0.23 -0.91 -0.67 0.00 0.00 178.83 177.81 1k7x h ASN 66 N 0.87 0.31 -0.95 1.46 4.21 -0.65 -2.11 115.58 118.73 1k7x h ASN 66 Ca 0.21 -0.09 0.05 0.00 1.21 0.00 0.00 56.30 57.67 1k7x h ASN 66 Cb 0.22 -0.08 -0.06 0.00 -1.12 0.00 0.00 38.32 37.28 1k7x h ASN 66 CO -0.01 0.55 0.61 0.00 -1.29 0.00 0.00 177.43 177.30 1k7x h ALA 67 N 1.47 1.29 -0.48 -0.83 0.00 0.34 -0.83 119.26 120.23 1k7x h ALA 67 Ca 0.05 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 1k7x h ALA 67 Cb 0.57 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1k7x h ALA 67 CO 0.04 0.44 -0.21 -0.91 0.00 0.00 0.00 179.25 178.61 1k7x h ASN 68 N 1.15 1.03 -0.51 0.00 4.21 -1.14 -0.51 115.58 119.81 1k7x h ASN 68 Ca 0.40 -0.39 0.09 0.00 1.21 0.00 0.00 56.30 57.60 1k7x h ASN 68 Cb 0.09 -0.28 -0.08 0.00 -1.12 0.00 0.00 38.32 36.93 1k7x h ASN 68 CO -0.15 1.19 0.07 -0.07 -1.29 0.00 0.00 177.43 177.19 1k7x h LEU 69 N 0.86 -0.07 -0.70 1.61 -0.00 -1.08 0.21 115.31 116.14 1k7x h LEU 69 Ca 0.11 0.10 -0.08 0.00 -0.00 0.00 0.00 57.88 58.01 1k7x h LEU 69 Cb 0.80 0.16 -0.03 0.00 -0.00 0.00 0.00 40.66 41.58 1k7x h LEU 69 CO 0.07 -0.01 0.10 0.03 -0.00 0.00 0.00 178.44 178.63 1k7x h ARG 70 N 0.20 1.10 -0.51 1.13 3.08 -0.78 0.46 114.38 119.06 1k7x h ARG 70 Ca 0.26 -0.30 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1k7x h ARG 70 Cb 0.37 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 1k7x h ARG 70 CO -0.37 1.01 0.06 0.00 -1.07 0.00 0.00 179.97 179.61 1k7x h ALA 71 N 1.07 1.15 -0.05 0.04 0.00 -0.48 -1.30 119.26 119.69 1k7x h ALA 71 Ca 0.20 -0.24 -0.20 0.00 0.00 0.00 0.00 54.91 54.68 1k7x h ALA 71 Cb 0.45 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1k7x h ALA 71 CO 0.01 0.56 -0.79 0.74 0.00 0.00 0.00 179.25 179.77 1k7x h PHE 72 N 0.77 0.56 -0.05 0.00 0.04 -0.49 -0.37 116.94 117.40 1k7x h PHE 72 Ca 0.16 -0.27 0.01 0.00 2.80 0.00 0.00 57.97 60.68 1k7x h PHE 72 Cb 0.38 -0.08 -0.00 0.00 2.20 0.00 0.00 35.95 38.45 1k7x h PHE 72 CO 0.02 1.04 0.05 0.00 -0.60 0.00 0.00 178.31 178.82 1k7x h ALA 73 N 0.88 1.73 -0.14 2.45 0.00 0.45 -1.21 119.26 123.42 1k7x h ALA 73 Ca -0.04 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1k7x h ALA 73 Cb 1.39 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1k7x h ALA 73 CO 0.14 -0.07 0.00 0.00 0.00 0.00 0.00 179.25 179.31 1k7x n ALA 74 N -2.39 2.53 -0.23 0.00 0.00 -0.54 -4.94 120.51 114.94 1k7x n ALA 74 Ca -0.02 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 52.90 1k7x n ALA 74 Cb 0.14 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1k7x n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k7x n GLY 75 N 1.14 0.88 3.73 0.00 0.00 -0.46 -4.95 105.19 105.54 1k7x n GLY 75 Ca 0.17 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1k7x n GLY 75 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k7x s VAL 76 N -2.00 3.42 0.37 1.61 1.01 -0.19 -5.00 120.40 119.61 1k7x s VAL 76 Ca 0.00 1.11 0.07 0.00 0.00 0.00 0.00 61.98 63.16 1k7x s VAL 76 Cb 0.00 -3.71 -0.07 0.00 0.00 0.00 0.00 36.38 32.60 1k7x s VAL 76 CO 0.00 0.14 -0.01 0.42 0.00 0.00 0.00 175.10 175.65 1k7x s THR 77 N 0.48 1.86 0.22 3.92 -4.23 -1.26 -4.73 115.64 111.90 1k7x s THR 77 Ca 0.58 -2.05 -0.09 0.00 -1.18 0.00 0.00 61.69 58.95 1k7x s THR 77 Cb -0.35 -2.84 0.17 0.00 1.34 0.00 0.00 72.50 70.82 1k7x s THR 77 CO 0.34 -0.07 1.87 -0.65 -0.54 0.00 0.00 174.62 175.58 1k7x h PRO 78 N 1.93 0.99 -0.52 3.99 0.11 -1.96 -1.08 132.00 135.45 1k7x h PRO 78 Ca -0.43 -0.06 0.09 0.00 0.11 0.00 0.00 66.00 65.71 1k7x h PRO 78 Cb 1.24 -0.22 -0.07 0.00 0.11 0.00 0.00 31.00 32.06 1k7x h PRO 78 CO 0.76 0.65 0.12 0.00 -0.21 0.00 0.00 178.00 179.32 1k7x h ALA 79 N 1.31 0.60 -0.34 -0.75 0.00 -2.00 -1.55 119.26 116.53 1k7x h ALA 79 Ca 0.30 0.10 -0.07 0.00 0.00 0.00 0.00 54.91 55.25 1k7x h ALA 79 Cb -0.04 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1k7x h ALA 79 CO -0.09 -0.29 -0.08 1.96 0.00 0.00 0.00 179.25 180.75 1k7x h GLN 80 N 0.26 0.57 -0.64 0.00 4.20 -1.65 -2.95 115.11 114.91 1k7x h GLN 80 Ca 0.26 -0.15 0.02 0.00 0.06 0.00 0.00 58.65 58.83 1k7x h GLN 80 Cb 0.35 -0.07 -0.04 0.00 0.30 0.00 0.00 27.48 28.03 1k7x h GLN 80 CO -0.33 0.65 0.41 0.00 -0.67 0.00 0.00 178.83 178.89 1k7x h PHE 82 N 0.82 1.05 0.02 0.00 0.04 -1.23 -0.60 116.94 117.05 1k7x h PHE 82 Ca 0.24 -0.13 0.01 0.00 2.80 0.00 0.00 57.97 60.89 1k7x h PHE 82 Cb -0.04 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 37.80 1k7x h PHE 82 CO -0.04 0.88 -0.04 0.93 -0.60 0.00 0.00 178.31 179.44 1k7x h GLU 83 N 0.94 -0.09 -0.55 1.51 5.08 -1.34 -1.63 114.58 118.50 1k7x h GLU 83 Ca 0.19 0.01 0.11 0.00 -1.00 0.00 0.00 59.36 58.67 1k7x h GLU 83 Cb 0.40 0.02 -0.11 0.00 0.50 0.00 0.00 28.75 29.56 1k7x h GLU 83 CO 0.01 -0.06 -0.23 0.52 -1.00 0.00 0.00 179.01 178.25 1k7x h MET 84 N -0.09 -0.10 -0.45 2.33 2.86 -0.62 -2.10 114.93 116.76 1k7x h MET 84 Ca 0.01 0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.63 1k7x h MET 84 Cb 0.10 0.02 -0.02 0.00 0.06 0.00 0.00 31.60 31.76 1k7x h MET 84 CO -0.03 -0.06 0.16 -0.07 1.06 0.00 0.00 176.91 177.96 1k7x h LEU 85 N -0.10 0.64 -1.24 1.22 3.38 -0.86 0.96 115.31 119.31 1k7x h LEU 85 Ca 0.25 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 58.03 1k7x h LEU 85 Cb 0.49 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 1k7x h LEU 85 CO -0.61 0.66 0.49 0.00 0.09 0.00 0.00 178.44 179.07 1k7x h ALA 86 N 1.01 1.44 -0.38 1.53 0.00 -0.94 -2.12 119.26 119.80 1k7x h ALA 86 Ca 0.15 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1k7x h ALA 86 Cb 0.24 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1k7x h ALA 86 CO -0.01 0.51 0.05 -0.07 0.00 0.00 0.00 179.25 179.74 1k7x h LEU 87 N 1.03 0.61 0.27 0.00 3.38 -0.43 -1.64 115.31 118.54 1k7x h LEU 87 Ca 0.28 -0.27 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1k7x h LEU 87 Cb -0.10 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 1k7x h LEU 87 CO -0.06 0.72 -0.19 0.40 0.09 0.00 0.00 178.44 179.41 1k7x h ILE 88 N 0.48 0.60 -0.84 1.22 2.04 -0.32 -2.43 117.51 118.25 1k7x h ILE 88 Ca 0.12 0.00 0.16 0.00 1.00 0.00 0.00 64.86 66.13 1k7x h ILE 88 Cb 0.38 0.60 -0.10 0.00 -0.74 0.00 0.00 36.82 36.96 1k7x h ILE 88 CO 0.01 0.00 0.41 -0.09 0.00 0.00 0.00 178.15 178.47 1k7x h ARG 89 N -0.45 0.54 0.00 2.37 9.65 -1.42 0.22 114.38 125.29 1k7x h ARG 89 Ca -0.02 -0.03 -0.04 0.00 -1.10 0.00 0.00 59.98 58.79 1k7x h ARG 89 Cb 0.39 -0.12 -0.01 0.00 -1.39 0.00 0.00 29.97 28.84 1k7x h ARG 89 CO 0.01 0.36 -0.19 0.93 2.80 0.00 0.00 179.97 183.87 1k7x h GLU 90 N 0.55 0.00 0.00 0.20 5.08 -0.84 -2.54 114.58 117.03 1k7x h GLU 90 Ca 0.47 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.77 1k7x h GLU 90 Cb 0.72 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.96 1k7x h GLU 90 CO -0.40 0.19 -1.05 0.87 -1.00 0.00 0.00 179.01 177.62 1k7x h LYS 91 N 0.00 0.00 -2.17 2.33 1.57 -0.83 -3.43 116.57 114.03 1k7x h LYS 91 Ca -0.00 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.31 1k7x h LYS 91 Cb 0.44 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 32.41 1k7x h LYS 91 CO 0.03 0.12 -0.79 -1.01 -0.57 0.00 0.00 179.45 177.23 1k7x s HIS 92 N -3.18 0.23 0.50 -1.35 3.76 -0.04 -5.04 115.29 110.17 1k7x s HIS 92 Ca -0.01 -1.39 0.23 0.00 -0.15 0.00 0.00 55.06 53.75 1k7x s HIS 92 Cb 0.09 -0.62 1.45 0.00 1.11 0.00 0.00 32.58 34.60 1k7x s HIS 92 CO 0.79 -0.92 2.13 -1.00 -0.85 0.00 0.00 174.74 174.89 1k7x h PRO 93 N 6.60 0.00 0.00 8.40 0.13 -1.83 -3.35 132.00 141.96 1k7x h PRO 93 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1k7x h PRO 93 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1k7x h PRO 93 CO 0.24 0.07 -1.76 0.25 -0.23 0.00 0.00 178.00 176.57 1k7x n THR 94 N -4.02 0.00 -2.38 1.56 -2.24 -1.26 -5.01 114.28 100.93 1k7x n THR 94 Ca -0.03 -0.39 -0.41 0.00 -2.27 0.00 0.00 64.05 60.95 1k7x n THR 94 Cb 0.16 0.14 -0.03 0.00 -2.10 0.00 0.00 70.33 68.49 1k7x n THR 94 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1k7x s ILE 95 N -3.20 3.57 0.35 2.28 2.07 -1.26 -4.92 121.20 120.08 1k7x s ILE 95 Ca -0.06 1.33 -0.27 0.00 -1.41 0.00 0.00 60.65 60.24 1k7x s ILE 95 Cb 0.11 -3.85 -0.09 0.00 0.13 0.00 0.00 42.46 38.76 1k7x s ILE 95 CO 0.74 0.22 1.15 -2.84 -1.91 0.00 0.00 174.94 172.30 1k7x s PRO 96 N -0.31 4.33 -0.14 3.50 0.02 -1.26 -4.94 135.00 136.20 1k7x s PRO 96 Ca 0.52 1.85 0.00 0.00 0.02 0.00 0.00 61.00 63.39 1k7x s PRO 96 Cb -0.33 -2.91 0.02 0.00 0.02 0.00 0.00 34.50 31.31 1k7x s PRO 96 CO 0.37 -0.09 -0.12 0.42 -0.33 0.00 0.00 177.00 177.25 1k7x s ILE 97 N -1.31 1.43 0.17 2.83 1.01 -1.26 -0.96 121.20 123.11 1k7x s ILE 97 Ca 0.51 -0.54 0.06 0.00 0.00 0.00 0.00 60.65 60.68 1k7x s ILE 97 Cb -0.32 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 1k7x s ILE 97 CO 0.41 0.44 0.04 -0.83 0.00 0.00 0.00 174.94 174.99 1k7x s GLY 98 N 1.54 1.74 0.09 6.18 0.00 0.12 -0.54 107.32 116.45 1k7x s GLY 98 Ca 0.05 -1.31 0.03 0.00 0.00 0.00 0.00 44.72 43.50 1k7x s GLY 98 CO -0.10 -1.32 0.09 1.08 0.00 0.00 0.00 173.10 172.85 1k7x s LEU 99 N -2.95 3.81 -0.25 0.66 1.43 0.21 -1.14 118.68 120.45 1k7x s LEU 99 Ca 0.28 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.37 1k7x s LEU 99 Cb -0.10 -2.48 0.04 0.00 0.03 0.00 0.00 46.19 43.69 1k7x s LEU 99 CO 0.20 0.16 -0.10 -0.22 0.23 0.00 0.00 176.35 176.62 1k7x s LEU 100 N -2.46 3.20 0.11 1.79 2.96 -0.60 -0.74 118.68 122.93 1k7x s LEU 100 Ca 0.29 -1.12 0.09 0.00 -0.22 0.00 0.00 54.13 53.18 1k7x s LEU 100 Cb -0.12 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.95 1k7x s LEU 100 CO 0.22 -0.15 -0.23 -0.04 -1.32 0.00 0.00 176.35 174.83 1k7x s MET 101 N 1.21 1.24 0.27 1.98 -1.94 -0.45 -2.89 119.30 118.72 1k7x s MET 101 Ca -0.04 -1.22 -0.10 0.00 -1.71 0.00 0.00 55.69 52.62 1k7x s MET 101 Cb -0.18 -1.59 -0.07 0.00 2.01 0.00 0.00 34.83 35.01 1k7x s MET 101 CO -0.06 0.37 0.59 0.71 -0.01 0.00 0.00 175.02 176.63 1k7x s TYR 102 N -1.11 3.43 0.26 -0.03 2.02 -1.26 -0.88 117.35 119.78 1k7x s TYR 102 Ca 0.09 0.90 -0.03 0.00 -0.37 0.00 0.00 57.07 57.66 1k7x s TYR 102 Cb -0.10 -2.29 0.44 0.00 -0.40 0.00 0.00 41.96 39.61 1k7x s TYR 102 CO 0.05 0.20 1.82 0.00 -1.57 0.00 0.00 175.55 176.04 1k7x h ALA 103 N 2.25 1.27 -0.73 3.71 0.00 -1.92 -2.43 119.26 121.41 1k7x h ALA 103 Ca -0.47 0.03 0.14 0.00 0.00 0.00 0.00 54.91 54.61 1k7x h ALA 103 Cb 1.17 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 1k7x h ALA 103 CO 0.68 0.15 0.49 -0.97 0.00 0.00 0.00 179.25 179.59 1k7x h ASN 104 N 0.86 0.39 0.82 0.00 -1.24 -1.99 0.14 115.58 114.56 1k7x h ASN 104 Ca 0.43 0.02 -0.07 0.00 0.71 0.00 0.00 56.30 57.38 1k7x h ASN 104 Cb 0.39 -0.06 -0.01 0.00 0.73 0.00 0.00 38.32 39.37 1k7x h ASN 104 CO -0.25 0.21 -0.34 -0.07 -1.29 0.00 0.00 177.43 175.69 1k7x h LEU 105 N 0.42 0.00 0.07 0.34 3.38 -1.85 -1.05 115.31 116.61 1k7x h LEU 105 Ca 0.36 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 58.01 1k7x h LEU 105 Cb 0.80 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 1k7x h LEU 105 CO -0.11 0.34 -1.75 0.58 0.09 0.00 0.00 178.44 177.58 1k7x h VAL 106 N 0.00 0.85 0.00 1.22 2.07 -1.21 -3.37 116.25 115.81 1k7x h VAL 106 Ca -0.00 -2.62 -0.14 0.00 0.82 0.00 0.00 66.70 64.76 1k7x h VAL 106 Cb 0.84 2.53 -0.02 0.00 -1.52 0.00 0.00 31.29 33.12 1k7x h VAL 106 CO 0.04 0.71 -0.79 0.15 0.02 0.00 0.00 177.57 177.70 1k7x h PHE 107 N 0.04 0.00 0.00 1.57 3.57 -0.96 -3.29 116.94 117.87 1k7x h PHE 107 Ca -0.32 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.18 1k7x h PHE 107 Cb 2.02 0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.76 1k7x h PHE 107 CO 0.04 0.60 0.00 -1.71 -2.23 0.00 0.00 178.31 175.01 1k7x n ASN 108 N -3.17 0.00 -0.89 0.41 5.15 -0.41 -0.20 115.26 116.15 1k7x n ASN 108 Ca -0.01 0.11 0.05 0.00 -0.60 0.00 0.00 54.58 54.13 1k7x n ASN 108 Cb 0.79 -0.05 0.23 0.00 -0.53 0.00 0.00 39.78 40.22 1k7x n ASN 108 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1k7x n ASN 109 N -1.91 3.32 0.00 1.20 2.85 -1.26 -5.01 115.26 114.45 1k7x n ASN 109 Ca 0.00 -3.24 0.00 0.00 -0.11 0.00 0.00 54.58 51.23 1k7x n ASN 109 Cb 0.00 -0.56 0.00 0.00 1.24 0.00 0.00 39.78 40.46 1k7x n ASN 109 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1k7x n GLY 110 N -0.79 2.76 0.23 8.20 0.00 0.72 -4.74 105.19 111.56 1k7x n GLY 110 Ca 0.24 -1.13 -0.15 0.00 0.00 0.00 0.00 46.02 44.99 1k7x n GLY 110 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1k7x h ILE 111 N 0.00 1.29 -0.93 -0.61 2.04 -1.72 -1.40 117.51 116.19 1k7x h ILE 111 Ca 0.00 -1.87 0.02 0.00 1.00 0.00 0.00 64.86 64.01 1k7x h ILE 111 Cb 0.00 1.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.85 1k7x h ILE 111 CO 0.00 0.59 0.61 -0.78 0.00 0.00 0.00 178.15 178.57 1k7x h ASP 112 N 0.55 1.03 -0.82 1.72 3.58 -1.91 -2.34 116.42 118.23 1k7x h ASP 112 Ca -0.02 -0.02 0.06 0.00 0.42 0.00 0.00 57.03 57.48 1k7x h ASP 112 Cb 1.26 -0.24 -0.06 0.00 1.72 0.00 0.00 39.33 42.00 1k7x h ASP 112 CO 0.13 0.73 0.50 0.00 -2.88 0.00 0.00 179.24 177.72 1k7x h ALA 113 N 1.36 1.11 -0.24 -0.78 0.00 -1.74 -0.22 119.26 118.76 1k7x h ALA 113 Ca 0.36 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 1k7x h ALA 113 Cb -0.06 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1k7x h ALA 113 CO -0.10 0.23 0.10 0.35 0.00 0.00 0.00 179.25 179.83 1k7x h PHE 114 N 0.91 0.37 -0.04 0.00 3.57 -0.74 -1.28 116.94 119.72 1k7x h PHE 114 Ca 0.36 -0.03 -0.18 0.00 3.53 0.00 0.00 57.97 61.65 1k7x h PHE 114 Cb 0.17 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1k7x h PHE 114 CO -0.04 0.39 -0.74 1.88 -2.23 0.00 0.00 178.31 177.56 1k7x h TYR 115 N 0.24 0.38 -0.37 0.41 0.05 -1.06 -1.53 116.97 115.10 1k7x h TYR 115 Ca 0.08 -0.18 -0.01 0.00 0.05 0.00 0.00 58.73 58.67 1k7x h TYR 115 Cb 0.18 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 37.84 1k7x h TYR 115 CO -0.01 0.92 0.17 0.00 -1.05 0.00 0.00 178.16 178.19 1k7x h ALA 116 N 1.03 1.61 -0.47 3.88 0.00 -0.90 -1.12 119.26 123.29 1k7x h ALA 116 Ca -0.03 -0.09 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 1k7x h ALA 116 Cb 1.32 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1k7x h ALA 116 CO 0.12 0.32 -0.23 -0.09 0.00 0.00 0.00 179.25 179.37 1k7x h ARG 117 N 0.51 0.97 -0.67 0.00 9.65 -0.65 0.28 114.38 124.47 1k7x h ARG 117 Ca 0.13 -0.42 -0.08 0.00 -1.10 0.00 0.00 59.98 58.51 1k7x h ARG 117 Cb 0.07 -0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 28.60 1k7x h ARG 117 CO -0.02 1.09 0.12 0.00 2.80 0.00 0.00 179.97 183.97 1k7x h GLU 119 N 1.03 0.63 -0.83 0.00 4.81 -0.93 -1.61 114.58 117.67 1k7x h GLU 119 Ca 0.21 -0.32 0.01 0.00 -0.13 0.00 0.00 59.36 59.12 1k7x h GLU 119 Cb 0.42 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.76 1k7x h GLU 119 CO 0.01 0.92 0.54 0.37 -0.73 0.00 0.00 179.01 180.12 1k7x h GLN 120 N 0.36 1.10 0.00 1.92 4.15 -0.66 -2.93 115.11 119.05 1k7x h GLN 120 Ca 0.05 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1k7x h GLN 120 Cb 0.79 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 28.23 1k7x h GLN 120 CO 0.06 0.74 -0.76 1.33 -1.93 0.00 0.00 178.83 178.27 1k7x n VAL 121 N -4.40 0.27 0.00 2.39 0.24 -0.78 -4.96 118.33 111.10 1k7x n VAL 121 Ca 0.09 -0.25 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 1k7x n VAL 121 Cb 0.03 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.41 1k7x n VAL 121 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1k7x n GLY 122 N 1.36 1.62 3.78 7.63 0.00 -0.68 -4.36 105.19 114.54 1k7x n GLY 122 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 1k7x n GLY 122 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k7x s VAL 123 N -2.00 3.43 -0.01 1.61 1.01 -0.78 -4.75 120.40 118.91 1k7x s VAL 123 Ca 0.00 0.93 0.08 0.00 0.00 0.00 0.00 61.98 63.00 1k7x s VAL 123 Cb 0.00 -3.40 -0.13 0.00 0.00 0.00 0.00 36.38 32.85 1k7x s VAL 123 CO 0.00 -0.15 0.18 0.47 0.00 0.00 0.00 175.10 175.59 1k7x n ASP 124 N -0.96 3.09 -3.59 3.32 8.00 0.30 -4.61 116.55 122.10 1k7x n ASP 124 Ca 0.10 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.49 1k7x n ASP 124 Cb 0.51 1.35 -0.04 0.00 -0.02 0.00 0.00 41.12 42.93 1k7x n ASP 124 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1k7x s SER 125 N -3.00 -0.34 -0.03 -2.24 1.04 -1.10 -0.74 113.70 107.29 1k7x s SER 125 Ca -0.03 -0.26 -0.00 0.00 0.48 0.00 0.00 55.95 56.14 1k7x s SER 125 Cb 0.05 0.53 0.03 0.00 0.10 0.00 0.00 66.02 66.74 1k7x s SER 125 CO 0.35 -0.93 0.03 -0.69 0.98 0.00 0.00 173.24 172.97 1k7x s VAL 126 N -3.80 -0.00 -0.19 5.02 1.01 -0.44 -0.62 120.40 121.38 1k7x s VAL 126 Ca 0.04 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.22 1k7x s VAL 126 Cb 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 36.38 36.21 1k7x s VAL 126 CO -0.10 0.13 -0.05 -0.22 0.00 0.00 0.00 175.10 174.85 1k7x s LEU 127 N 1.34 2.98 -0.25 3.92 0.20 0.08 -1.30 118.68 125.65 1k7x s LEU 127 Ca -0.06 -0.30 -0.12 0.00 0.69 0.00 0.00 54.13 54.34 1k7x s LEU 127 Cb -0.13 -1.73 -0.05 0.00 -0.43 0.00 0.00 46.19 43.85 1k7x s LEU 127 CO -0.03 0.06 0.25 -0.69 -0.29 0.00 0.00 176.35 175.66 1k7x s VAL 128 N 0.98 5.28 0.16 1.68 1.01 -1.26 -1.34 120.40 126.92 1k7x s VAL 128 Ca -0.00 0.34 0.19 0.00 0.00 0.00 0.00 61.98 62.52 1k7x s VAL 128 Cb -0.15 -3.58 0.15 0.00 0.00 0.00 0.00 36.38 32.80 1k7x s VAL 128 CO 0.00 0.27 1.75 0.00 0.00 0.00 0.00 175.10 177.12 1k7x h ALA 129 N 7.85 1.01 0.00 5.51 0.00 -1.37 -2.77 119.26 129.48 1k7x h ALA 129 Ca -0.36 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.23 1k7x h ALA 129 Cb 1.17 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1k7x h ALA 129 CO 0.64 0.44 -0.47 -0.40 0.00 0.00 0.00 179.25 179.45 1k7x n ASP 130 N -3.52 1.73 -4.11 0.00 5.75 -1.26 -4.85 116.55 110.29 1k7x n ASP 130 Ca -0.00 -3.71 -0.33 0.00 -0.01 0.00 0.00 54.79 50.74 1k7x n ASP 130 Cb 0.49 -0.51 -0.15 0.00 -1.03 0.00 0.00 41.12 39.93 1k7x n ASP 130 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1k7x s VAL 131 N -3.02 2.33 0.76 2.12 1.01 -1.05 -4.88 120.40 117.68 1k7x s VAL 131 Ca 0.37 -1.37 -0.12 0.00 0.00 0.00 0.00 61.98 60.86 1k7x s VAL 131 Cb 0.36 -2.26 0.05 0.00 0.00 0.00 0.00 36.38 34.53 1k7x s VAL 131 CO -0.06 0.12 1.11 -2.16 0.00 0.00 0.00 175.10 174.11 1k7x s PRO 132 N 1.19 2.37 0.43 2.72 0.04 -1.26 -4.84 135.00 135.65 1k7x s PRO 132 Ca -0.04 0.45 0.15 0.00 0.04 0.00 0.00 61.00 61.60 1k7x s PRO 132 Cb -0.18 -1.97 1.05 0.00 0.04 0.00 0.00 34.50 33.44 1k7x s PRO 132 CO -0.06 -1.38 1.94 -0.39 0.04 0.00 0.00 177.00 177.15 1k7x h VAL 133 N -0.91 0.83 0.00 -0.36 -1.51 -1.99 0.72 116.25 113.03 1k7x h VAL 133 Ca -0.46 -0.14 -0.01 0.00 -1.23 0.00 0.00 66.70 64.86 1k7x h VAL 133 Cb 1.28 0.39 -0.00 0.00 -2.13 0.00 0.00 31.29 30.82 1k7x h VAL 133 CO 0.63 0.07 -0.03 -0.33 -1.23 0.00 0.00 177.57 176.68 1k7x h GLU 134 N 0.41 0.00 -0.35 5.19 3.07 -2.03 -1.69 114.58 119.17 1k7x h GLU 134 Ca 0.34 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.20 1k7x h GLU 134 Cb 0.75 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.66 1k7x h GLU 134 CO -0.10 0.03 0.00 0.39 -1.40 0.00 0.00 179.01 177.93 1k7x n GLU 135 N -3.89 2.93 0.00 2.33 -0.58 0.19 -4.76 120.64 116.86 1k7x n GLU 135 Ca -0.03 -2.29 0.13 0.00 -0.42 0.00 0.00 57.16 54.56 1k7x n GLU 135 Cb 0.12 -1.44 0.51 0.00 -0.57 0.00 0.00 31.44 30.06 1k7x n GLU 135 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 1k7x n SER 136 N 0.35 0.30 -0.10 1.62 3.41 -0.63 -4.52 113.62 114.05 1k7x n SER 136 Ca 0.15 -0.09 -0.08 0.00 -0.26 0.00 0.00 58.87 58.59 1k7x n SER 136 Cb 0.56 -0.14 -0.02 0.00 -0.26 0.00 0.00 64.21 64.35 1k7x n SER 136 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k7x h ALA 137 N 3.21 -0.26 0.00 7.33 0.00 -1.86 0.15 119.26 127.83 1k7x h ALA 137 Ca 0.00 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1k7x h ALA 137 Cb 0.45 0.72 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 1k7x h ALA 137 CO 0.00 -0.76 -0.06 -1.00 0.00 0.00 0.00 179.25 177.43 1k7x h PRO 138 N -0.29 0.00 0.28 0.00 0.13 -1.99 0.22 132.00 130.35 1k7x h PRO 138 Ca 0.15 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.27 1k7x h PRO 138 Cb 0.55 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.68 1k7x h PRO 138 CO -0.51 0.06 -0.13 0.74 -0.23 0.00 0.00 178.00 177.93 1k7x h PHE 139 N 0.00 -0.35 -0.65 1.56 -1.00 -1.31 -1.74 116.94 113.46 1k7x h PHE 139 Ca -0.00 -0.01 0.01 0.00 2.81 0.00 0.00 57.97 60.78 1k7x h PHE 139 Cb 0.12 0.11 -0.03 0.00 3.61 0.00 0.00 35.95 39.76 1k7x h PHE 139 CO 0.00 0.01 0.43 0.07 -1.61 0.00 0.00 178.31 177.21 1k7x h ARG 140 N -0.81 0.85 -0.49 1.51 0.11 -0.64 0.13 114.38 115.04 1k7x h ARG 140 Ca -0.04 -0.05 -0.06 0.00 0.10 0.00 0.00 59.98 59.93 1k7x h ARG 140 Cb 0.51 -0.19 -0.02 0.00 1.11 0.00 0.00 29.97 31.38 1k7x h ARG 140 CO 0.06 0.56 0.07 1.96 0.10 0.00 0.00 179.97 182.73 1k7x h GLN 141 N 0.88 0.82 -0.20 0.08 4.20 -1.03 -0.44 115.11 119.42 1k7x h GLN 141 Ca 0.24 -0.22 -0.08 0.00 0.06 0.00 0.00 58.65 58.65 1k7x h GLN 141 Cb -0.09 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.58 1k7x h GLN 141 CO -0.06 0.82 -0.23 0.00 -0.67 0.00 0.00 178.83 178.70 1k7x h ALA 142 N 0.96 1.25 0.00 3.87 0.00 -0.95 -1.76 119.26 122.63 1k7x h ALA 142 Ca 0.15 -0.30 -0.00 0.00 0.00 0.00 0.00 54.91 54.75 1k7x h ALA 142 Cb 0.40 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1k7x h ALA 142 CO 0.01 0.49 -0.00 0.00 0.00 0.00 0.00 179.25 179.75 1k7x h ALA 143 N 1.44 -0.00 -0.62 0.00 0.00 -0.41 -2.86 119.26 116.81 1k7x h ALA 143 Ca 0.05 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1k7x h ALA 143 Cb 0.58 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1k7x h ALA 143 CO 0.04 -0.43 0.08 -0.07 0.00 0.00 0.00 179.25 178.87 1k7x h LEU 144 N -0.14 0.99 -2.55 0.00 3.38 -0.75 -0.04 115.31 116.20 1k7x h LEU 144 Ca -0.00 -0.24 0.01 0.00 0.09 0.00 0.00 57.88 57.74 1k7x h LEU 144 Cb 0.14 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1k7x h LEU 144 CO 0.00 1.00 0.04 0.03 0.09 0.00 0.00 178.44 179.60 1k7x h ARG 145 N 0.96 0.00 -0.32 1.13 3.08 -1.14 -2.65 114.38 115.45 1k7x h ARG 145 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1k7x h ARG 145 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1k7x h ARG 145 CO 0.02 0.00 0.00 0.72 -1.07 0.00 0.00 179.97 179.64 1k7x n HIS 146 N -3.63 1.06 -2.71 3.04 8.25 -0.71 -4.95 115.22 115.57 1k7x n HIS 146 Ca -0.02 -0.81 -0.18 0.00 -0.26 0.00 0.00 57.72 56.45 1k7x n HIS 146 Cb 0.12 -0.31 0.02 0.00 1.12 0.00 0.00 29.99 30.94 1k7x n HIS 146 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1k7x n ASN 147 N -0.20 -5.19 -4.51 0.41 3.02 -1.00 -4.66 115.26 103.13 1k7x n ASN 147 Ca 0.21 -0.17 -0.33 0.00 -0.03 0.00 0.00 54.58 54.26 1k7x n ASN 147 Cb 0.89 -4.10 -0.12 0.00 -0.61 0.00 0.00 39.78 35.83 1k7x n ASN 147 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1k7x s ILE 148 N -2.99 3.44 -0.12 2.41 -1.09 -0.11 -2.38 121.20 120.35 1k7x s ILE 148 Ca 0.17 -0.57 -0.29 0.00 -2.23 0.00 0.00 60.65 57.73 1k7x s ILE 148 Cb -0.08 -2.40 -0.01 0.00 -1.58 0.00 0.00 42.46 38.39 1k7x s ILE 148 CO 0.21 0.58 1.00 0.00 -1.23 0.00 0.00 174.94 175.50 1k7x s ALA 149 N -0.52 3.43 -0.09 9.38 0.00 0.08 -3.63 121.76 130.42 1k7x s ALA 149 Ca 0.07 0.34 -0.27 0.00 0.00 0.00 0.00 51.96 52.10 1k7x s ALA 149 Cb -0.12 -3.43 -0.02 0.00 0.00 0.00 0.00 23.12 19.55 1k7x s ALA 149 CO 0.02 -0.64 0.90 -1.25 0.00 0.00 0.00 175.76 174.79 1k7x s PRO 150 N 2.10 4.42 -0.03 0.00 0.04 -1.26 -1.33 135.00 138.93 1k7x s PRO 150 Ca 0.47 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.72 1k7x s PRO 150 Cb -0.18 -3.52 -0.03 0.00 0.04 0.00 0.00 34.50 30.81 1k7x s PRO 150 CO 0.17 -0.20 0.00 0.42 0.04 0.00 0.00 177.00 177.43 1k7x s ILE 151 N 1.64 4.24 0.07 0.56 -1.09 -0.42 -1.76 121.20 124.44 1k7x s ILE 151 Ca 0.45 -0.46 0.08 0.00 -2.23 0.00 0.00 60.65 58.49 1k7x s ILE 151 Cb -0.18 -2.85 -0.03 0.00 -1.58 0.00 0.00 42.46 37.82 1k7x s ILE 151 CO 0.19 0.46 -0.22 -0.36 -1.23 0.00 0.00 174.94 173.78 1k7x s PHE 152 N -1.01 1.90 0.14 3.97 0.08 -1.26 -4.38 117.98 117.41 1k7x s PHE 152 Ca 0.17 -0.39 -0.27 0.00 0.12 0.00 0.00 56.93 56.56 1k7x s PHE 152 Cb -0.11 -1.09 -0.07 0.00 -0.57 0.00 0.00 43.02 41.18 1k7x s PHE 152 CO 0.07 0.16 0.85 0.42 -0.10 0.00 0.00 175.22 176.62 1k7x s ILE 153 N -0.94 4.43 -0.35 0.64 1.01 -1.26 -1.84 121.20 122.88 1k7x s ILE 153 Ca 0.08 1.86 -0.07 0.00 0.00 0.00 0.00 60.65 62.52 1k7x s ILE 153 Cb -0.09 -4.22 0.04 0.00 0.01 0.00 0.00 42.46 38.20 1k7x s ILE 153 CO 0.03 0.43 0.13 0.00 0.00 0.00 0.00 174.94 175.53 1k7x s PRO 155 N 1.41 2.90 0.50 0.00 0.04 -1.26 -1.62 135.00 136.97 1k7x s PRO 155 Ca -0.01 0.55 0.22 0.00 0.04 0.00 0.00 61.00 61.81 1k7x s PRO 155 Cb -0.20 -2.02 1.31 0.00 0.04 0.00 0.00 34.50 33.63 1k7x s PRO 155 CO 0.03 -1.03 2.06 -1.00 0.04 0.00 0.00 177.00 177.10 1k7x h PRO 156 N -0.65 0.00 -0.31 0.56 0.13 -1.98 -1.98 132.00 127.76 1k7x h PRO 156 Ca -0.45 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 1k7x h PRO 156 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 1k7x h PRO 156 CO 0.63 0.13 0.00 0.27 -0.23 0.00 0.00 178.00 178.80 1k7x n ASN 157 N -3.93 4.08 -4.61 1.44 6.94 -1.26 -4.67 115.26 113.24 1k7x n ASN 157 Ca -0.02 -3.04 -0.58 0.00 -0.02 0.00 0.00 54.58 50.92 1k7x n ASN 157 Cb 0.22 -0.57 -0.08 0.00 -2.36 0.00 0.00 39.78 36.99 1k7x n ASN 157 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1k7x n ALA 158 N -0.40 -0.04 -1.37 -2.53 0.00 -0.75 -4.91 120.51 110.52 1k7x n ALA 158 Ca 0.23 0.29 -0.29 0.00 0.00 0.00 0.00 53.44 53.68 1k7x n ALA 158 Cb 0.95 -2.23 0.15 0.00 0.00 0.00 0.00 19.45 18.32 1k7x n ALA 158 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1k7x s ASP 159 N 4.49 3.15 0.39 0.00 1.47 -1.26 -4.71 116.67 120.20 1k7x s ASP 159 Ca 1.04 1.09 0.10 0.00 1.18 0.00 0.00 52.55 55.95 1k7x s ASP 159 Cb -1.13 -1.71 0.79 0.00 -0.34 0.00 0.00 42.92 40.53 1k7x s ASP 159 CO 0.65 -2.79 1.92 -0.78 0.68 0.00 0.00 175.17 174.84 1k7x h ASP 160 N -1.66 0.21 -0.06 2.11 3.58 -1.99 0.72 116.42 119.33 1k7x h ASP 160 Ca -0.52 -0.04 -0.13 0.00 0.42 0.00 0.00 57.03 56.76 1k7x h ASP 160 Cb 1.33 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 42.31 1k7x h ASP 160 CO 0.60 0.37 -0.37 0.44 -2.88 0.00 0.00 179.24 177.40 1k7x h ASP 161 N 0.21 0.59 -0.21 2.28 5.19 -2.00 -1.30 116.42 121.19 1k7x h ASP 161 Ca 0.04 -0.25 -0.09 0.00 -0.62 0.00 0.00 57.03 56.11 1k7x h ASP 161 Cb 0.37 -0.17 -0.00 0.00 0.18 0.00 0.00 39.33 39.72 1k7x h ASP 161 CO 0.02 0.91 -0.23 0.25 -3.12 0.00 0.00 179.24 177.07 1k7x h LEU 162 N 0.47 0.57 -0.87 1.55 5.85 -1.56 -1.49 115.31 119.83 1k7x h LEU 162 Ca 0.05 -0.49 0.22 0.00 0.84 0.00 0.00 57.88 58.50 1k7x h LEU 162 Cb 0.86 -0.16 -0.13 0.00 0.37 0.00 0.00 40.66 41.61 1k7x h LEU 162 CO 0.07 0.94 0.33 -0.07 -0.34 0.00 0.00 178.44 179.38 1k7x h LEU 163 N 0.21 0.22 -0.28 2.25 3.38 -0.64 0.34 115.31 120.78 1k7x h LEU 163 Ca 0.03 0.16 -0.20 0.00 0.09 0.00 0.00 57.88 57.96 1k7x h LEU 163 Cb 0.79 0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 1k7x h LEU 163 CO 0.06 -0.05 -0.84 0.03 0.09 0.00 0.00 178.44 177.73 1k7x h ARG 164 N 0.34 0.38 -0.25 1.13 3.08 -0.97 -0.05 114.38 118.04 1k7x h ARG 164 Ca 0.54 -0.37 -0.19 0.00 0.07 0.00 0.00 59.98 60.03 1k7x h ARG 164 Cb 1.04 0.09 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1k7x h ARG 164 CO -0.56 1.03 -0.60 1.96 -1.07 0.00 0.00 179.97 180.73 1k7x h GLN 165 N 0.23 0.83 -0.48 0.04 4.20 -0.67 -0.14 115.11 119.12 1k7x h GLN 165 Ca -0.05 -0.56 -0.06 0.00 0.06 0.00 0.00 58.65 58.03 1k7x h GLN 165 Cb 1.45 0.08 -0.02 0.00 0.30 0.00 0.00 27.48 29.29 1k7x h GLN 165 CO 0.14 1.18 0.04 0.28 -0.67 0.00 0.00 178.83 179.81 1k7x h VAL 166 N 0.62 1.23 -0.26 -0.54 2.07 -0.90 0.16 116.25 118.63 1k7x h VAL 166 Ca -0.00 -0.93 -0.15 0.00 0.82 0.00 0.00 66.70 66.44 1k7x h VAL 166 Cb 1.21 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1k7x h VAL 166 CO 0.13 0.33 -0.44 0.00 0.02 0.00 0.00 177.57 177.61 1k7x h ALA 167 N 1.31 0.73 -0.43 1.67 0.00 -0.80 -2.19 119.26 119.54 1k7x h ALA 167 Ca 0.15 -0.47 -0.11 0.00 0.00 0.00 0.00 54.91 54.49 1k7x h ALA 167 Cb 0.39 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1k7x h ALA 167 CO 0.01 0.67 -0.15 1.03 0.00 0.00 0.00 179.25 180.81 1k7x h SER 168 N 0.54 0.87 0.74 0.00 0.87 -0.36 -3.38 113.55 112.83 1k7x h SER 168 Ca 0.04 -0.38 -0.19 0.00 -1.23 0.00 0.00 61.79 60.03 1k7x h SER 168 Cb 0.98 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 62.67 1k7x h SER 168 CO 0.09 1.05 -1.38 1.88 -0.53 0.00 0.00 176.83 177.95 1k7x h TYR 169 N 0.68 0.00 -3.81 2.24 0.05 -0.69 -3.48 116.97 111.95 1k7x h TYR 169 Ca 0.10 0.00 -0.49 0.00 0.05 0.00 0.00 58.73 58.39 1k7x h TYR 169 Cb 0.70 0.00 0.05 0.00 1.01 0.00 0.00 36.73 38.49 1k7x h TYR 169 CO 0.05 0.67 0.21 0.20 -1.05 0.00 0.00 178.16 178.24 1k7x s GLY 170 N -4.82 1.58 0.13 3.88 0.00 -0.83 -4.79 107.32 102.47 1k7x s GLY 170 Ca -0.02 -0.51 -0.05 0.00 0.00 0.00 0.00 44.72 44.14 1k7x s GLY 170 CO 0.81 -0.26 0.15 0.50 0.00 0.00 0.00 173.10 174.30 1k7x s ARG 171 N -4.97 0.97 0.43 2.90 1.81 -0.72 -4.60 118.95 114.77 1k7x s ARG 171 Ca 0.52 -1.25 0.00 0.00 -1.72 0.00 0.00 55.73 53.28 1k7x s ARG 171 Cb -0.11 0.31 0.00 0.00 -0.45 0.00 0.00 34.95 34.70 1k7x s ARG 171 CO 0.47 -0.31 0.00 0.41 -0.68 0.00 0.00 175.30 175.19 1k7x n GLY 172 N -0.11 1.84 3.29 -3.53 0.00 -1.26 -4.50 105.19 100.92 1k7x n GLY 172 Ca -0.08 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 45.50 1k7x n GLY 172 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1k7x s TYR 173 N 0.00 0.79 -0.21 1.61 -0.85 -1.26 -4.20 117.35 113.23 1k7x s TYR 173 Ca 0.00 -1.10 -0.09 0.00 -0.52 0.00 0.00 57.07 55.36 1k7x s TYR 173 Cb 0.00 -0.29 -0.05 0.00 0.38 0.00 0.00 41.96 42.00 1k7x s TYR 173 CO 0.00 -0.70 0.12 0.99 -1.52 0.00 0.00 175.55 174.44 1k7x s THR 174 N -4.07 5.24 -0.59 -3.49 2.01 0.43 -4.52 115.64 110.65 1k7x s THR 174 Ca 0.28 0.13 -0.26 0.00 0.31 0.00 0.00 61.69 62.16 1k7x s THR 174 Cb 0.05 -3.40 0.04 0.00 0.01 0.00 0.00 72.50 69.20 1k7x s THR 174 CO 0.07 0.42 1.08 -0.47 -0.69 0.00 0.00 174.62 175.03 1k7x s TYR 175 N 0.53 2.65 -0.27 4.92 6.14 -0.77 -0.48 117.35 130.07 1k7x s TYR 175 Ca 0.07 0.11 -0.10 0.00 0.64 0.00 0.00 57.07 57.79 1k7x s TYR 175 Cb -0.12 -4.32 -0.04 0.00 0.42 0.00 0.00 41.96 37.89 1k7x s TYR 175 CO -0.00 -1.55 0.15 -1.17 0.64 0.00 0.00 175.55 173.63 1k7x s LEU 176 N 4.55 3.86 0.10 6.97 2.96 0.56 -0.97 118.68 136.71 1k7x s LEU 176 Ca 0.35 -0.09 -0.10 0.00 -0.22 0.00 0.00 54.13 54.07 1k7x s LEU 176 Cb -0.10 -2.06 -0.16 0.00 0.50 0.00 0.00 46.19 44.36 1k7x s LEU 176 CO 0.20 -0.05 1.25 0.25 -1.32 0.00 0.00 176.35 176.69 1k7x h LEU 177 N 8.33 0.78 -9.71 -0.68 5.85 -1.59 0.34 115.31 118.63 1k7x h LEU 177 Ca -0.36 -0.61 -0.52 0.00 0.84 0.00 0.00 57.88 57.23 1k7x h LEU 177 Cb 1.18 -0.24 0.07 0.00 0.37 0.00 0.00 40.66 42.04 1k7x h LEU 177 CO 0.56 1.40 0.96 -2.16 -0.34 0.00 0.00 178.44 178.86 1k7x s PRO 192 N -3.38 4.13 0.24 5.25 0.05 -1.26 -4.62 135.00 135.40 1k7x s PRO 192 Ca -0.08 2.59 -0.05 0.00 0.05 0.00 0.00 61.00 63.50 1k7x s PRO 192 Cb 0.08 -3.06 0.42 0.00 0.05 0.00 0.00 34.50 31.99 1k7x s PRO 192 CO 0.90 -0.70 1.74 1.25 0.05 0.00 0.00 177.00 180.24 1k7x h LEU 193 N 6.07 0.30 -1.81 -3.56 5.85 -1.99 0.36 115.31 120.52 1k7x h LEU 193 Ca -0.44 0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.34 1k7x h LEU 193 Cb 1.21 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.30 1k7x h LEU 193 CO 0.89 0.13 -0.15 0.45 -0.34 0.00 0.00 178.44 179.43 1k7x h HIS 194 N 0.46 0.00 0.00 1.25 3.86 -1.99 0.16 115.15 118.89 1k7x h HIS 194 Ca 0.39 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.59 1k7x h HIS 194 Cb 0.56 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.03 1k7x h HIS 194 CO -0.16 0.15 -0.07 1.25 0.86 0.00 0.00 177.93 179.96 1k7x h HIS 195 N 0.00 0.00 -0.68 2.45 -0.00 -1.34 -2.01 115.15 113.58 1k7x h HIS 195 Ca -0.00 0.00 0.14 0.00 -0.00 0.00 0.00 60.37 60.51 1k7x h HIS 195 Cb 0.34 0.00 -0.11 0.00 -0.00 0.00 0.00 27.41 27.64 1k7x h HIS 195 CO 0.00 0.94 0.08 -0.07 -0.00 0.00 0.00 177.93 178.88 1k7x h LEU 196 N -1.00 -0.16 -0.57 0.26 4.07 -1.08 -1.22 115.31 115.62 1k7x h LEU 196 Ca -0.02 0.15 -0.11 0.00 0.08 0.00 0.00 57.88 57.98 1k7x h LEU 196 Cb 0.94 0.24 -0.02 0.00 1.08 0.00 0.00 40.66 42.90 1k7x h LEU 196 CO -0.01 -0.09 -0.08 0.40 -1.08 0.00 0.00 178.44 177.58 1k7x h ILE 197 N 0.18 1.27 -0.18 1.22 2.04 -0.71 -1.63 117.51 119.70 1k7x h ILE 197 Ca 0.37 -1.24 -0.19 0.00 1.00 0.00 0.00 64.86 64.79 1k7x h ILE 197 Cb 0.61 0.92 0.00 0.00 -0.74 0.00 0.00 36.82 37.61 1k7x h ILE 197 CO -0.53 0.44 -0.66 -0.33 0.00 0.00 0.00 178.15 177.08 1k7x h GLU 198 N 0.94 0.69 -0.60 2.37 4.39 -1.09 -1.77 114.58 119.51 1k7x h GLU 198 Ca 0.15 -0.49 0.07 0.00 0.34 0.00 0.00 59.36 59.43 1k7x h GLU 198 Cb 0.65 0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 29.32 1k7x h GLU 198 CO 0.05 1.11 0.27 0.87 -1.16 0.00 0.00 179.01 180.15 1k7x h LYS 199 N 0.50 0.48 -0.72 2.33 1.79 -1.11 0.92 116.57 120.75 1k7x h LYS 199 Ca -0.02 -0.03 -0.03 0.00 -2.18 0.00 0.00 60.65 58.39 1k7x h LYS 199 Cb 1.25 -0.11 -0.03 0.00 -1.58 0.00 0.00 32.23 31.76 1k7x h LYS 199 CO 0.13 0.32 0.33 -0.07 -1.08 0.00 0.00 179.45 179.08 1k7x h LEU 200 N 0.49 0.96 -0.57 2.94 3.38 -1.14 0.12 115.31 121.49 1k7x h LEU 200 Ca 0.29 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.97 1k7x h LEU 200 Cb 0.28 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1k7x h LEU 200 CO -0.24 0.84 -0.35 0.11 0.09 0.00 0.00 178.44 178.89 1k7x h LYS 201 N 1.02 0.76 -0.95 1.13 1.57 -0.93 -0.15 116.57 119.01 1k7x h LYS 201 Ca 0.25 -0.37 0.11 0.00 -1.87 0.00 0.00 60.65 58.76 1k7x h LYS 201 Cb 0.14 -0.00 -0.08 0.00 0.08 0.00 0.00 32.23 32.37 1k7x h LYS 201 CO -0.03 0.99 0.59 1.49 -0.57 0.00 0.00 179.45 181.92 1k7x h GLU 202 N 0.63 0.93 -0.16 3.15 4.81 -0.09 -1.53 114.58 122.32 1k7x h GLU 202 Ca 0.06 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1k7x h GLU 202 Cb 0.89 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 30.06 1k7x h GLU 202 CO 0.08 0.62 0.00 0.66 -0.73 0.00 0.00 179.01 179.64 1k7x n TYR 203 N -4.64 0.22 -3.61 0.92 4.01 0.35 -4.91 117.16 109.50 1k7x n TYR 203 Ca 0.17 -0.11 -0.24 0.00 -0.16 0.00 0.00 57.90 57.56 1k7x n TYR 203 Cb 0.31 0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.42 1k7x n TYR 203 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1k7x n HIS 204 N 0.05 -2.78 -1.03 -0.72 8.25 -0.58 -4.71 115.22 113.69 1k7x n HIS 204 Ca 0.12 1.00 -0.29 0.00 -0.26 0.00 0.00 57.72 58.29 1k7x n HIS 204 Cb 0.22 -4.98 0.17 0.00 1.12 0.00 0.00 29.99 26.52 1k7x n HIS 204 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1k7x s ALA 205 N -3.33 0.98 0.66 -1.41 0.00 -0.12 -4.93 121.76 113.61 1k7x s ALA 205 Ca 0.53 -0.12 -0.16 0.00 0.00 0.00 0.00 51.96 52.21 1k7x s ALA 205 Cb -0.24 -3.20 -0.00 0.00 0.00 0.00 0.00 23.12 19.68 1k7x s ALA 205 CO 0.74 -2.81 1.17 0.00 0.00 0.00 0.00 175.76 174.85 1k7x s ALA 206 N -2.83 2.39 0.65 0.00 0.00 -1.26 -4.90 121.76 115.81 1k7x s ALA 206 Ca 0.65 0.81 -0.18 0.00 0.00 0.00 0.00 51.96 53.24 1k7x s ALA 206 Cb -0.20 -3.41 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 1k7x s ALA 206 CO 0.59 -1.40 1.13 -2.30 0.00 0.00 0.00 175.76 173.77 1k7x n PRO 207 N -2.20 0.91 -3.43 0.00 -0.02 -1.26 -3.47 135.00 125.53 1k7x n PRO 207 Ca 0.12 0.36 -0.38 0.00 -2.02 0.00 0.00 63.50 61.59 1k7x n PRO 207 Cb 0.51 -2.36 -0.06 0.00 -0.02 0.00 0.00 33.50 31.57 1k7x n PRO 207 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1k7x s ALA 208 N -1.52 3.60 -0.16 3.55 0.00 -1.26 -0.43 121.76 125.54 1k7x s ALA 208 Ca 0.79 -0.23 -0.02 0.00 0.00 0.00 0.00 51.96 52.50 1k7x s ALA 208 Cb -0.38 -2.49 -0.02 0.00 0.00 0.00 0.00 23.12 20.23 1k7x s ALA 208 CO 0.44 0.26 -0.09 -0.51 0.00 0.00 0.00 175.76 175.86 1k7x s LEU 209 N -0.28 2.88 -0.03 0.00 1.43 0.37 0.06 118.68 123.12 1k7x s LEU 209 Ca 0.24 -0.30 -0.30 0.00 -1.03 0.00 0.00 54.13 52.74 1k7x s LEU 209 Cb -0.16 -1.68 -0.03 0.00 0.03 0.00 0.00 46.19 44.34 1k7x s LEU 209 CO 0.11 0.12 1.15 -1.58 0.23 0.00 0.00 176.35 176.38 1k7x s GLN 210 N 0.65 4.41 0.39 1.70 2.00 -0.30 -0.33 119.66 128.18 1k7x s GLN 210 Ca -0.05 1.63 0.07 0.00 -2.00 0.00 0.00 55.36 55.01 1k7x s GLN 210 Cb -0.15 -3.49 -0.08 0.00 0.80 0.00 0.00 33.01 30.09 1k7x s GLN 210 CO 0.02 -0.34 0.01 0.20 -0.50 0.00 0.00 175.29 174.68 1k7x s GLY 211 N 1.27 2.41 0.00 2.59 0.00 0.11 0.44 107.32 114.14 1k7x s GLY 211 Ca 0.55 -2.25 0.00 0.00 0.00 0.00 0.00 44.72 43.02 1k7x s GLY 211 CO 0.24 -2.05 0.00 1.97 0.00 0.00 0.00 173.10 173.26 1k7x n PHE 212 N -0.91 0.00 -0.92 1.90 -0.00 -1.25 -4.66 117.46 111.63 1k7x n PHE 212 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.40 1k7x n PHE 212 Cb 0.67 -0.92 0.00 0.00 -0.00 0.00 0.00 39.48 39.23 1k7x n PHE 212 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1k7x n GLY 213 N 0.37 0.75 3.54 4.97 0.00 -1.26 -4.90 105.19 108.65 1k7x n GLY 213 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1k7x n GLY 213 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k7x s ILE 214 N -2.91 4.02 -0.02 -0.61 -1.09 -1.26 -4.74 121.20 114.60 1k7x s ILE 214 Ca 0.00 0.38 0.03 0.00 -2.23 0.00 0.00 60.65 58.83 1k7x s ILE 214 Cb 0.00 -4.76 0.04 0.00 -1.58 0.00 0.00 42.46 36.16 1k7x s ILE 214 CO 0.00 -1.52 0.84 -1.54 -1.23 0.00 0.00 174.94 171.50 1k7x n SER 215 N 8.50 0.60 -3.53 3.58 3.41 -1.26 -4.53 113.62 120.39 1k7x n SER 215 Ca 0.03 -1.80 -0.10 0.00 -0.26 0.00 0.00 58.87 56.74 1k7x n SER 215 Cb 0.48 -0.13 -0.02 0.00 -0.26 0.00 0.00 64.21 64.28 1k7x n SER 215 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1k7x s SER 216 N -0.91 -0.45 0.30 4.04 1.04 -1.26 -5.05 113.70 111.42 1k7x s SER 216 Ca 0.04 -0.12 0.05 0.00 0.48 0.00 0.00 55.95 56.40 1k7x s SER 216 Cb 0.04 0.56 0.68 0.00 0.10 0.00 0.00 66.02 67.40 1k7x s SER 216 CO 0.00 -0.95 1.82 -0.65 0.98 0.00 0.00 173.24 174.44 1k7x h PRO 217 N 2.00 0.82 0.00 4.02 0.11 -1.93 -0.38 132.00 136.64 1k7x h PRO 217 Ca -0.28 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1k7x h PRO 217 Cb 1.28 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1k7x h PRO 217 CO 0.33 0.54 0.00 1.05 -0.21 0.00 0.00 178.00 179.72 1k7x h GLU 218 N 0.85 0.00 0.00 1.05 4.11 -1.96 -1.54 114.58 117.09 1k7x h GLU 218 Ca 0.53 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.95 1k7x h GLU 218 Cb 0.71 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.96 1k7x h GLU 218 CO -0.30 0.00 -0.54 1.96 0.07 0.00 0.00 179.01 180.19 1k7x h GLN 219 N 0.00 0.00 -0.16 1.06 4.20 -1.45 -1.74 115.11 117.01 1k7x h GLN 219 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1k7x h GLN 219 Cb 0.28 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.05 1k7x h GLN 219 CO 0.00 0.03 0.02 0.28 -0.67 0.00 0.00 178.83 178.49 1k7x h VAL 220 N 0.00 1.23 -0.27 -0.54 2.07 -1.35 -1.13 116.25 116.26 1k7x h VAL 220 Ca -0.01 -0.77 -0.14 0.00 0.82 0.00 0.00 66.70 66.61 1k7x h VAL 220 Cb 1.04 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 1k7x h VAL 220 CO 0.00 0.23 -0.40 0.77 0.02 0.00 0.00 177.57 178.20 1k7x h SER 221 N 0.04 0.68 0.50 0.57 4.64 -1.29 -1.62 113.55 117.07 1k7x h SER 221 Ca 0.05 -0.30 -0.12 0.00 -0.47 0.00 0.00 61.79 60.94 1k7x h SER 221 Cb 0.33 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.22 1k7x h SER 221 CO 0.01 1.00 -0.56 0.00 -0.87 0.00 0.00 176.83 176.41 1k7x h ALA 222 N 1.03 1.04 -0.84 5.18 0.00 -1.30 -1.45 119.26 122.92 1k7x h ALA 222 Ca 0.05 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 1k7x h ALA 222 Cb 0.92 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 1k7x h ALA 222 CO 0.08 0.70 0.39 0.00 0.00 0.00 0.00 179.25 180.42 1k7x h ALA 223 N 1.39 1.08 -0.41 0.00 0.00 -0.24 0.16 119.26 121.25 1k7x h ALA 223 Ca -0.00 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.60 1k7x h ALA 223 Cb 1.00 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1k7x h ALA 223 CO 0.08 0.66 -0.27 0.28 0.00 0.00 0.00 179.25 179.99 1k7x h VAL 224 N 1.20 1.28 -0.44 0.00 2.07 -1.30 -0.07 116.25 118.98 1k7x h VAL 224 Ca 0.29 -1.43 -0.13 0.00 0.82 0.00 0.00 66.70 66.24 1k7x h VAL 224 Cb 0.14 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1k7x h VAL 224 CO -0.03 0.48 -0.24 -0.09 0.02 0.00 0.00 177.57 177.71 1k7x h ARG 225 N 0.73 0.92 0.00 1.57 2.43 -0.94 -1.86 114.38 117.23 1k7x h ARG 225 Ca 0.08 -0.40 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 1k7x h ARG 225 Cb 0.85 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 1k7x h ARG 225 CO 0.07 1.05 0.17 0.00 -1.51 0.00 0.00 179.97 179.76 1k7x h ALA 226 N 0.93 1.13 0.00 2.80 0.00 -0.46 -3.45 119.26 120.21 1k7x h ALA 226 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1k7x h ALA 226 Cb 0.80 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1k7x h ALA 226 CO 0.07 -0.13 0.00 0.41 0.00 0.00 0.00 179.25 179.59 1k7x n GLY 227 N -1.25 0.96 3.81 0.00 0.00 -0.70 -4.76 105.19 103.26 1k7x n GLY 227 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 1k7x n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k7x s ALA 228 N -2.00 2.54 -1.63 4.61 0.00 -0.08 -4.88 121.76 120.32 1k7x s ALA 228 Ca 0.00 -0.01 0.27 0.00 0.00 0.00 0.00 51.96 52.22 1k7x s ALA 228 Cb 0.00 -3.15 0.85 0.00 0.00 0.00 0.00 23.12 20.82 1k7x s ALA 228 CO 0.00 -1.39 1.63 0.00 0.00 0.00 0.00 175.76 176.00 1k7x n ALA 229 N -3.23 3.04 0.00 0.00 0.00 0.11 -4.29 120.51 116.13 1k7x n ALA 229 Ca 0.07 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1k7x n ALA 229 Cb 0.54 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1k7x n ALA 229 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k7x n GLY 230 N 1.35 -1.37 2.97 0.00 0.00 -1.19 -0.80 105.19 106.14 1k7x n GLY 230 Ca 0.12 -1.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.03 1k7x n GLY 230 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k7x s ALA 231 N -1.10 0.05 -0.15 4.61 0.00 -0.28 -1.15 121.76 123.73 1k7x s ALA 231 Ca 0.00 -0.40 -0.00 0.00 0.00 0.00 0.00 51.96 51.56 1k7x s ALA 231 Cb 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.22 1k7x s ALA 231 CO 0.00 -0.13 -0.13 0.42 0.00 0.00 0.00 175.76 175.92 1k7x s ILE 232 N -1.10 2.93 -0.66 0.00 1.01 0.17 -1.59 121.20 121.96 1k7x s ILE 232 Ca -0.12 -0.69 -0.16 0.00 0.00 0.00 0.00 60.65 59.68 1k7x s ILE 232 Cb -0.07 -2.24 0.15 0.00 0.01 0.00 0.00 42.46 40.31 1k7x s ILE 232 CO -0.01 0.51 0.65 -0.55 0.00 0.00 0.00 174.94 175.54 1k7x s SER 233 N 0.68 6.39 0.50 3.58 0.15 -0.46 -3.75 113.70 120.79 1k7x s SER 233 Ca -0.07 -2.02 0.21 0.00 0.70 0.00 0.00 55.95 54.77 1k7x s SER 233 Cb -0.15 -2.24 1.29 0.00 -1.71 0.00 0.00 66.02 63.21 1k7x s SER 233 CO 0.02 -0.83 2.07 1.23 1.20 0.00 0.00 173.24 176.94 1k7x h GLY 234 N 8.81 0.00 0.00 9.45 0.00 -1.87 -2.27 103.07 117.19 1k7x h GLY 234 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.18 1k7x h GLY 234 CO 0.96 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 176.36 1k7x n SER 235 N -4.07 0.00 0.22 0.19 3.41 -1.26 -4.77 113.62 107.34 1k7x n SER 235 Ca -0.02 -0.25 0.06 0.00 -0.26 0.00 0.00 58.87 58.40 1k7x n SER 235 Cb 0.20 0.00 0.54 0.00 -0.26 0.00 0.00 64.21 64.69 1k7x n SER 235 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k7x h ALA 236 N 0.00 1.79 -0.39 7.33 0.00 -1.84 -1.81 119.26 124.34 1k7x h ALA 236 Ca 0.00 -0.11 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 1k7x h ALA 236 Cb 0.12 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1k7x h ALA 236 CO 0.00 0.16 -0.32 0.82 0.00 0.00 0.00 179.25 179.91 1k7x h ILE 237 N 0.03 1.28 -0.61 0.00 1.08 -1.82 -2.87 117.51 114.60 1k7x h ILE 237 Ca 0.01 -1.48 -0.04 0.00 -0.39 0.00 0.00 64.86 62.95 1k7x h ILE 237 Cb 0.20 1.36 -0.03 0.00 -3.07 0.00 0.00 36.82 35.29 1k7x h ILE 237 CO 0.01 0.50 0.20 0.58 -0.69 0.00 0.00 178.15 178.75 1k7x h VAL 238 N 0.71 1.23 -0.16 1.67 2.07 -1.56 -2.16 116.25 118.05 1k7x h VAL 238 Ca 0.07 -0.76 -0.10 0.00 0.82 0.00 0.00 66.70 66.73 1k7x h VAL 238 Cb 0.90 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1k7x h VAL 238 CO 0.08 0.30 -0.34 0.11 0.02 0.00 0.00 177.57 177.73 1k7x h LYS 239 N 0.89 0.32 -0.46 1.57 1.57 -1.17 -1.88 116.57 117.41 1k7x h LYS 239 Ca 0.20 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.80 1k7x h LYS 239 Cb 0.23 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 1k7x h LYS 239 CO -0.01 0.63 0.07 0.82 -0.57 0.00 0.00 179.45 180.39 1k7x h ILE 240 N 0.27 1.21 -0.25 1.86 2.04 -1.22 0.31 117.51 121.74 1k7x h ILE 240 Ca 0.03 -0.81 -0.02 0.00 1.00 0.00 0.00 64.86 65.06 1k7x h ILE 240 Cb 0.74 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1k7x h ILE 240 CO 0.06 0.29 0.07 0.40 0.00 0.00 0.00 178.15 178.97 1k7x h ILE 241 N 0.68 1.20 -0.12 -0.67 2.04 -1.17 -2.89 117.51 116.59 1k7x h ILE 241 Ca 0.15 -0.65 -0.00 0.00 1.00 0.00 0.00 64.86 65.36 1k7x h ILE 241 Cb 0.31 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.55 1k7x h ILE 241 CO 0.00 0.21 0.07 -0.08 0.00 0.00 0.00 178.15 178.36 1k7x h GLU 242 N 0.23 0.16 0.00 2.37 4.81 -0.64 -0.49 114.58 121.02 1k7x h GLU 242 Ca 0.08 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.30 1k7x h GLU 242 Cb 0.25 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.60 1k7x h GLU 242 CO -0.00 0.13 -0.00 0.87 -0.73 0.00 0.00 179.01 179.28 1k7x h LYS 243 N 0.13 0.00 -0.06 1.92 1.57 -0.41 -3.18 116.57 116.55 1k7x h LYS 243 Ca 0.04 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1k7x h LYS 243 Cb 0.01 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.31 1k7x h LYS 243 CO -0.01 0.00 -0.43 0.09 -0.57 0.00 0.00 179.45 178.53 1k7x n ASN 244 N -3.44 1.84 0.02 0.86 3.02 -0.22 -4.74 115.26 112.61 1k7x n ASN 244 Ca -0.03 -3.89 0.03 0.00 -0.03 0.00 0.00 54.58 50.66 1k7x n ASN 244 Cb 0.08 -0.55 0.40 0.00 -0.61 0.00 0.00 39.78 39.10 1k7x n ASN 244 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1k7x h LEU 245 N 1.00 0.43 0.00 3.41 3.38 -1.47 -2.29 115.31 119.77 1k7x h LEU 245 Ca 0.04 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1k7x h LEU 245 Cb 1.12 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.76 1k7x h LEU 245 CO 0.07 0.38 0.00 0.00 0.09 0.00 0.00 178.44 178.98 1k7x n ALA 246 N -2.48 1.82 -3.44 1.53 0.00 -1.26 -4.35 120.51 112.33 1k7x n ALA 246 Ca 0.02 -0.06 -0.23 0.00 0.00 0.00 0.00 53.44 53.16 1k7x n ALA 246 Cb 0.12 -1.29 -0.11 0.00 0.00 0.00 0.00 19.45 18.17 1k7x n ALA 246 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1k7x s SER 247 N -2.97 2.40 0.20 0.00 1.04 -0.86 -5.01 113.70 108.49 1k7x s SER 247 Ca 0.09 -1.48 -0.17 0.00 0.48 0.00 0.00 55.95 54.87 1k7x s SER 247 Cb 0.12 0.05 0.19 0.00 0.10 0.00 0.00 66.02 66.47 1k7x s SER 247 CO 0.32 -0.35 1.61 -0.65 0.98 0.00 0.00 173.24 175.15 1k7x h PRO 248 N 7.68 -0.08 -0.59 4.02 0.11 -1.76 0.14 132.00 141.53 1k7x h PRO 248 Ca -0.05 0.01 0.05 0.00 0.11 0.00 0.00 66.00 66.11 1k7x h PRO 248 Cb 1.02 0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.10 1k7x h PRO 248 CO 0.31 -0.05 0.32 0.87 -0.21 0.00 0.00 178.00 179.24 1k7x h LYS 249 N -0.08 0.60 -0.54 1.05 1.57 -1.95 -1.72 116.57 115.50 1k7x h LYS 249 Ca 0.27 -0.04 -0.08 0.00 -1.87 0.00 0.00 60.65 58.94 1k7x h LYS 249 Cb 0.51 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 1k7x h LYS 249 CO -0.66 0.39 0.01 0.37 -0.57 0.00 0.00 179.45 178.99 1k7x h GLN 250 N 0.61 0.90 -0.52 3.15 4.15 -1.73 -2.43 115.11 119.25 1k7x h GLN 250 Ca 0.26 -0.26 0.07 0.00 0.77 0.00 0.00 58.65 59.49 1k7x h GLN 250 Cb 0.13 -0.10 -0.06 0.00 0.21 0.00 0.00 27.48 27.66 1k7x h GLN 250 CO -0.16 0.89 0.19 1.98 -1.93 0.00 0.00 178.83 179.80 1k7x h MET 251 N 0.84 0.36 -0.79 1.69 4.05 -0.39 -0.16 114.93 120.53 1k7x h MET 251 Ca 0.16 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.53 1k7x h MET 251 Cb 0.48 -0.08 -0.04 0.00 -0.80 0.00 0.00 31.60 31.17 1k7x h MET 251 CO 0.02 0.24 0.38 -0.07 0.23 0.00 0.00 176.91 177.71 1k7x h LEU 252 N 0.37 1.02 -0.29 3.39 3.38 -0.91 -0.03 115.31 122.24 1k7x h LEU 252 Ca 0.25 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 1k7x h LEU 252 Cb 0.27 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1k7x h LEU 252 CO -0.25 0.85 0.03 0.00 0.09 0.00 0.00 178.44 179.15 1k7x h ALA 253 N 1.30 0.39 -0.33 1.53 0.00 -0.94 0.29 119.26 121.49 1k7x h ALA 253 Ca 0.27 -0.21 -0.13 0.00 0.00 0.00 0.00 54.91 54.84 1k7x h ALA 253 Cb 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1k7x h ALA 253 CO -0.04 0.10 -0.34 0.93 0.00 0.00 0.00 179.25 179.90 1k7x h GLU 254 N 0.30 0.74 -0.89 0.00 5.08 -0.86 -1.33 114.58 117.62 1k7x h GLU 254 Ca 0.09 -0.35 -0.02 0.00 -1.00 0.00 0.00 59.36 58.07 1k7x h GLU 254 Cb 0.38 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.59 1k7x h GLU 254 CO 0.01 0.97 0.47 -0.07 -1.00 0.00 0.00 179.01 179.39 1k7x h LEU 255 N 0.62 1.13 -0.03 1.33 3.38 -0.76 -0.35 115.31 120.62 1k7x h LEU 255 Ca 0.06 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 57.94 1k7x h LEU 255 Cb 0.87 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1k7x h LEU 255 CO 0.08 0.92 -0.09 -0.09 0.09 0.00 0.00 178.44 179.35 1k7x h ARG 256 N 1.25 -0.13 -0.42 1.13 2.43 -0.00 -0.96 114.38 117.68 1k7x h ARG 256 Ca 0.31 0.01 0.09 0.00 -0.81 0.00 0.00 59.98 59.58 1k7x h ARG 256 Cb 0.06 0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 29.55 1k7x h ARG 256 CO -0.05 -0.09 -0.12 0.77 -1.51 0.00 0.00 179.97 178.98 1k7x h SER 257 N -0.13 -0.44 0.09 -3.80 0.02 -1.11 0.19 113.55 108.37 1k7x h SER 257 Ca 0.04 0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1k7x h SER 257 Cb 0.19 0.28 0.00 0.00 0.14 0.00 0.00 62.40 63.02 1k7x h SER 257 CO -0.11 -0.16 -0.04 0.15 -1.14 0.00 0.00 176.83 175.53 1k7x h PHE 258 N -0.02 -0.11 -0.65 3.45 3.57 -0.87 -2.31 116.94 120.00 1k7x h PHE 258 Ca 0.21 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 1k7x h PHE 258 Cb 0.33 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 1k7x h PHE 258 CO -0.39 0.15 0.38 0.28 -2.23 0.00 0.00 178.31 176.50 1k7x h VAL 259 N -0.36 1.19 -1.00 1.41 2.07 -1.03 -0.51 116.25 118.02 1k7x h VAL 259 Ca -0.01 -0.44 0.24 0.00 0.82 0.00 0.00 66.70 67.30 1k7x h VAL 259 Cb 0.31 0.32 -0.09 0.00 -1.52 0.00 0.00 31.29 30.31 1k7x h VAL 259 CO 0.02 0.20 0.64 -1.28 0.02 0.00 0.00 177.57 177.17 1k7x h SER 260 N 0.88 0.51 0.87 0.57 0.87 -0.60 0.12 113.55 116.77 1k7x h SER 260 Ca 0.23 0.08 -0.23 0.00 -1.23 0.00 0.00 61.79 60.64 1k7x h SER 260 Cb -0.01 -0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 61.92 1k7x h SER 260 CO -0.04 0.14 -1.14 0.00 -0.53 0.00 0.00 176.83 175.26 1k7x h ALA 261 N 1.63 0.36 -0.64 6.23 0.00 -0.79 -0.53 119.26 125.51 1k7x h ALA 261 Ca 0.56 -0.98 -0.09 0.00 0.00 0.00 0.00 54.91 54.41 1k7x h ALA 261 Cb 1.30 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 1k7x h ALA 261 CO -0.29 1.24 0.06 0.52 0.00 0.00 0.00 179.25 180.79 1k7x h MET 262 N 0.01 1.09 -0.05 0.00 2.86 -0.75 -2.25 114.93 115.85 1k7x h MET 262 Ca -0.07 -0.32 -0.14 0.00 -2.06 0.00 0.00 59.70 57.11 1k7x h MET 262 Cb 1.84 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 33.37 1k7x h MET 262 CO 0.14 1.03 -0.62 -0.22 1.06 0.00 0.00 176.91 178.29 1k7x h LYS 263 N 1.00 0.16 -0.77 1.72 1.63 -0.72 -2.81 116.57 116.78 1k7x h LYS 263 Ca 0.19 -0.12 0.10 0.00 -0.85 0.00 0.00 60.65 59.97 1k7x h LYS 263 Cb 0.49 0.02 -0.07 0.00 -0.60 0.00 0.00 32.23 32.07 1k7x h LYS 263 CO 0.02 0.73 0.41 0.00 -3.45 0.00 0.00 179.45 177.15 1k7x h ALA 264 N 1.24 1.08 0.00 5.00 0.00 -0.85 -1.07 119.26 124.67 1k7x h ALA 264 Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1k7x h ALA 264 Cb 1.12 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1k7x h ALA 264 CO 0.09 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.34 1k7x h ALA 265 N 1.45 1.00 -0.00 0.00 0.00 -1.14 -2.57 119.26 118.00 1k7x h ALA 265 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1k7x h ALA 265 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1k7x h ALA 265 CO -0.27 0.00 -0.40 -1.13 0.00 0.00 0.00 179.25 177.45 1k7x n SER 266 N -2.76 0.44 -4.81 0.00 3.41 -0.41 -4.12 113.62 105.37 1k7x n SER 266 Ca -0.01 -0.16 -0.33 0.00 -0.26 0.00 0.00 58.87 58.10 1k7x n SER 266 Cb 0.13 0.12 -0.06 0.00 -0.26 0.00 0.00 64.21 64.13 1k7x n SER 266 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1k7x s ARG 267 N -2.97 4.13 0.00 4.33 0.52 -0.97 -0.84 118.95 123.16 1k7x s ARG 267 Ca 0.12 1.18 0.25 0.00 -0.52 0.00 0.00 55.73 56.76 1k7x s ARG 267 Cb 0.18 -2.17 0.35 0.00 0.52 0.00 0.00 34.95 33.84 1k7x s ARG 267 CO 0.66 -0.12 1.35 0.00 0.02 0.00 0.00 175.30 177.21