#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k8y s THR 2 N 0.00 3.33 -0.08 3.17 2.01 -1.26 -4.85 115.64 117.96 3k8y s THR 2 Ca 0.00 1.07 0.01 0.00 0.31 0.00 0.00 61.69 63.08 3k8y s THR 2 Cb 0.00 -3.68 -0.02 0.00 0.01 0.00 0.00 72.50 68.80 3k8y s THR 2 CO 0.00 0.15 -0.11 -0.70 -0.69 0.00 0.00 174.62 173.26 3k8y s GLU 3 N 0.10 2.84 -0.19 4.92 2.12 -1.26 -0.65 118.70 126.58 3k8y s GLU 3 Ca 0.57 -0.64 -0.01 0.00 0.36 0.00 0.00 54.97 55.26 3k8y s GLU 3 Cb -0.35 -2.53 0.01 0.00 0.26 0.00 0.00 34.13 31.51 3k8y s GLU 3 CO 0.36 0.52 -0.14 0.71 -0.54 0.00 0.00 175.26 176.18 3k8y s TYR 4 N -0.44 2.84 -0.55 5.30 2.02 0.02 -4.95 117.35 121.59 3k8y s TYR 4 Ca 0.06 -1.26 -0.18 0.00 -0.37 0.00 0.00 57.07 55.31 3k8y s TYR 4 Cb -0.12 -1.97 0.09 0.00 -0.40 0.00 0.00 41.96 39.56 3k8y s TYR 4 CO 0.02 -0.64 0.64 0.15 -1.57 0.00 0.00 175.55 174.15 3k8y s LYS 5 N 1.22 3.06 -0.04 -0.62 1.02 -1.26 -1.15 119.74 121.97 3k8y s LYS 5 Ca 0.02 -1.22 -0.02 0.00 0.02 0.00 0.00 55.97 54.77 3k8y s LYS 5 Cb -0.14 -4.20 -0.04 0.00 -0.52 0.00 0.00 37.83 32.93 3k8y s LYS 5 CO -0.06 -1.38 0.10 -0.51 -0.92 0.00 0.00 175.35 172.58 3k8y s LEU 6 N 2.49 4.06 -0.07 3.17 1.43 0.38 -0.64 118.68 129.51 3k8y s LEU 6 Ca 0.11 0.25 0.02 0.00 -1.03 0.00 0.00 54.13 53.48 3k8y s LEU 6 Cb -0.23 -2.25 0.02 0.00 0.03 0.00 0.00 46.19 43.76 3k8y s LEU 6 CO 0.08 0.31 -0.10 -0.69 0.23 0.00 0.00 176.35 176.18 3k8y s VAL 7 N -1.15 1.01 -0.28 -1.59 1.01 -0.34 -0.70 120.40 118.35 3k8y s VAL 7 Ca 0.21 -0.38 -0.10 0.00 0.00 0.00 0.00 61.98 61.71 3k8y s VAL 7 Cb -0.12 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.28 3k8y s VAL 7 CO 0.11 0.33 0.15 -0.69 0.00 0.00 0.00 175.10 175.01 3k8y s VAL 8 N 0.88 4.83 0.23 2.92 1.01 -0.04 -0.78 120.40 129.44 3k8y s VAL 8 Ca -0.11 -0.11 0.06 0.00 0.00 0.00 0.00 61.98 61.82 3k8y s VAL 8 Cb -0.15 -3.35 -0.05 0.00 0.00 0.00 0.00 36.38 32.83 3k8y s VAL 8 CO 0.01 0.21 -0.08 0.68 0.00 0.00 0.00 175.10 175.92 3k8y s VAL 9 N 1.68 1.49 0.00 2.92 -7.23 -0.32 -2.85 120.40 116.09 3k8y s VAL 9 Ca 0.06 -2.13 0.00 0.00 -1.81 0.00 0.00 61.98 58.10 3k8y s VAL 9 Cb -0.16 -2.21 0.00 0.00 0.56 0.00 0.00 36.38 34.57 3k8y s VAL 9 CO 0.08 -0.47 0.00 0.61 -0.31 0.00 0.00 175.10 175.01 3k8y n GLY 10 N -0.43 3.00 3.66 2.32 0.00 -1.26 -0.78 105.19 111.70 3k8y n GLY 10 Ca -0.07 -1.48 -0.31 0.00 0.00 0.00 0.00 46.02 44.16 3k8y n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k8y s ALA 11 N -2.00 1.29 0.30 4.61 0.00 -1.26 -4.06 121.76 120.65 3k8y s ALA 11 Ca 0.00 0.42 -0.30 0.00 0.00 0.00 0.00 51.96 52.09 3k8y s ALA 11 Cb 0.00 -3.39 -0.12 0.00 0.00 0.00 0.00 23.12 19.61 3k8y s ALA 11 CO 0.00 -2.78 1.51 0.41 0.00 0.00 0.00 175.76 174.90 3k8y n GLY 12 N 0.06 1.13 2.31 0.00 0.00 -1.07 -3.14 105.19 104.48 3k8y n GLY 12 Ca 0.10 0.43 0.00 0.00 0.00 0.00 0.00 46.02 46.55 3k8y n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k8y n GLY 13 N 1.70 0.67 0.13 -0.02 0.00 -1.26 -4.91 105.19 101.50 3k8y n GLY 13 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.22 3k8y n GLY 13 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3k8y h VAL 14 N 0.00 0.00 0.00 1.61 -1.51 -1.91 -3.47 116.25 110.97 3k8y h VAL 14 Ca 0.00 -0.53 0.00 0.00 -1.23 0.00 0.00 66.70 64.94 3k8y h VAL 14 Cb 0.00 1.50 0.00 0.00 -2.13 0.00 0.00 31.29 30.66 3k8y h VAL 14 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 3k8y n GLY 15 N 1.12 1.75 0.08 5.19 0.00 -1.26 -4.55 105.19 107.53 3k8y n GLY 15 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 3k8y n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k8y h LYS 16 N 0.00 0.09 -0.28 1.61 1.57 -1.91 -0.44 116.57 117.21 3k8y h LYS 16 Ca 0.00 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 3k8y h LYS 16 Cb 0.00 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 3k8y h LYS 16 CO 0.00 0.06 -0.03 0.77 -0.57 0.00 0.00 179.45 179.67 3k8y h SER 17 N 0.09 0.52 -0.98 0.86 0.02 -1.96 -2.15 113.55 109.95 3k8y h SER 17 Ca 0.06 -0.34 0.03 0.00 -0.84 0.00 0.00 61.79 60.69 3k8y h SER 17 Cb 0.04 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 62.39 3k8y h SER 17 CO -0.07 0.73 0.64 0.00 -1.14 0.00 0.00 176.83 177.00 3k8y h ALA 18 N 0.80 1.27 -0.10 3.77 0.00 -1.87 0.52 119.26 123.65 3k8y h ALA 18 Ca 0.08 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 3k8y h ALA 18 Cb 0.49 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 3k8y h ALA 18 CO 0.02 0.57 0.05 -0.07 0.00 0.00 0.00 179.25 179.82 3k8y h LEU 19 N 1.27 0.14 -0.56 0.00 3.38 -0.97 -0.81 115.31 117.76 3k8y h LEU 19 Ca 0.38 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 58.18 3k8y h LEU 19 Cb -0.06 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.63 3k8y h LEU 19 CO -0.10 0.22 0.17 0.74 0.09 0.00 0.00 178.44 179.55 3k8y h THR 20 N 0.04 1.24 -0.28 0.22 2.02 -0.96 -1.39 112.91 113.80 3k8y h THR 20 Ca 0.04 -0.83 -0.13 0.00 0.77 0.00 0.00 66.41 66.26 3k8y h THR 20 Cb 0.12 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 3k8y h THR 20 CO -0.00 0.31 -0.35 0.40 0.37 0.00 0.00 175.52 176.24 3k8y h ILE 21 N 0.79 1.29 -0.39 3.11 2.04 -0.88 -1.13 117.51 122.34 3k8y h ILE 21 Ca 0.18 -1.49 -0.02 0.00 1.00 0.00 0.00 64.86 64.53 3k8y h ILE 21 Cb 0.30 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 3k8y h ILE 21 CO -0.00 0.48 0.17 -0.61 0.00 0.00 0.00 178.15 178.18 3k8y h GLN 22 N 0.52 0.58 0.08 2.37 5.75 -0.89 0.25 115.11 123.78 3k8y h GLN 22 Ca 0.05 -0.10 -0.00 0.00 -0.15 0.00 0.00 58.65 58.45 3k8y h GLN 22 Cb 0.85 -0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.31 3k8y h GLN 22 CO 0.07 0.54 -0.04 1.25 -2.65 0.00 0.00 178.83 178.00 3k8y h LEU 23 N 0.49 -0.09 0.19 -2.39 5.85 -1.00 -1.22 115.31 117.14 3k8y h LEU 23 Ca 0.13 -0.02 -0.33 0.00 0.84 0.00 0.00 57.88 58.51 3k8y h LEU 23 Cb 0.17 0.02 0.02 0.00 0.37 0.00 0.00 40.66 41.24 3k8y h LEU 23 CO -0.01 -0.05 -1.55 0.40 -0.34 0.00 0.00 178.44 176.89 3k8y h ILE 24 N -0.13 1.18 -0.00 4.05 1.08 -1.13 -3.39 117.51 119.15 3k8y h ILE 24 Ca -0.01 -2.72 0.00 0.00 -0.39 0.00 0.00 64.86 61.74 3k8y h ILE 24 Cb 0.10 2.88 0.00 0.00 -3.07 0.00 0.00 36.82 36.74 3k8y h ILE 24 CO 0.02 0.84 -0.12 0.00 -0.69 0.00 0.00 178.15 178.20 3k8y n GLN 25 N -3.59 3.12 -3.17 2.37 6.02 0.87 -5.03 117.38 117.95 3k8y n GLN 25 Ca -0.18 -0.33 -0.21 0.00 -0.01 0.00 0.00 57.00 56.27 3k8y n GLN 25 Cb 1.07 -0.87 0.05 0.00 1.02 0.00 0.00 30.24 31.51 3k8y n GLN 25 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3k8y n ASN 26 N -0.53 -5.93 -3.96 1.08 3.02 -0.46 -4.97 115.26 103.51 3k8y n ASN 26 Ca 0.02 -0.35 -0.09 0.00 -0.03 0.00 0.00 54.58 54.13 3k8y n ASN 26 Cb 0.09 -4.68 -0.08 0.00 -0.61 0.00 0.00 39.78 34.50 3k8y n ASN 26 CO 0.00 0.00 0.00 -1.38 -2.62 0.00 0.00 177.26 173.26 3k8y s HIS 27 N -3.20 0.35 -0.25 3.10 -3.43 -1.26 -5.02 115.29 105.58 3k8y s HIS 27 Ca 0.38 -0.79 -0.11 0.00 -0.80 0.00 0.00 55.06 53.74 3k8y s HIS 27 Cb -0.17 -0.18 -0.05 0.00 -1.43 0.00 0.00 32.58 30.76 3k8y s HIS 27 CO 0.47 -0.54 0.18 0.12 -2.00 0.00 0.00 174.74 172.98 3k8y s PHE 28 N -3.91 3.29 -0.41 0.38 5.36 -1.26 -3.53 117.98 117.89 3k8y s PHE 28 Ca 0.10 0.21 -0.25 0.00 -0.96 0.00 0.00 56.93 56.03 3k8y s PHE 28 Cb 0.06 -2.32 0.02 0.00 -0.34 0.00 0.00 43.02 40.44 3k8y s PHE 28 CO -0.07 -0.01 0.90 0.08 -1.46 0.00 0.00 175.22 174.65 3k8y s VAL 29 N 1.30 4.56 0.08 3.12 1.01 -1.26 -4.92 120.40 124.29 3k8y s VAL 29 Ca 0.08 0.93 0.07 0.00 0.00 0.00 0.00 61.98 63.05 3k8y s VAL 29 Cb -0.14 -4.36 -0.22 0.00 0.00 0.00 0.00 36.38 31.65 3k8y s VAL 29 CO 0.07 -0.66 1.12 0.44 0.00 0.00 0.00 175.10 176.07 3k8y h ASP 30 N 8.75 0.06 -3.85 3.32 5.19 -2.01 -3.47 116.42 124.41 3k8y h ASP 30 Ca -0.24 -0.07 -0.48 0.00 -0.62 0.00 0.00 57.03 55.62 3k8y h ASP 30 Cb 1.08 -0.02 0.06 0.00 0.18 0.00 0.00 39.33 40.63 3k8y h ASP 30 CO 0.99 1.06 0.23 -1.83 -3.12 0.00 0.00 179.24 176.57 3k8y s GLU 31 N -2.68 2.86 -0.42 3.56 -1.05 -1.26 -5.05 118.70 114.66 3k8y s GLU 31 Ca -0.01 0.09 0.02 0.00 -0.15 0.00 0.00 54.97 54.92 3k8y s GLU 31 Cb 0.09 -2.21 0.11 0.00 -0.44 0.00 0.00 34.13 31.69 3k8y s GLU 31 CO 0.83 -0.81 0.16 -0.47 0.95 0.00 0.00 175.26 175.92 3k8y s TYR 32 N -3.09 3.57 -0.35 4.83 6.04 -1.26 -5.04 117.35 122.03 3k8y s TYR 32 Ca 0.55 -2.92 -0.05 0.00 0.04 0.00 0.00 57.07 54.69 3k8y s TYR 32 Cb -0.11 -2.98 0.06 0.00 -1.04 0.00 0.00 41.96 37.90 3k8y s TYR 32 CO 0.47 -0.89 0.12 -0.51 -1.54 0.00 0.00 175.55 173.19 3k8y s ASP 33 N 0.75 5.23 0.34 4.32 -0.00 -1.26 -5.09 116.67 120.96 3k8y s ASP 33 Ca 0.12 -1.42 -0.29 0.00 -0.00 0.00 0.00 52.55 50.97 3k8y s ASP 33 Cb -0.21 -1.83 -0.12 0.00 -0.00 0.00 0.00 42.92 40.76 3k8y s ASP 33 CO -0.05 -0.38 1.42 -2.65 -0.00 0.00 0.00 175.17 173.51 3k8y n PRO 34 N 4.72 2.40 -3.38 8.23 -0.02 -1.26 -4.96 135.00 140.74 3k8y n PRO 34 Ca -0.10 0.85 -0.35 0.00 -2.02 0.00 0.00 63.50 61.88 3k8y n PRO 34 Cb 0.43 -2.52 -0.06 0.00 -0.02 0.00 0.00 33.50 31.34 3k8y n PRO 34 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3k8y s THR 35 N -0.84 4.88 0.00 3.45 2.01 -1.26 -5.02 115.64 118.86 3k8y s THR 35 Ca 0.57 0.77 0.00 0.00 0.31 0.00 0.00 61.69 63.34 3k8y s THR 35 Cb -0.53 -3.72 0.00 0.00 0.01 0.00 0.00 72.50 68.26 3k8y s THR 35 CO 0.60 0.22 0.00 -0.38 -0.69 0.00 0.00 174.62 174.36 3k8y n ILE 36 N 0.73 0.00 -3.47 1.82 2.08 -1.26 -4.27 119.36 114.99 3k8y n ILE 36 Ca -0.05 0.49 0.01 0.00 0.56 0.00 0.00 62.75 63.76 3k8y n ILE 36 Cb 0.52 -1.48 -0.04 0.00 -0.75 0.00 0.00 39.64 37.89 3k8y n ILE 36 CO 0.00 0.00 0.00 -0.70 0.56 0.00 0.00 176.55 176.41 3k8y s GLU 37 N -0.98 0.37 0.15 0.38 2.12 -1.26 -2.79 118.70 116.68 3k8y s GLU 37 Ca 0.00 0.93 0.09 0.00 0.36 0.00 0.00 54.97 56.35 3k8y s GLU 37 Cb 0.00 0.56 -0.04 0.00 0.26 0.00 0.00 34.13 34.91 3k8y s GLU 37 CO 0.00 -0.13 -0.20 -0.51 -0.54 0.00 0.00 175.26 173.88 3k8y s ASP 38 N 2.57 2.75 -0.02 -1.70 1.01 -0.43 -4.99 116.67 115.86 3k8y s ASP 38 Ca -0.03 -0.80 0.07 0.00 0.71 0.00 0.00 52.55 52.49 3k8y s ASP 38 Cb -0.08 -0.17 -0.02 0.00 1.01 0.00 0.00 42.92 43.67 3k8y s ASP 38 CO -0.18 0.02 -0.22 -0.55 0.21 0.00 0.00 175.17 174.45 3k8y s SER 39 N -2.39 2.62 0.02 0.27 0.15 -1.26 -0.31 113.70 112.80 3k8y s SER 39 Ca 0.13 -0.41 0.04 0.00 0.70 0.00 0.00 55.95 56.41 3k8y s SER 39 Cb -0.08 -0.32 -0.01 0.00 -1.71 0.00 0.00 66.02 63.90 3k8y s SER 39 CO 0.06 0.27 -0.12 -0.31 1.20 0.00 0.00 173.24 174.34 3k8y s TYR 40 N -0.49 1.03 -0.02 3.44 2.02 -0.11 -4.99 117.35 118.22 3k8y s TYR 40 Ca 0.08 -0.27 0.01 0.00 -0.37 0.00 0.00 57.07 56.52 3k8y s TYR 40 Cb -0.09 -0.64 0.01 0.00 -0.40 0.00 0.00 41.96 40.85 3k8y s TYR 40 CO -0.01 -0.00 -0.04 0.50 -1.57 0.00 0.00 175.55 174.43 3k8y s ARG 41 N -0.72 0.57 -0.19 -0.62 3.52 -1.26 -0.26 118.95 119.98 3k8y s ARG 41 Ca 0.02 -0.12 -0.17 0.00 -0.13 0.00 0.00 55.73 55.33 3k8y s ARG 41 Cb -0.06 -0.59 0.05 0.00 -1.56 0.00 0.00 34.95 32.79 3k8y s ARG 41 CO 0.00 0.01 0.51 0.21 -0.81 0.00 0.00 175.30 175.22 3k8y s LYS 42 N 0.43 0.58 -0.09 5.12 2.20 -0.62 -4.99 119.74 122.36 3k8y s LYS 42 Ca -0.05 0.76 -0.24 0.00 -0.36 0.00 0.00 55.97 56.08 3k8y s LYS 42 Cb -0.09 0.24 -0.03 0.00 -1.51 0.00 0.00 37.83 36.44 3k8y s LYS 42 CO -0.00 -0.09 0.72 -1.14 -0.36 0.00 0.00 175.35 174.48 3k8y s GLN 43 N 0.51 4.41 0.22 4.03 0.74 -1.26 -0.86 119.66 127.45 3k8y s GLN 43 Ca -0.02 0.89 -0.00 0.00 0.05 0.00 0.00 55.36 56.28 3k8y s GLN 43 Cb -0.04 -3.47 -0.04 0.00 1.10 0.00 0.00 33.01 30.55 3k8y s GLN 43 CO -0.02 -0.01 0.13 0.14 -0.55 0.00 0.00 175.29 174.97 3k8y s VAL 44 N 1.05 0.14 -0.22 1.34 -7.23 -0.18 -4.99 120.40 110.32 3k8y s VAL 44 Ca 0.37 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.51 3k8y s VAL 44 Cb -0.17 -2.53 -0.00 0.00 0.56 0.00 0.00 36.38 34.23 3k8y s VAL 44 CO 0.17 0.00 -0.07 -0.69 -0.31 0.00 0.00 175.10 174.20 3k8y s VAL 45 N -4.04 3.12 -0.19 1.32 1.01 -1.26 -0.89 120.40 119.48 3k8y s VAL 45 Ca 0.39 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.78 3k8y s VAL 45 Cb 0.07 -2.42 0.03 0.00 0.00 0.00 0.00 36.38 34.07 3k8y s VAL 45 CO 0.13 0.43 -0.14 -0.63 0.00 0.00 0.00 175.10 174.89 3k8y s ILE 46 N 1.44 1.77 -1.47 2.22 1.01 -0.21 -4.72 121.20 121.23 3k8y s ILE 46 Ca 0.05 -0.94 -0.10 0.00 0.00 0.00 0.00 60.65 59.66 3k8y s ILE 46 Cb -0.14 -1.74 0.06 0.00 0.01 0.00 0.00 42.46 40.65 3k8y s ILE 46 CO -0.05 0.32 0.90 0.47 0.00 0.00 0.00 174.94 176.58 3k8y n ASP 47 N 4.67 -3.73 0.00 3.58 8.00 -1.26 -1.59 116.55 126.23 3k8y n ASP 47 Ca -0.17 -0.79 0.00 0.00 0.71 0.00 0.00 54.79 54.54 3k8y n ASP 47 Cb 0.48 -3.92 0.00 0.00 -0.02 0.00 0.00 41.12 37.66 3k8y n ASP 47 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3k8y n GLY 48 N -1.68 1.98 3.62 0.44 0.00 -1.26 -5.00 105.19 103.29 3k8y n GLY 48 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 3k8y n GLY 48 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3k8y s GLU 49 N -0.24 4.02 -0.08 1.61 2.12 -0.62 -5.05 118.70 120.46 3k8y s GLU 49 Ca 0.00 -0.14 -0.30 0.00 0.36 0.00 0.00 54.97 54.89 3k8y s GLU 49 Cb 0.00 -3.62 -0.02 0.00 0.26 0.00 0.00 34.13 30.75 3k8y s GLU 49 CO 0.00 -0.14 1.12 0.99 -0.54 0.00 0.00 175.26 176.69 3k8y s THR 50 N 1.64 4.47 0.23 -1.70 2.01 -1.26 -1.05 115.64 119.99 3k8y s THR 50 Ca 0.11 1.77 -0.10 0.00 0.31 0.00 0.00 61.69 63.78 3k8y s THR 50 Cb -0.15 -4.14 -0.01 0.00 0.01 0.00 0.00 72.50 68.21 3k8y s THR 50 CO 0.09 -0.00 0.39 0.00 -0.69 0.00 0.00 174.62 174.41 3k8y s LEU 52 N -3.05 2.97 -0.21 0.00 2.96 0.18 -1.01 118.68 120.51 3k8y s LEU 52 Ca 0.26 -0.34 -0.17 0.00 -0.22 0.00 0.00 54.13 53.66 3k8y s LEU 52 Cb 0.01 -1.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.92 3k8y s LEU 52 CO 0.10 0.02 0.48 -0.76 -1.32 0.00 0.00 176.35 174.86 3k8y s LEU 53 N 1.24 4.13 -0.32 -0.68 1.43 -0.04 -0.80 118.68 123.64 3k8y s LEU 53 Ca 0.03 0.58 -0.04 0.00 -1.03 0.00 0.00 54.13 53.67 3k8y s LEU 53 Cb -0.14 -2.63 0.04 0.00 0.03 0.00 0.00 46.19 43.49 3k8y s LEU 53 CO -0.01 -0.17 0.05 -0.62 0.23 0.00 0.00 176.35 175.83 3k8y s ASP 54 N 1.21 5.10 -0.15 2.29 2.15 -0.30 -1.59 116.67 125.38 3k8y s ASP 54 Ca 0.22 -1.17 -0.01 0.00 0.43 0.00 0.00 52.55 52.02 3k8y s ASP 54 Cb -0.15 -1.80 -0.01 0.00 -0.30 0.00 0.00 42.92 40.66 3k8y s ASP 54 CO 0.09 -0.29 -0.12 -0.63 -0.17 0.00 0.00 175.17 174.05 3k8y s ILE 55 N 1.34 3.01 -0.26 4.11 1.01 0.64 -0.47 121.20 130.57 3k8y s ILE 55 Ca -0.03 -0.66 -0.09 0.00 0.00 0.00 0.00 60.65 59.87 3k8y s ILE 55 Cb -0.19 -2.28 -0.04 0.00 0.01 0.00 0.00 42.46 39.95 3k8y s ILE 55 CO 0.01 0.50 0.13 -0.22 0.00 0.00 0.00 174.94 175.37 3k8y s LEU 56 N 0.68 3.77 -0.40 2.97 2.96 0.12 -0.93 118.68 127.85 3k8y s LEU 56 Ca -0.06 -0.08 -0.16 0.00 -0.22 0.00 0.00 54.13 53.61 3k8y s LEU 56 Cb -0.15 -2.03 0.01 0.00 0.50 0.00 0.00 46.19 44.52 3k8y s LEU 56 CO 0.02 -0.03 0.35 -0.62 -1.32 0.00 0.00 176.35 174.75 3k8y s ASP 57 N 1.61 6.14 0.46 3.68 2.15 0.58 -0.86 116.67 130.43 3k8y s ASP 57 Ca 0.07 -0.70 0.08 0.00 0.43 0.00 0.00 52.55 52.43 3k8y s ASP 57 Cb -0.15 -2.19 0.03 0.00 -0.30 0.00 0.00 42.92 40.31 3k8y s ASP 57 CO 0.07 -0.47 0.61 0.42 -0.17 0.00 0.00 175.17 175.64 3k8y s THR 58 N 1.89 2.78 -0.02 1.71 -4.23 -1.13 -1.32 115.64 115.33 3k8y s THR 58 Ca 0.08 -1.02 -0.25 0.00 -1.18 0.00 0.00 61.69 59.33 3k8y s THR 58 Cb -0.18 -2.80 -0.04 0.00 1.34 0.00 0.00 72.50 70.82 3k8y s THR 58 CO 0.12 0.00 0.78 0.00 -0.54 0.00 0.00 174.62 174.98 3k8y s ALA 59 N -2.43 3.31 -0.22 3.99 0.00 -1.12 -4.82 121.76 120.46 3k8y s ALA 59 Ca 0.56 0.27 0.22 0.00 0.00 0.00 0.00 51.96 53.01 3k8y s ALA 59 Cb -0.09 -3.05 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 3k8y s ALA 59 CO 0.34 -0.08 1.01 0.41 0.00 0.00 0.00 175.76 177.44 3k8y n GLY 60 N 2.83 -1.43 3.70 0.00 0.00 -1.26 -4.85 105.19 104.19 3k8y n GLY 60 Ca 0.00 -0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.37 3k8y n GLY 60 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3k8y s GLN 61 N -3.32 4.24 0.63 1.61 -1.52 -1.26 -2.61 119.66 117.42 3k8y s GLN 61 Ca -0.01 2.22 0.36 0.00 -1.95 0.00 0.00 55.36 55.97 3k8y s GLN 61 Cb 0.10 -3.46 2.05 0.00 -0.22 0.00 0.00 33.01 31.47 3k8y s GLN 61 CO 0.80 -0.63 2.27 0.93 -0.25 0.00 0.00 175.29 178.41 3k8y h GLU 62 N 7.72 0.00 -0.73 2.91 5.08 -1.99 -1.29 114.58 126.28 3k8y h GLU 62 Ca -0.41 0.00 0.21 0.00 -1.00 0.00 0.00 59.36 58.16 3k8y h GLU 62 Cb 1.20 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.42 3k8y h GLU 62 CO 0.91 0.00 0.55 0.93 -1.00 0.00 0.00 179.01 180.40 3k8y h GLU 63 N 0.00 0.00 -0.44 2.33 3.07 -1.98 -1.89 114.58 115.67 3k8y h GLU 63 Ca 0.01 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.78 3k8y h GLU 63 Cb 0.08 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 27.94 3k8y h GLU 63 CO -0.00 0.00 0.06 0.66 -1.40 0.00 0.00 179.01 178.33 3k8y n TYR 64 N -4.21 1.51 0.31 4.33 4.01 -0.49 -4.64 117.16 117.98 3k8y n TYR 64 Ca 0.15 -1.06 0.20 0.00 -0.16 0.00 0.00 57.90 57.03 3k8y n TYR 64 Cb 0.82 -0.47 0.98 0.00 -0.31 0.00 0.00 39.34 40.36 3k8y n TYR 64 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3k8y h SER 65 N 2.17 0.00 0.68 7.72 4.64 -1.50 -2.07 113.55 125.20 3k8y h SER 65 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3k8y h SER 65 Cb 1.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.87 3k8y h SER 65 CO 0.42 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.38 3k8y h ALA 66 N 2.00 1.00 0.00 5.18 0.00 -1.84 -2.59 119.26 123.00 3k8y h ALA 66 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k8y h ALA 66 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3k8y h ALA 66 CO 0.00 0.00 -0.03 -1.33 0.00 0.00 0.00 179.25 177.89 3k8y n MET 67 N -2.84 0.05 -0.18 0.00 2.00 -0.78 -4.13 117.12 111.25 3k8y n MET 67 Ca 0.00 0.04 -0.10 0.00 0.00 0.00 0.00 57.70 57.65 3k8y n MET 67 Cb 0.22 -1.56 0.01 0.00 0.00 0.00 0.00 33.22 31.89 3k8y n MET 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3k8y h ARG 68 N 0.00 0.89 -0.63 0.03 3.08 -1.64 -3.09 114.38 113.02 3k8y h ARG 68 Ca 0.00 -0.27 0.09 0.00 0.07 0.00 0.00 59.98 59.87 3k8y h ARG 68 Cb 0.55 -0.09 -0.07 0.00 0.08 0.00 0.00 29.97 30.44 3k8y h ARG 68 CO 0.00 0.90 0.25 -0.44 -1.07 0.00 0.00 179.97 179.61 3k8y h ASP 69 N 0.75 0.26 -0.10 7.04 3.45 -1.80 -0.25 116.42 125.79 3k8y h ASP 69 Ca 0.15 0.08 -0.00 0.00 0.43 0.00 0.00 57.03 57.68 3k8y h ASP 69 Cb 0.49 0.05 -0.00 0.00 -0.56 0.00 0.00 39.33 39.30 3k8y h ASP 69 CO 0.02 0.15 0.04 -0.61 -1.57 0.00 0.00 179.24 177.28 3k8y h GLN 70 N 0.44 0.14 0.00 3.56 5.75 -1.81 -1.96 115.11 121.23 3k8y h GLN 70 Ca 0.32 -0.02 -0.09 0.00 -0.15 0.00 0.00 58.65 58.70 3k8y h GLN 70 Cb 0.38 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.90 3k8y h GLN 70 CO -0.30 0.24 -0.45 0.10 -2.65 0.00 0.00 178.83 175.77 3k8y h TYR 71 N 0.01 0.00 -0.01 3.99 -0.00 -1.44 -2.78 116.97 116.75 3k8y h TYR 71 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 58.73 58.63 3k8y h TYR 71 Cb 0.15 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 36.86 3k8y h TYR 71 CO -0.02 0.45 -0.63 0.52 -0.00 0.00 0.00 178.16 178.48 3k8y h MET 72 N 0.00 0.04 -0.56 0.10 2.86 -0.96 -2.18 114.93 114.22 3k8y h MET 72 Ca -0.00 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.57 3k8y h MET 72 Cb 1.03 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.67 3k8y h MET 72 CO 0.06 0.66 0.19 0.00 1.06 0.00 0.00 176.91 178.88 3k8y h ARG 73 N 0.03 0.87 0.04 1.72 3.08 -1.08 -3.32 114.38 115.72 3k8y h ARG 73 Ca -0.01 -0.18 -0.26 0.00 0.07 0.00 0.00 59.98 59.60 3k8y h ARG 73 Cb 1.12 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 31.01 3k8y h ARG 73 CO 0.08 0.77 -1.36 1.15 -1.07 0.00 0.00 179.97 179.55 3k8y h THR 74 N 0.78 1.31 -4.00 2.04 2.02 -1.45 -3.48 112.91 110.14 3k8y h THR 74 Ca 0.18 -3.03 -0.52 0.00 0.77 0.00 0.00 66.41 63.82 3k8y h THR 74 Cb 0.25 2.72 0.08 0.00 -1.74 0.00 0.00 68.15 69.46 3k8y h THR 74 CO -0.01 0.80 0.52 -0.83 0.37 0.00 0.00 175.52 176.37 3k8y s GLY 75 N -4.89 2.82 -0.12 2.16 0.00 -0.83 -4.96 107.32 101.50 3k8y s GLY 75 Ca -0.04 1.04 0.18 0.00 0.00 0.00 0.00 44.72 45.90 3k8y s GLY 75 CO 0.83 1.53 0.31 1.18 0.00 0.00 0.00 173.10 176.95 3k8y n GLU 76 N -0.49 0.67 -3.77 2.90 1.02 0.19 -4.99 120.64 116.17 3k8y n GLU 76 Ca 0.07 0.02 -0.12 0.00 -0.02 0.00 0.00 57.16 57.11 3k8y n GLU 76 Cb 0.47 -1.59 -0.08 0.00 -0.02 0.00 0.00 31.44 30.22 3k8y n GLU 76 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3k8y s GLY 77 N -5.19 -0.12 -0.08 0.62 0.00 -0.98 -4.34 107.32 97.23 3k8y s GLY 77 Ca -0.08 0.13 0.02 0.00 0.00 0.00 0.00 44.72 44.80 3k8y s GLY 77 CO 0.84 -0.07 -0.15 -1.36 0.00 0.00 0.00 173.10 172.36 3k8y s PHE 78 N -1.89 1.80 -0.43 1.90 0.40 -0.57 -1.20 117.98 118.00 3k8y s PHE 78 Ca -0.10 -0.73 -0.19 0.00 -0.60 0.00 0.00 56.93 55.31 3k8y s PHE 78 Cb -0.03 -1.28 0.02 0.00 0.51 0.00 0.00 43.02 42.24 3k8y s PHE 78 CO 0.01 -0.36 0.53 -1.17 0.70 0.00 0.00 175.22 174.93 3k8y s LEU 79 N 0.69 4.70 -0.48 -0.37 2.96 0.04 -1.72 118.68 124.50 3k8y s LEU 79 Ca -0.13 -0.52 -0.17 0.00 -0.22 0.00 0.00 54.13 53.09 3k8y s LEU 79 Cb -0.16 -2.54 0.07 0.00 0.50 0.00 0.00 46.19 44.06 3k8y s LEU 79 CO 0.03 -0.67 0.48 0.00 -1.32 0.00 0.00 176.35 174.87 3k8y s VAL 81 N 2.00 4.70 0.34 0.00 1.01 0.04 -0.82 120.40 127.67 3k8y s VAL 81 Ca 0.08 -0.07 0.04 0.00 0.00 0.00 0.00 61.98 62.02 3k8y s VAL 81 Cb -0.22 -3.08 -0.06 0.00 0.00 0.00 0.00 36.38 33.02 3k8y s VAL 81 CO 0.09 0.50 0.07 0.72 0.00 0.00 0.00 175.10 176.48 3k8y s PHE 82 N 0.01 1.94 -0.11 5.22 -0.71 -0.30 -4.11 117.98 119.93 3k8y s PHE 82 Ca 0.05 -1.00 -0.02 0.00 -1.04 0.00 0.00 56.93 54.92 3k8y s PHE 82 Cb -0.12 -1.28 -0.03 0.00 -1.21 0.00 0.00 43.02 40.38 3k8y s PHE 82 CO 0.01 -0.03 -0.02 0.00 -1.34 0.00 0.00 175.22 173.84 3k8y s ALA 83 N -3.28 3.15 -0.67 1.99 0.00 -1.26 -0.46 121.76 121.24 3k8y s ALA 83 Ca 0.34 -0.82 0.18 0.00 0.00 0.00 0.00 51.96 51.65 3k8y s ALA 83 Cb 0.08 -1.47 0.79 0.00 0.00 0.00 0.00 23.12 22.52 3k8y s ALA 83 CO 0.15 0.47 1.55 0.44 0.00 0.00 0.00 175.76 178.37 3k8y n ILE 84 N 2.60 1.04 -1.07 0.00 -6.64 -0.35 -1.45 119.36 113.47 3k8y n ILE 84 Ca -0.18 0.33 -0.00 0.00 -1.77 0.00 0.00 62.75 61.13 3k8y n ILE 84 Cb 0.53 -1.22 0.29 0.00 -1.44 0.00 0.00 39.64 37.80 3k8y n ILE 84 CO 0.00 0.00 0.00 -0.46 -1.77 0.00 0.00 176.55 174.32 3k8y n ASN 85 N -1.92 4.35 -3.38 7.28 6.94 -1.26 -1.05 115.26 126.22 3k8y n ASN 85 Ca 0.02 -3.21 -0.22 0.00 -0.02 0.00 0.00 54.58 51.14 3k8y n ASN 85 Cb 0.16 -0.67 -0.09 0.00 -2.36 0.00 0.00 39.78 36.82 3k8y n ASN 85 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 3k8y s ASN 86 N -1.48 1.78 0.27 0.53 3.84 -0.53 -4.82 114.94 114.53 3k8y s ASN 86 Ca 0.50 -1.99 -0.04 0.00 0.21 0.00 0.00 52.86 51.54 3k8y s ASN 86 Cb 0.41 0.14 0.33 0.00 -0.55 0.00 0.00 41.25 41.58 3k8y s ASN 86 CO 0.11 -0.26 1.94 0.74 -2.79 0.00 0.00 177.10 176.84 3k8y h THR 87 N 4.97 1.23 -0.98 -5.21 2.02 -1.87 -1.61 112.91 111.47 3k8y h THR 87 Ca 0.08 -0.44 0.04 0.00 0.77 0.00 0.00 66.41 66.86 3k8y h THR 87 Cb 1.01 -0.15 -0.06 0.00 -1.74 0.00 0.00 68.15 67.21 3k8y h THR 87 CO 0.23 0.23 0.64 0.50 0.37 0.00 0.00 175.52 177.50 3k8y h LYS 88 N 1.27 1.19 -0.23 6.66 1.63 -1.95 -1.50 116.57 123.65 3k8y h LYS 88 Ca 0.35 -0.07 -0.06 0.00 -0.85 0.00 0.00 60.65 60.02 3k8y h LYS 88 Cb -0.13 -0.27 -0.01 0.00 -0.60 0.00 0.00 32.23 31.22 3k8y h LYS 88 CO -0.08 0.79 -0.11 0.66 -3.45 0.00 0.00 179.45 177.26 3k8y h SER 89 N 1.23 0.35 -0.26 4.20 4.64 -1.63 0.26 113.55 122.35 3k8y h SER 89 Ca 0.39 -0.08 -0.06 0.00 -0.47 0.00 0.00 61.79 61.57 3k8y h SER 89 Cb 0.02 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 3k8y h SER 89 CO -0.13 0.50 -0.07 0.15 -0.87 0.00 0.00 176.83 176.42 3k8y h PHE 90 N 0.35 0.57 -0.13 4.77 3.57 -1.15 -2.89 116.94 122.02 3k8y h PHE 90 Ca 0.07 -0.13 -0.02 0.00 3.53 0.00 0.00 57.97 61.42 3k8y h PHE 90 Cb 0.42 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 3k8y h PHE 90 CO 0.01 0.73 -0.02 0.93 -2.23 0.00 0.00 178.31 177.73 3k8y h GLU 91 N 0.25 0.19 0.00 1.11 5.08 -0.78 -2.41 114.58 118.01 3k8y h GLU 91 Ca 0.06 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3k8y h GLU 91 Cb 0.55 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.77 3k8y h GLU 91 CO 0.03 0.22 0.00 -0.44 -1.00 0.00 0.00 179.01 177.82 3k8y h ASP 92 N 0.19 0.00 -0.97 1.42 3.32 -0.75 -3.23 116.42 116.40 3k8y h ASP 92 Ca 0.04 0.00 0.08 0.00 0.02 0.00 0.00 57.03 57.17 3k8y h ASP 92 Cb 0.16 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.64 3k8y h ASP 92 CO 0.00 0.00 0.63 0.40 -1.72 0.00 0.00 179.24 178.55 3k8y h ILE 93 N 0.00 1.04 -0.94 0.35 1.08 -1.34 -2.52 117.51 115.18 3k8y h ILE 93 Ca 0.00 -0.37 0.02 0.00 -0.39 0.00 0.00 64.86 64.11 3k8y h ILE 93 Cb 0.44 -0.14 -0.05 0.00 -3.07 0.00 0.00 36.82 34.00 3k8y h ILE 93 CO 0.00 0.20 0.62 -0.74 -0.69 0.00 0.00 178.15 177.54 3k8y h HIS 94 N 1.09 1.17 -0.13 1.37 2.76 -1.76 -0.06 115.15 119.59 3k8y h HIS 94 Ca 0.43 0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.55 3k8y h HIS 94 Cb 0.25 -0.39 -0.01 0.00 1.55 0.00 0.00 27.41 28.80 3k8y h HIS 94 CO -0.00 0.72 -0.26 1.96 -1.30 0.00 0.00 177.93 179.05 3k8y h GLN 95 N 1.25 0.22 -0.14 5.26 1.08 -1.69 0.19 115.11 121.28 3k8y h GLN 95 Ca 0.35 -0.07 -0.04 0.00 -1.45 0.00 0.00 58.65 57.44 3k8y h GLN 95 Cb -0.10 -0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.31 3k8y h GLN 95 CO -0.09 0.48 -0.08 1.88 -0.95 0.00 0.00 178.83 180.07 3k8y h TYR 96 N 0.20 0.35 -0.68 2.96 -1.99 -1.21 -2.66 116.97 113.94 3k8y h TYR 96 Ca 0.03 -0.09 -0.01 0.00 2.00 0.00 0.00 58.73 60.66 3k8y h TYR 96 Cb 0.57 -0.08 -0.03 0.00 2.00 0.00 0.00 36.73 39.19 3k8y h TYR 96 CO 0.01 0.65 0.37 -0.09 -0.00 0.00 0.00 178.16 179.09 3k8y h ARG 97 N -0.05 0.95 -0.60 4.88 1.12 -0.73 -1.26 114.38 118.70 3k8y h ARG 97 Ca 0.03 -0.11 -0.07 0.00 -1.11 0.00 0.00 59.98 58.71 3k8y h ARG 97 Cb 0.56 -0.19 -0.03 0.00 -0.01 0.00 0.00 29.97 30.31 3k8y h ARG 97 CO 0.02 0.72 0.09 0.93 -3.11 0.00 0.00 179.97 178.63 3k8y h GLU 98 N 0.94 0.96 -0.18 0.20 4.39 -0.67 0.42 114.58 120.64 3k8y h GLU 98 Ca 0.24 -0.24 -0.11 0.00 0.34 0.00 0.00 59.36 59.59 3k8y h GLU 98 Cb 0.05 -0.12 -0.00 0.00 -0.10 0.00 0.00 28.75 28.57 3k8y h GLU 98 CO -0.04 0.89 -0.30 0.37 -1.16 0.00 0.00 179.01 178.77 3k8y h GLN 99 N 0.91 0.52 -0.56 2.33 4.15 -1.29 -1.66 115.11 119.50 3k8y h GLN 99 Ca 0.18 -0.32 0.09 0.00 0.77 0.00 0.00 58.65 59.38 3k8y h GLN 99 Cb 0.40 0.04 -0.07 0.00 0.21 0.00 0.00 27.48 28.05 3k8y h GLN 99 CO 0.01 0.92 0.15 0.82 -1.93 0.00 0.00 178.83 178.80 3k8y h ILE 100 N 0.16 0.72 -0.67 2.39 2.04 -0.96 0.10 117.51 121.29 3k8y h ILE 100 Ca 0.01 -0.10 0.02 0.00 1.00 0.00 0.00 64.86 65.79 3k8y h ILE 100 Cb 0.89 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 37.33 3k8y h ILE 100 CO 0.07 0.05 0.43 0.50 0.00 0.00 0.00 178.15 179.20 3k8y h LYS 101 N 0.30 0.83 -0.10 2.37 3.64 -0.79 0.29 116.57 123.12 3k8y h LYS 101 Ca 0.28 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.60 3k8y h LYS 101 Cb 0.38 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.01 3k8y h LYS 101 CO -0.34 0.55 0.00 0.00 -2.27 0.00 0.00 179.45 177.40 3k8y h ARG 102 N 0.86 0.17 -0.45 1.90 3.08 -0.62 0.76 114.38 120.07 3k8y h ARG 102 Ca 0.26 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.21 3k8y h ARG 102 Cb -0.04 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 3k8y h ARG 102 CO -0.08 0.41 0.11 0.28 -1.07 0.00 0.00 179.97 179.62 3k8y h VAL 103 N -0.10 1.23 0.00 2.04 2.07 -0.66 -2.58 116.25 118.25 3k8y h VAL 103 Ca 0.03 -0.81 0.00 0.00 0.82 0.00 0.00 66.70 66.74 3k8y h VAL 103 Cb 0.33 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 3k8y h VAL 103 CO 0.00 0.29 0.00 0.29 0.02 0.00 0.00 177.57 178.17 3k8y n LYS 104 N -4.51 0.19 -3.94 1.57 4.76 0.08 -4.93 118.16 111.38 3k8y n LYS 104 Ca 0.00 0.21 -0.26 0.00 -2.87 0.00 0.00 58.31 55.39 3k8y n LYS 104 Cb 0.21 -1.74 -0.01 0.00 -1.84 0.00 0.00 35.03 31.65 3k8y n LYS 104 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3k8y n ASP 105 N -2.08 -1.00 -3.70 4.39 2.03 0.21 -4.96 116.55 111.44 3k8y n ASP 105 Ca 0.05 -0.97 -0.14 0.00 0.52 0.00 0.00 54.79 54.26 3k8y n ASP 105 Cb 0.37 -3.21 -0.09 0.00 -0.72 0.00 0.00 41.12 37.47 3k8y n ASP 105 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 3k8y s SER 106 N -4.20 -0.51 0.00 1.67 0.15 -0.88 -5.00 113.70 104.93 3k8y s SER 106 Ca 0.12 0.94 0.21 0.00 0.70 0.00 0.00 55.95 57.91 3k8y s SER 106 Cb -0.06 0.96 0.62 0.00 -1.71 0.00 0.00 66.02 65.83 3k8y s SER 106 CO 0.88 -0.22 1.48 0.47 1.20 0.00 0.00 173.24 177.05 3k8y n ASP 107 N 2.61 2.18 -2.50 5.45 8.00 -1.26 -4.42 116.55 126.60 3k8y n ASP 107 Ca -0.14 -1.81 -0.18 0.00 0.71 0.00 0.00 54.79 53.36 3k8y n ASP 107 Cb 0.56 -0.16 0.02 0.00 -0.02 0.00 0.00 41.12 41.52 3k8y n ASP 107 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3k8y n ASP 108 N 0.66 3.44 -4.74 -2.24 8.00 -1.26 -5.01 116.55 115.41 3k8y n ASP 108 Ca 0.17 -3.24 -0.40 0.00 0.71 0.00 0.00 54.79 52.02 3k8y n ASP 108 Cb 0.40 -0.46 -0.05 0.00 -0.02 0.00 0.00 41.12 40.99 3k8y n ASP 108 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3k8y s VAL 109 N -4.49 4.61 0.08 2.53 1.01 -1.26 -4.99 120.40 117.88 3k8y s VAL 109 Ca 0.40 1.84 -0.31 0.00 0.00 0.00 0.00 61.98 63.92 3k8y s VAL 109 Cb 0.41 -4.22 -0.09 0.00 0.00 0.00 0.00 36.38 32.49 3k8y s VAL 109 CO -0.07 0.35 1.79 -2.84 0.00 0.00 0.00 175.10 174.33 3k8y s PRO 110 N -0.05 4.16 0.06 2.72 0.02 -1.26 -4.96 135.00 135.69 3k8y s PRO 110 Ca 0.42 2.49 -0.15 0.00 0.02 0.00 0.00 61.00 63.78 3k8y s PRO 110 Cb -0.22 -3.74 0.03 0.00 0.02 0.00 0.00 34.50 30.59 3k8y s PRO 110 CO 0.26 -0.83 0.34 -1.64 -0.33 0.00 0.00 177.00 174.80 3k8y s MET 111 N 3.15 0.89 -0.03 5.54 -1.94 -1.26 -1.50 119.30 124.14 3k8y s MET 111 Ca 0.80 -0.53 0.02 0.00 -1.71 0.00 0.00 55.69 54.26 3k8y s MET 111 Cb -0.42 0.39 0.01 0.00 2.01 0.00 0.00 34.83 36.81 3k8y s MET 111 CO 0.36 -0.30 -0.06 0.08 -0.01 0.00 0.00 175.02 175.09 3k8y s VAL 112 N -2.84 0.56 -0.13 -6.03 1.01 -0.70 -4.46 120.40 107.81 3k8y s VAL 112 Ca -0.03 -0.21 -0.22 0.00 0.00 0.00 0.00 61.98 61.53 3k8y s VAL 112 Cb 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 3k8y s VAL 112 CO -0.05 0.20 0.64 -0.22 0.00 0.00 0.00 175.10 175.67 3k8y s LEU 113 N 0.42 4.23 -0.15 3.92 2.96 -0.53 -1.12 118.68 128.42 3k8y s LEU 113 Ca -0.06 0.98 0.02 0.00 -0.22 0.00 0.00 54.13 54.85 3k8y s LEU 113 Cb -0.09 -2.95 0.01 0.00 0.50 0.00 0.00 46.19 43.66 3k8y s LEU 113 CO 0.00 -0.17 -0.20 -0.69 -1.32 0.00 0.00 176.35 173.97 3k8y s VAL 114 N 1.28 1.96 -0.48 1.68 1.01 -0.00 -1.21 120.40 124.63 3k8y s VAL 114 Ca 0.32 -0.90 -0.15 0.00 0.00 0.00 0.00 61.98 61.25 3k8y s VAL 114 Cb -0.16 -1.75 0.09 0.00 0.00 0.00 0.00 36.38 34.55 3k8y s VAL 114 CO 0.13 0.53 0.40 -0.83 0.00 0.00 0.00 175.10 175.33 3k8y s GLY 115 N 1.03 2.05 0.53 4.51 0.00 -0.39 -1.14 107.32 113.90 3k8y s GLY 115 Ca -0.02 -2.21 0.01 0.00 0.00 0.00 0.00 44.72 42.50 3k8y s GLY 115 CO -0.06 1.08 0.75 0.21 0.00 0.00 0.00 173.10 175.08 3k8y s ASN 116 N 2.75 5.38 -0.83 1.64 2.47 0.39 -1.14 114.94 125.60 3k8y s ASN 116 Ca 0.04 0.03 -0.02 0.00 0.42 0.00 0.00 52.86 53.34 3k8y s ASN 116 Cb -0.25 -0.99 0.00 0.00 -1.45 0.00 0.00 41.25 38.56 3k8y s ASN 116 CO 0.05 -1.06 0.20 0.29 -3.72 0.00 0.00 177.10 172.87 3k8y n LYS 117 N -2.29 -1.92 0.00 0.43 5.02 -0.75 -1.21 118.16 117.44 3k8y n LYS 117 Ca 0.07 0.48 0.07 0.00 -2.02 0.00 0.00 58.31 56.90 3k8y n LYS 117 Cb 0.59 -4.47 0.34 0.00 -0.02 0.00 0.00 35.03 31.47 3k8y n LYS 117 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k8y h ASP 119 N 0.00 0.00 -3.45 0.00 2.03 -1.91 -3.46 116.42 109.63 3k8y h ASP 119 Ca 0.00 0.00 -0.54 0.00 -0.73 0.00 0.00 57.03 55.76 3k8y h ASP 119 Cb 0.14 0.00 -0.03 0.00 -0.83 0.00 0.00 39.33 38.61 3k8y h ASP 119 CO 0.00 0.00 -0.03 -0.76 -1.03 0.00 0.00 179.24 177.42 3k8y s LEU 120 N -5.23 4.26 0.00 0.15 1.43 -0.44 -5.00 118.68 113.86 3k8y s LEU 120 Ca 0.07 1.14 0.23 0.00 -1.03 0.00 0.00 54.13 54.54 3k8y s LEU 120 Cb 0.09 -3.53 0.12 0.00 0.03 0.00 0.00 46.19 42.90 3k8y s LEU 120 CO 0.57 0.01 1.14 0.00 0.23 0.00 0.00 176.35 178.30 3k8y n ALA 121 N 0.43 4.05 -1.15 4.21 0.00 -1.26 -4.47 120.51 122.33 3k8y n ALA 121 Ca -0.02 -0.52 -0.19 0.00 0.00 0.00 0.00 53.44 52.71 3k8y n ALA 121 Cb 0.52 -0.91 -0.13 0.00 0.00 0.00 0.00 19.45 18.93 3k8y n ALA 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k8y n ALA 122 N -1.17 6.60 -2.26 0.00 0.00 -1.26 -4.93 120.51 117.49 3k8y n ALA 122 Ca 0.06 -2.34 -0.42 0.00 0.00 0.00 0.00 53.44 50.74 3k8y n ALA 122 Cb 0.36 -2.48 -0.03 0.00 0.00 0.00 0.00 19.45 17.30 3k8y n ALA 122 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3k8y s ARG 123 N 0.76 4.33 0.00 0.00 3.52 -1.26 -4.29 118.95 122.01 3k8y s ARG 123 Ca 0.66 1.95 0.00 0.00 -0.13 0.00 0.00 55.73 58.21 3k8y s ARG 123 Cb 0.30 -3.41 -0.00 0.00 -1.56 0.00 0.00 34.95 30.27 3k8y s ARG 123 CO -0.04 -0.45 0.02 0.25 -0.81 0.00 0.00 175.30 174.27 3k8y n THR 124 N 4.26 0.00 -3.78 4.11 -2.24 -0.22 -4.94 114.28 111.47 3k8y n THR 124 Ca 0.12 -0.49 -0.37 0.00 -2.27 0.00 0.00 64.05 61.03 3k8y n THR 124 Cb 0.44 1.00 -0.13 0.00 -2.10 0.00 0.00 70.33 69.54 3k8y n THR 124 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3k8y s VAL 125 N -1.04 3.69 0.43 2.28 1.01 -0.80 -4.90 120.40 121.09 3k8y s VAL 125 Ca 0.00 -1.08 -0.21 0.00 0.00 0.00 0.00 61.98 60.68 3k8y s VAL 125 Cb 0.00 -3.06 -0.10 0.00 0.00 0.00 0.00 36.38 33.23 3k8y s VAL 125 CO 0.02 -0.12 0.98 -1.61 0.00 0.00 0.00 175.10 174.38 3k8y s GLU 126 N 1.40 4.13 0.23 2.72 0.41 -1.26 -4.92 118.70 121.40 3k8y s GLU 126 Ca -0.01 1.24 -0.09 0.00 -0.41 0.00 0.00 54.97 55.70 3k8y s GLU 126 Cb -0.19 -2.24 0.35 0.00 -1.78 0.00 0.00 34.13 30.27 3k8y s GLU 126 CO 0.02 -0.13 1.65 1.03 -0.49 0.00 0.00 175.26 177.35 3k8y h SER 127 N 1.97 -0.28 -0.27 -0.19 0.87 -2.00 -1.43 113.55 112.22 3k8y h SER 127 Ca -0.49 0.17 -0.03 0.00 -1.23 0.00 0.00 61.79 60.21 3k8y h SER 127 Cb 1.20 0.29 -0.02 0.00 -0.44 0.00 0.00 62.40 63.43 3k8y h SER 127 CO 0.61 -0.13 0.08 -0.09 -0.53 0.00 0.00 176.83 176.77 3k8y h ARG 128 N 0.12 0.50 -0.78 2.24 9.65 -1.99 0.37 114.38 124.49 3k8y h ARG 128 Ca 0.36 -0.08 0.00 0.00 -1.10 0.00 0.00 59.98 59.17 3k8y h ARG 128 Cb 0.60 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 29.06 3k8y h ARG 128 CO -0.58 0.47 0.50 1.96 2.80 0.00 0.00 179.97 185.12 3k8y h GLN 129 N 0.49 1.03 -0.07 0.20 4.20 -1.64 -1.44 115.11 117.87 3k8y h GLN 129 Ca 0.12 -0.07 -0.23 0.00 0.06 0.00 0.00 58.65 58.53 3k8y h GLN 129 Cb 0.20 -0.23 0.01 0.00 0.30 0.00 0.00 27.48 27.76 3k8y h GLN 129 CO -0.00 0.70 -0.86 0.00 -0.67 0.00 0.00 178.83 178.00 3k8y h ALA 130 N 1.27 0.34 -0.80 3.87 0.00 -1.21 -2.62 119.26 120.12 3k8y h ALA 130 Ca 0.28 -0.64 0.10 0.00 0.00 0.00 0.00 54.91 54.65 3k8y h ALA 130 Cb -0.10 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 3k8y h ALA 130 CO -0.06 0.73 0.44 1.96 0.00 0.00 0.00 179.25 182.32 3k8y h GLN 131 N 0.39 0.72 -0.57 0.00 4.20 -0.77 -0.83 115.11 118.25 3k8y h GLN 131 Ca -0.07 -0.04 -0.09 0.00 0.06 0.00 0.00 58.65 58.50 3k8y h GLN 131 Cb 1.48 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 29.08 3k8y h GLN 131 CO 0.16 0.48 -0.01 -0.44 -0.67 0.00 0.00 178.83 178.35 3k8y h ASP 132 N 0.74 1.00 -0.07 1.46 3.32 -1.18 0.19 116.42 121.88 3k8y h ASP 132 Ca 0.39 -0.31 -0.00 0.00 0.02 0.00 0.00 57.03 57.12 3k8y h ASP 132 Cb 0.38 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 3k8y h ASP 132 CO -0.26 1.07 0.03 0.25 -1.72 0.00 0.00 179.24 178.62 3k8y h LEU 133 N 0.91 0.10 -0.75 1.55 5.85 -1.06 -2.25 115.31 119.66 3k8y h LEU 133 Ca 0.16 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.77 3k8y h LEU 133 Cb 0.56 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.52 3k8y h LEU 133 CO 0.03 0.22 0.47 0.00 -0.34 0.00 0.00 178.44 178.82 3k8y h ALA 134 N 0.89 0.98 -0.92 1.25 0.00 -1.02 -1.95 119.26 118.48 3k8y h ALA 134 Ca 0.03 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.97 3k8y h ALA 134 Cb 0.15 -0.24 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 3k8y h ALA 134 CO -0.00 0.26 0.59 -0.09 0.00 0.00 0.00 179.25 180.01 3k8y h ARG 135 N 0.92 1.06 0.00 0.00 2.43 -0.80 -0.93 114.38 117.05 3k8y h ARG 135 Ca 0.30 -0.06 -0.04 0.00 -0.81 0.00 0.00 59.98 59.37 3k8y h ARG 135 Cb 0.02 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.33 3k8y h ARG 135 CO -0.11 0.70 -0.19 0.66 -1.51 0.00 0.00 179.97 179.52 3k8y h SER 136 N 1.09 0.00 0.56 -3.80 4.64 -0.75 -1.64 113.55 113.65 3k8y h SER 136 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 3k8y h SER 136 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3k8y h SER 136 CO -0.16 0.19 -0.41 -1.22 -0.87 0.00 0.00 176.83 174.36 3k8y n TYR 137 N -4.26 0.00 -2.43 4.77 4.01 -0.62 -4.96 117.16 113.66 3k8y n TYR 137 Ca -0.02 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.65 3k8y n TYR 137 Cb 0.26 -0.28 0.01 0.00 -0.31 0.00 0.00 39.34 39.01 3k8y n TYR 137 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3k8y n GLY 138 N 1.49 0.26 3.23 2.72 0.00 -0.45 -4.99 105.19 107.45 3k8y n GLY 138 Ca 0.06 -0.52 -0.13 0.00 0.00 0.00 0.00 46.02 45.43 3k8y n GLY 138 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3k8y s ILE 139 N -2.65 0.89 0.55 -0.61 -4.36 -0.63 -5.02 121.20 109.35 3k8y s ILE 139 Ca 0.08 -2.00 -0.17 0.00 -0.26 0.00 0.00 60.65 58.30 3k8y s ILE 139 Cb -0.03 -1.92 -0.06 0.00 1.25 0.00 0.00 42.46 41.69 3k8y s ILE 139 CO 0.10 -0.67 1.02 -2.84 0.24 0.00 0.00 174.94 172.79 3k8y s PRO 140 N -3.83 3.63 -0.11 0.37 0.02 -1.26 -4.05 135.00 129.77 3k8y s PRO 140 Ca 0.18 1.12 0.00 0.00 0.02 0.00 0.00 61.00 62.33 3k8y s PRO 140 Cb 0.05 -2.08 -0.02 0.00 0.02 0.00 0.00 34.50 32.46 3k8y s PRO 140 CO 0.01 -0.54 -0.11 -0.47 -0.33 0.00 0.00 177.00 175.55 3k8y s TYR 141 N -2.47 2.84 -0.01 6.54 5.04 -1.26 -1.45 117.35 126.58 3k8y s TYR 141 Ca 0.62 -0.41 0.01 0.00 -2.44 0.00 0.00 57.07 54.85 3k8y s TYR 141 Cb -0.13 -1.80 0.00 0.00 0.35 0.00 0.00 41.96 40.38 3k8y s TYR 141 CO 0.32 -0.04 -0.04 0.42 -1.34 0.00 0.00 175.55 174.87 3k8y s ILE 142 N -0.01 0.36 0.01 3.14 1.01 -0.35 -5.00 121.20 120.36 3k8y s ILE 142 Ca -0.03 -0.15 -0.08 0.00 0.00 0.00 0.00 60.65 60.39 3k8y s ILE 142 Cb -0.14 -0.33 -0.05 0.00 0.01 0.00 0.00 42.46 41.95 3k8y s ILE 142 CO 0.04 0.12 0.30 -1.61 0.00 0.00 0.00 174.94 173.79 3k8y s GLU 143 N 0.13 3.64 0.07 2.79 2.02 -1.26 -1.27 118.70 124.83 3k8y s GLU 143 Ca -0.01 0.02 0.00 0.00 0.02 0.00 0.00 54.97 55.01 3k8y s GLU 143 Cb -0.05 -3.09 -0.04 0.00 0.10 0.00 0.00 34.13 31.06 3k8y s GLU 143 CO -0.00 0.65 -0.05 0.95 0.02 0.00 0.00 175.26 176.83 3k8y s THR 144 N -1.27 0.45 -0.14 3.63 -4.23 -0.29 -4.38 115.64 109.40 3k8y s THR 144 Ca 0.27 -1.85 -0.02 0.00 -1.18 0.00 0.00 61.69 58.91 3k8y s THR 144 Cb -0.14 -1.57 0.05 0.00 1.34 0.00 0.00 72.50 72.18 3k8y s THR 144 CO 0.15 -0.93 0.02 -0.55 -0.54 0.00 0.00 174.62 172.77 3k8y s SER 145 N -2.94 2.38 0.53 3.99 0.15 0.03 -1.38 113.70 116.45 3k8y s SER 145 Ca 0.09 -0.52 0.27 0.00 0.70 0.00 0.00 55.95 56.49 3k8y s SER 145 Cb 0.06 -0.55 1.49 0.00 -1.71 0.00 0.00 66.02 65.31 3k8y s SER 145 CO -0.07 -0.25 2.11 0.00 1.20 0.00 0.00 173.24 176.22 3k8y h ALA 146 N 8.27 1.38 -0.04 5.45 0.00 -1.90 0.67 119.26 133.09 3k8y h ALA 146 Ca -0.18 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.57 3k8y h ALA 146 Cb 1.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3k8y h ALA 146 CO 0.31 0.12 -0.23 -0.22 0.00 0.00 0.00 179.25 179.24 3k8y h LYS 147 N 0.00 0.23 -0.00 0.00 3.64 -1.94 -3.35 116.57 115.15 3k8y h LYS 147 Ca -0.00 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 3k8y h LYS 147 Cb 0.25 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.12 3k8y h LYS 147 CO 0.01 0.85 -0.73 0.25 -2.27 0.00 0.00 179.45 177.56 3k8y n THR 148 N -4.53 0.00 -0.35 1.00 -2.24 -1.18 -4.88 114.28 102.11 3k8y n THR 148 Ca -0.09 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 3k8y n THR 148 Cb 0.46 0.79 0.00 0.00 -2.10 0.00 0.00 70.33 69.47 3k8y n THR 148 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3k8y n ARG 149 N -1.21 0.00 -1.66 -0.78 1.74 0.21 -5.00 116.66 109.96 3k8y n ARG 149 Ca 0.06 0.00 -0.51 0.00 -0.77 0.00 0.00 57.85 56.63 3k8y n ARG 149 Cb 0.35 -1.74 -0.06 0.00 -1.02 0.00 0.00 32.46 30.00 3k8y n ARG 149 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 3k8y n GLN 150 N -2.00 1.63 -0.60 5.56 7.27 -1.15 -2.14 117.38 125.95 3k8y n GLN 150 Ca 0.00 0.59 0.00 0.00 0.07 0.00 0.00 57.00 57.66 3k8y n GLN 150 Cb 0.00 -2.33 0.00 0.00 2.41 0.00 0.00 30.24 30.32 3k8y n GLN 150 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3k8y n GLY 151 N 3.63 1.02 0.29 1.69 0.00 -1.26 -0.79 105.19 109.76 3k8y n GLY 151 Ca 0.21 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.09 3k8y n GLY 151 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3k8y h VAL 152 N 0.00 0.41 -0.73 1.61 2.07 -1.73 0.13 116.25 118.01 3k8y h VAL 152 Ca 0.00 -0.39 0.06 0.00 0.82 0.00 0.00 66.70 67.19 3k8y h VAL 152 Cb 0.00 0.56 -0.06 0.00 -1.52 0.00 0.00 31.29 30.27 3k8y h VAL 152 CO 0.00 0.06 0.43 -0.33 0.02 0.00 0.00 177.57 177.74 3k8y h GLU 153 N -0.93 0.76 -0.75 1.57 5.08 -1.90 -2.58 114.58 115.84 3k8y h GLU 153 Ca -0.07 -0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.33 3k8y h GLU 153 Cb 0.60 -0.17 -0.07 0.00 0.50 0.00 0.00 28.75 29.61 3k8y h GLU 153 CO 0.11 0.51 0.41 -0.44 -1.00 0.00 0.00 179.01 178.60 3k8y h ASP 154 N 0.79 0.59 -0.06 1.42 3.32 -1.88 0.67 116.42 121.27 3k8y h ASP 154 Ca 0.32 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.41 3k8y h ASP 154 Cb 0.17 -0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 3k8y h ASP 154 CO -0.17 0.35 0.02 0.00 -1.72 0.00 0.00 179.24 177.72 3k8y h ALA 155 N 1.41 0.07 -0.43 3.45 0.00 -0.58 0.35 119.26 123.54 3k8y h ALA 155 Ca 0.35 -0.10 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 3k8y h ALA 155 Cb 0.30 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3k8y h ALA 155 CO -0.23 -0.33 -0.16 0.74 0.00 0.00 0.00 179.25 179.27 3k8y h PHE 156 N -0.08 0.99 -0.28 0.00 0.04 -1.27 -2.18 116.94 114.16 3k8y h PHE 156 Ca 0.02 -0.23 -0.10 0.00 2.80 0.00 0.00 57.97 60.45 3k8y h PHE 156 Cb 0.18 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.08 3k8y h PHE 156 CO -0.01 1.00 -0.26 1.88 -0.60 0.00 0.00 178.31 180.32 3k8y h TYR 157 N 0.69 0.63 -0.89 -0.55 -1.99 -0.85 -2.09 116.97 111.93 3k8y h TYR 157 Ca 0.10 -0.14 -0.02 0.00 2.00 0.00 0.00 58.73 60.67 3k8y h TYR 157 Cb 0.71 -0.15 -0.04 0.00 2.00 0.00 0.00 36.73 39.25 3k8y h TYR 157 CO 0.05 0.77 0.48 1.15 -0.00 0.00 0.00 178.16 180.61 3k8y h THR 158 N 0.49 1.26 -0.67 -2.88 2.02 -0.80 -1.01 112.91 111.32 3k8y h THR 158 Ca 0.07 -0.65 -0.03 0.00 0.77 0.00 0.00 66.41 66.57 3k8y h THR 158 Cb 0.71 0.06 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 3k8y h THR 158 CO 0.05 0.29 0.32 0.25 0.37 0.00 0.00 175.52 176.81 3k8y h LEU 159 N 1.25 0.88 -0.63 2.58 5.85 -0.91 0.02 115.31 124.35 3k8y h LEU 159 Ca 0.31 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.93 3k8y h LEU 159 Cb 0.04 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 40.80 3k8y h LEU 159 CO -0.05 0.77 0.39 0.58 -0.34 0.00 0.00 178.44 179.79 3k8y h VAL 160 N 0.94 1.07 0.00 1.05 2.07 -0.96 -0.63 116.25 119.79 3k8y h VAL 160 Ca 0.23 -0.26 -0.04 0.00 0.82 0.00 0.00 66.70 67.45 3k8y h VAL 160 Cb 0.12 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 3k8y h VAL 160 CO -0.03 0.14 -0.18 0.03 0.02 0.00 0.00 177.57 177.55 3k8y h ARG 161 N 0.75 0.00 -0.08 1.57 3.08 -0.58 -1.46 114.38 117.66 3k8y h ARG 161 Ca 0.26 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.10 3k8y h ARG 161 Cb 0.03 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.10 3k8y h ARG 161 CO -0.11 0.18 -0.74 0.93 -1.07 0.00 0.00 179.97 179.16 3k8y h GLU 162 N 0.00 0.65 -0.88 0.04 4.39 -0.14 -3.11 114.58 115.54 3k8y h GLU 162 Ca -0.00 -0.59 0.04 0.00 0.34 0.00 0.00 59.36 59.15 3k8y h GLU 162 Cb 0.40 0.14 -0.06 0.00 -0.10 0.00 0.00 28.75 29.13 3k8y h GLU 162 CO 0.02 1.20 0.56 0.82 -1.16 0.00 0.00 179.01 180.45 3k8y h ILE 163 N 0.30 1.11 0.00 3.13 2.04 -0.66 -1.94 117.51 121.49 3k8y h ILE 163 Ca -0.07 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.43 3k8y h ILE 163 Cb 1.39 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.43 3k8y h ILE 163 CO 0.15 0.19 0.00 0.03 0.00 0.00 0.00 178.15 178.52 3k8y h ARG 164 N 1.07 0.00 -0.00 2.37 3.08 -1.29 -1.95 114.38 117.66 3k8y h ARG 164 Ca 0.36 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.41 3k8y h ARG 164 Cb 0.06 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.11 3k8y h ARG 164 CO -0.13 0.00 -0.26 1.04 -1.07 0.00 0.00 179.97 179.55 3k8y n GLN 165 N -2.96 0.21 0.00 0.04 6.02 -0.73 -5.10 117.38 114.85 3k8y n GLN 165 Ca -0.01 -0.09 0.10 0.00 -0.01 0.00 0.00 57.00 56.99 3k8y n GLN 165 Cb 0.17 -1.50 0.08 0.00 1.02 0.00 0.00 30.24 30.02 3k8y n GLN 165 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77