#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d1h s VAL 35 N 0.00 4.96 -0.08 2.28 1.01 -1.26 -5.02 120.40 122.30 3d1h s VAL 35 Ca 0.00 0.96 -0.26 0.00 0.00 0.00 0.00 61.98 62.67 3d1h s VAL 35 Cb 0.00 -3.78 -0.22 0.00 0.00 0.00 0.00 36.38 32.38 3d1h s VAL 35 CO 0.00 0.55 0.98 0.74 0.00 0.00 0.00 175.10 177.37 3d1h h THR 36 N 3.77 1.50 -3.20 3.92 2.02 -2.07 -3.44 112.91 115.42 3d1h h THR 36 Ca -0.50 -1.69 -0.53 0.00 0.77 0.00 0.00 66.41 64.46 3d1h h THR 36 Cb 1.21 2.62 -0.37 0.00 -1.74 0.00 0.00 68.15 69.88 3d1h h THR 36 CO 0.63 0.43 -0.80 -1.61 0.37 0.00 0.00 175.52 174.54 3d1h s GLU 37 N -3.21 1.51 0.74 6.66 0.41 -1.26 -5.10 118.70 118.45 3d1h s GLU 37 Ca -0.17 -0.29 -0.11 0.00 -0.41 0.00 0.00 54.97 54.00 3d1h s GLU 37 Cb -0.01 -1.64 0.03 0.00 -1.78 0.00 0.00 34.13 30.73 3d1h s GLU 37 CO 0.65 -0.29 1.08 -1.25 -0.49 0.00 0.00 175.26 174.96 3d1h s PRO 38 N 1.70 2.60 0.24 0.39 0.04 -1.26 -4.86 135.00 133.85 3d1h s PRO 38 Ca 0.04 0.81 -0.31 0.00 0.04 0.00 0.00 61.00 61.58 3d1h s PRO 38 Cb -0.13 -1.96 -0.13 0.00 0.04 0.00 0.00 34.50 32.32 3d1h s PRO 38 CO -0.08 -1.30 1.55 0.28 0.04 0.00 0.00 177.00 177.49 3d1h n VAL 39 N -3.24 0.66 0.00 -0.36 0.31 -1.26 -1.14 118.33 113.29 3d1h n VAL 39 Ca 0.07 -0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 3d1h n VAL 39 Cb 0.55 -1.74 0.00 0.00 -0.91 0.00 0.00 33.84 31.74 3d1h n VAL 39 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3d1h n GLY 40 N 2.67 0.55 0.83 2.92 0.00 -1.26 -4.63 105.19 106.27 3d1h n GLY 40 Ca 0.12 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.19 3d1h n GLY 40 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3d1h n SER 41 N 0.00 1.35 -0.28 1.61 7.64 -0.30 -4.79 113.62 118.85 3d1h n SER 41 Ca 0.00 -2.91 0.00 0.00 1.01 0.00 0.00 58.87 56.98 3d1h n SER 41 Cb 0.00 -0.40 0.13 0.00 -1.01 0.00 0.00 64.21 62.93 3d1h n SER 41 CO 0.00 0.00 0.00 1.88 -3.01 0.00 0.00 175.04 173.91 3d1h h TYR 42 N 0.75 0.85 -0.03 1.43 0.05 -1.89 -1.75 116.97 116.37 3d1h h TYR 42 Ca -0.08 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.74 3d1h h TYR 42 Cb 1.36 -0.27 -0.00 0.00 1.01 0.00 0.00 36.73 38.83 3d1h h TYR 42 CO 0.38 0.40 0.17 0.00 -1.05 0.00 0.00 178.16 178.06 3d1h h ALA 43 N 1.40 1.28 0.00 3.88 0.00 -1.95 -0.26 119.26 123.61 3d1h h ALA 43 Ca 0.35 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.26 3d1h h ALA 43 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3d1h h ALA 43 CO -0.19 -0.19 0.00 0.00 0.00 0.00 0.00 179.25 178.87 3d1h h ARG 44 N 0.00 0.00 0.00 0.00 3.08 -1.71 -2.22 114.38 113.53 3d1h h ARG 44 Ca 0.02 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.07 3d1h h ARG 44 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.40 3d1h h ARG 44 CO -0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 3d1h h ALA 45 N 2.03 1.00 -2.26 0.04 0.00 -1.21 -3.46 119.26 115.40 3d1h h ALA 45 Ca 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 54.91 54.45 3d1h h ALA 45 Cb 0.23 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.03 3d1h h ALA 45 CO 0.00 0.00 0.37 -1.21 0.00 0.00 0.00 179.25 178.41 3d1h s GLU 46 N -3.19 3.92 -0.30 0.00 0.41 -0.84 -5.02 118.70 113.68 3d1h s GLU 46 Ca 0.08 1.30 -0.19 0.00 -0.41 0.00 0.00 54.97 55.74 3d1h s GLU 46 Cb 0.08 -2.12 -0.01 0.00 -1.78 0.00 0.00 34.13 30.29 3d1h s GLU 46 CO 0.63 -0.32 0.59 1.03 -0.49 0.00 0.00 175.26 176.70 3d1h s ARG 47 N -3.21 3.91 0.46 1.61 0.52 -1.26 -4.95 118.95 116.03 3d1h s ARG 47 Ca 0.66 0.26 0.13 0.00 -0.52 0.00 0.00 55.73 56.26 3d1h s ARG 47 Cb -0.14 -3.72 1.07 0.00 0.52 0.00 0.00 34.95 32.67 3d1h s ARG 47 CO 0.18 -0.53 2.06 -1.00 0.02 0.00 0.00 175.30 176.03 3d1h h PRO 48 N 8.17 0.12 0.00 3.54 0.13 -1.94 -2.19 132.00 139.83 3d1h h PRO 48 Ca -0.27 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 3d1h h PRO 48 Cb 1.12 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3d1h h PRO 48 CO 0.78 0.16 0.00 -0.56 -0.23 0.00 0.00 178.00 178.14 3d1h h GLN 49 N 0.12 0.00 -0.01 0.86 -0.00 -1.93 -1.54 115.11 112.60 3d1h h GLN 49 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.68 3d1h h GLN 49 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.61 3d1h h GLN 49 CO 0.00 0.00 -0.13 -0.25 -0.00 0.00 0.00 178.83 178.46 3d1h n ASP 50 N -2.33 1.50 -0.98 0.06 8.00 -0.82 -4.22 116.55 117.75 3d1h n ASP 50 Ca -0.01 -1.33 0.05 0.00 0.71 0.00 0.00 54.79 54.22 3d1h n ASP 50 Cb 0.10 0.08 0.12 0.00 -0.02 0.00 0.00 41.12 41.40 3d1h n ASP 50 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3d1h n PHE 51 N -0.03 0.00 -1.93 1.24 3.01 -0.58 -4.82 117.46 114.35 3d1h n PHE 51 Ca 0.15 -1.02 -0.38 0.00 1.01 0.00 0.00 57.45 57.22 3d1h n PHE 51 Cb 0.38 -0.20 0.03 0.00 -0.01 0.00 0.00 39.48 39.68 3d1h n PHE 51 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 3d1h s GLU 52 N -1.75 3.25 0.51 -1.08 2.02 -1.24 -3.18 118.70 117.23 3d1h s GLU 52 Ca 0.35 2.05 -0.23 0.00 0.02 0.00 0.00 54.97 57.17 3d1h s GLU 52 Cb 0.37 -2.23 -0.06 0.00 0.10 0.00 0.00 34.13 32.31 3d1h s GLU 52 CO -0.11 -1.05 1.33 0.20 0.02 0.00 0.00 175.26 175.65 3d1h s GLY 53 N -1.16 2.88 0.00 -1.39 0.00 -1.26 -4.31 107.32 102.07 3d1h s GLY 53 Ca 0.71 1.28 0.00 0.00 0.00 0.00 0.00 44.72 46.71 3d1h s GLY 53 CO 0.42 1.81 0.00 1.97 0.00 0.00 0.00 173.10 177.30 3d1h n PHE 54 N -0.78 0.00 -3.53 1.90 1.16 0.08 -4.88 117.46 111.41 3d1h n PHE 54 Ca 0.09 0.00 -0.17 0.00 -1.87 0.00 0.00 57.45 55.49 3d1h n PHE 54 Cb 0.45 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.26 3d1h n PHE 54 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 3d1h s VAL 55 N 0.00 0.00 -0.61 1.97 0.11 -1.19 -5.00 120.40 115.69 3d1h s VAL 55 Ca 0.00 -0.03 -0.27 0.00 -2.93 0.00 0.00 61.98 58.75 3d1h s VAL 55 Cb 0.00 -0.98 0.03 0.00 -1.53 0.00 0.00 36.38 33.90 3d1h s VAL 55 CO 0.00 -0.01 1.17 0.26 -3.33 0.00 0.00 175.10 173.18 3d1h s TRP 56 N -1.35 2.58 0.21 1.54 0.52 -1.25 -0.47 118.94 120.71 3d1h s TRP 56 Ca -0.10 0.25 -0.29 0.00 0.02 0.00 0.00 56.10 55.98 3d1h s TRP 56 Cb -0.00 -4.47 -0.09 0.00 -1.15 0.00 0.00 33.47 27.76 3d1h s TRP 56 CO 0.08 -1.64 0.90 0.50 0.02 0.00 0.00 176.95 176.81 3d1h s ARG 57 N 4.94 4.77 -0.37 4.98 3.52 0.14 -2.00 118.95 134.93 3d1h s ARG 57 Ca 0.39 1.39 -0.29 0.00 -0.13 0.00 0.00 55.73 57.10 3d1h s ARG 57 Cb -0.08 -3.28 0.01 0.00 -1.56 0.00 0.00 34.95 30.03 3d1h s ARG 57 CO 0.22 0.51 1.30 -1.17 -0.81 0.00 0.00 175.30 175.36 3d1h s LEU 58 N -1.09 3.75 0.43 -0.88 2.96 -0.48 -1.49 118.68 121.88 3d1h s LEU 58 Ca 0.40 0.96 0.24 0.00 -0.22 0.00 0.00 54.13 55.51 3d1h s LEU 58 Cb -0.25 -3.54 0.50 0.00 0.50 0.00 0.00 46.19 43.40 3d1h s LEU 58 CO 0.30 -1.21 1.67 0.44 -1.32 0.00 0.00 176.35 176.23 3d1h h ASP 59 N 9.68 0.00 -2.74 3.68 3.32 -1.23 -3.44 116.42 125.68 3d1h h ASP 59 Ca -0.26 0.00 0.09 0.00 0.02 0.00 0.00 57.03 56.88 3d1h h ASP 59 Cb 1.09 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.38 3d1h h ASP 59 CO 1.07 0.00 0.34 0.21 -1.72 0.00 0.00 179.24 179.14 3d1h s ASN 60 N -5.99 -0.56 0.00 6.45 3.84 -1.26 -4.68 114.94 112.74 3d1h s ASN 60 Ca 0.07 0.93 0.25 0.00 0.21 0.00 0.00 52.86 54.32 3d1h s ASN 60 Cb 0.06 1.17 1.32 0.00 -0.55 0.00 0.00 41.25 43.25 3d1h s ASN 60 CO 0.65 -0.15 1.85 -0.90 -2.79 0.00 0.00 177.10 175.76 3d1h n ASP 61 N 3.50 0.00 -0.78 -4.21 5.68 -1.26 -4.68 116.55 114.79 3d1h n ASP 61 Ca -0.18 -0.21 -0.10 0.00 -0.50 0.00 0.00 54.79 53.80 3d1h n ASP 61 Cb 0.57 -0.23 -0.04 0.00 -1.14 0.00 0.00 41.12 40.28 3d1h n ASP 61 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3d1h n GLY 62 N 0.80 1.05 0.12 6.12 0.00 -1.26 -4.88 105.19 107.13 3d1h n GLY 62 Ca 0.13 -0.12 -0.02 0.00 0.00 0.00 0.00 46.02 46.01 3d1h n GLY 62 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d1h h LYS 63 N 0.07 0.00 -6.65 1.61 1.57 -1.96 -3.45 116.57 107.76 3d1h h LYS 63 Ca -0.21 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.10 3d1h h LYS 63 Cb 1.00 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.33 3d1h h LYS 63 CO 0.31 0.72 -0.11 -1.21 -0.57 0.00 0.00 179.45 178.58 3d1h s GLU 64 N -3.23 3.26 0.27 3.15 0.41 -1.26 -5.01 118.70 116.30 3d1h s GLU 64 Ca 0.00 -0.37 0.10 0.00 -0.41 0.00 0.00 54.97 54.30 3d1h s GLU 64 Cb 0.11 -2.58 0.36 0.00 -1.78 0.00 0.00 34.13 30.24 3d1h s GLU 64 CO 0.77 -0.11 1.62 0.00 -0.49 0.00 0.00 175.26 177.05 3d1h h ALA 65 N 0.51 0.99 -2.18 5.21 0.00 -1.99 -3.46 119.26 118.34 3d1h h ALA 65 Ca -0.48 -0.56 -0.46 0.00 0.00 0.00 0.00 54.91 53.42 3d1h h ALA 65 Cb 1.24 -0.10 -0.14 0.00 0.00 0.00 0.00 17.79 18.79 3d1h h ALA 65 CO 0.59 0.77 -0.71 -0.51 0.00 0.00 0.00 179.25 179.38 3d1h s LEU 66 N -7.62 2.52 1.00 0.00 1.43 -1.26 -4.42 118.68 110.32 3d1h s LEU 66 Ca -0.01 -1.08 -0.12 0.00 -1.03 0.00 0.00 54.13 51.89 3d1h s LEU 66 Cb 0.13 -0.65 0.19 0.00 0.03 0.00 0.00 46.19 45.89 3d1h s LEU 66 CO 0.76 -0.23 1.10 -2.16 0.23 0.00 0.00 176.35 176.05 3d1h s PRO 67 N -3.68 0.40 0.64 1.29 0.04 -1.26 -5.00 135.00 127.43 3d1h s PRO 67 Ca 0.25 0.48 -0.13 0.00 0.04 0.00 0.00 61.00 61.64 3d1h s PRO 67 Cb 0.01 -1.74 -0.02 0.00 0.04 0.00 0.00 34.50 32.80 3d1h s PRO 67 CO 0.08 -2.74 1.05 1.03 0.04 0.00 0.00 177.00 176.46 3d1h s ARG 68 N -4.99 3.16 -1.47 4.56 1.81 -1.26 -3.84 118.95 116.92 3d1h s ARG 68 Ca 0.65 1.04 0.00 0.00 -1.72 0.00 0.00 55.73 55.71 3d1h s ARG 68 Cb -0.18 -2.02 0.00 0.00 -0.45 0.00 0.00 34.95 32.30 3d1h s ARG 68 CO 0.57 -0.93 0.00 0.09 -0.68 0.00 0.00 175.30 174.35 3d1h n ASN 69 N -2.62 -4.98 -4.72 0.23 3.02 -1.26 -0.53 115.26 104.41 3d1h n ASN 69 Ca 0.08 0.10 -0.42 0.00 -0.03 0.00 0.00 54.58 54.30 3d1h n ASN 69 Cb 0.53 -4.19 -0.03 0.00 -0.61 0.00 0.00 39.78 35.48 3d1h n ASN 69 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3d1h s PHE 70 N -2.83 3.18 0.02 3.10 5.36 -1.25 -4.06 117.98 121.51 3d1h s PHE 70 Ca 0.00 0.85 -0.23 0.00 -0.96 0.00 0.00 56.93 56.59 3d1h s PHE 70 Cb 0.00 -3.76 0.05 0.00 -0.34 0.00 0.00 43.02 38.97 3d1h s PHE 70 CO 0.00 -2.72 0.52 -0.98 -1.46 0.00 0.00 175.22 170.58 3d1h s ARG 71 N 1.09 1.00 0.16 10.12 1.70 -0.62 -4.98 118.95 127.42 3d1h s ARG 71 Ca 0.66 -0.15 0.05 0.00 -0.47 0.00 0.00 55.73 55.82 3d1h s ARG 71 Cb -0.39 0.46 -0.05 0.00 -0.57 0.00 0.00 34.95 34.40 3d1h s ARG 71 CO 0.31 -0.35 -0.10 0.95 -1.08 0.00 0.00 175.30 175.03 3d1h s THR 72 N -2.13 1.25 -1.91 4.99 -4.23 -1.26 -0.90 115.64 111.44 3d1h s THR 72 Ca -0.07 -2.08 0.18 0.00 -1.18 0.00 0.00 61.69 58.54 3d1h s THR 72 Cb -0.01 -1.92 0.48 0.00 1.34 0.00 0.00 72.50 72.39 3d1h s THR 72 CO 0.01 -0.69 1.48 -1.54 -0.54 0.00 0.00 174.62 173.34 3d1h n SER 73 N -0.24 0.00 -0.54 3.99 3.41 -0.12 -1.66 113.62 118.46 3d1h n SER 73 Ca -0.09 -0.47 0.12 0.00 -0.26 0.00 0.00 58.87 58.17 3d1h n SER 73 Cb 0.61 -0.04 0.20 0.00 -0.26 0.00 0.00 64.21 64.71 3d1h n SER 73 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d1h n ALA 74 N -1.04 3.04 -1.73 7.33 0.00 -1.26 -4.52 120.51 122.31 3d1h n ALA 74 Ca 0.13 -0.56 -0.33 0.00 0.00 0.00 0.00 53.44 52.68 3d1h n ALA 74 Cb 0.07 -0.94 -0.01 0.00 0.00 0.00 0.00 19.45 18.57 3d1h n ALA 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3d1h s ASP 75 N -2.30 6.08 0.57 0.00 -0.00 -0.66 -5.03 116.67 115.33 3d1h s ASP 75 Ca 0.25 1.78 -0.17 0.00 -0.00 0.00 0.00 52.55 54.41 3d1h s ASP 75 Cb 0.19 -2.53 -0.04 0.00 -0.00 0.00 0.00 42.92 40.54 3d1h s ASP 75 CO 0.46 -0.96 1.08 0.00 -0.00 0.00 0.00 175.17 175.75 3d1h s ALA 76 N -2.40 2.69 0.19 5.23 0.00 -1.26 -4.96 121.76 121.26 3d1h s ALA 76 Ca 0.63 0.58 -0.25 0.00 0.00 0.00 0.00 51.96 52.93 3d1h s ALA 76 Cb -0.15 -3.29 -0.08 0.00 0.00 0.00 0.00 23.12 19.60 3d1h s ALA 76 CO 0.32 -0.80 0.79 -0.51 0.00 0.00 0.00 175.76 175.56 3d1h s LEU 77 N -4.19 4.54 0.46 0.00 1.43 -1.26 -4.64 118.68 115.01 3d1h s LEU 77 Ca 0.67 1.64 0.06 0.00 -1.03 0.00 0.00 54.13 55.47 3d1h s LEU 77 Cb -0.19 -3.41 -0.03 0.00 0.03 0.00 0.00 46.19 42.60 3d1h s LEU 77 CO 0.32 0.16 0.21 -0.13 0.23 0.00 0.00 176.35 177.14 3d1h s ARG 78 N -1.35 2.23 0.48 1.70 0.52 0.21 -5.01 118.95 117.74 3d1h s ARG 78 Ca 0.38 -1.97 -0.24 0.00 -0.52 0.00 0.00 55.73 53.38 3d1h s ARG 78 Cb -0.22 -1.94 -0.08 0.00 0.52 0.00 0.00 34.95 33.23 3d1h s ARG 78 CO 0.25 -0.27 1.39 0.00 0.02 0.00 0.00 175.30 176.69 3d1h n ALA 79 N -1.37 1.81 -1.24 2.13 0.00 -1.26 -4.69 120.51 115.89 3d1h n ALA 79 Ca -0.04 0.21 -0.30 0.00 0.00 0.00 0.00 53.44 53.32 3d1h n ALA 79 Cb 0.65 -2.37 0.13 0.00 0.00 0.00 0.00 19.45 17.86 3d1h n ALA 79 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3d1h s PRO 80 N -2.54 1.45 0.20 0.00 0.04 -1.26 -4.93 135.00 127.97 3d1h s PRO 80 Ca 0.64 0.85 -0.30 0.00 0.04 0.00 0.00 61.00 62.23 3d1h s PRO 80 Cb -0.45 -1.83 -0.08 0.00 0.04 0.00 0.00 34.50 32.18 3d1h s PRO 80 CO 0.55 -2.11 0.96 -1.21 0.04 0.00 0.00 177.00 175.22 3d1h s GLU 81 N -4.95 4.80 0.29 4.56 2.02 -1.26 -4.95 118.70 119.22 3d1h s GLU 81 Ca 0.63 1.50 0.02 0.00 0.02 0.00 0.00 54.97 57.14 3d1h s GLU 81 Cb -0.18 -3.30 0.59 0.00 0.10 0.00 0.00 34.13 31.35 3d1h s GLU 81 CO 0.57 0.41 1.84 0.87 0.02 0.00 0.00 175.26 178.97 3d1h h LYS 82 N 4.55 0.93 -0.28 1.61 1.57 -1.98 -1.69 116.57 121.27 3d1h h LYS 82 Ca -0.44 -0.06 0.08 0.00 -1.87 0.00 0.00 60.65 58.36 3d1h h LYS 82 Cb 1.20 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 3d1h h LYS 82 CO 0.69 0.61 0.40 1.57 -0.57 0.00 0.00 179.45 182.15 3d1h h LYS 83 N 0.95 0.00 -0.01 3.15 2.10 -1.99 0.21 116.57 120.98 3d1h h LYS 83 Ca 0.49 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.14 3d1h h LYS 83 Cb 0.53 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.86 3d1h h LYS 83 CO -0.26 0.00 -0.20 1.19 -2.00 0.00 0.00 179.45 178.18 3d1h n PHE 84 N -3.49 0.00 -3.94 0.07 3.01 -0.64 -4.55 117.46 107.93 3d1h n PHE 84 Ca 0.04 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.18 3d1h n PHE 84 Cb 0.53 -0.11 -0.00 0.00 -0.01 0.00 0.00 39.48 39.89 3d1h n PHE 84 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 3d1h n HIS 85 N -0.58 -1.63 -3.25 1.38 8.25 0.74 -4.72 115.22 115.41 3d1h n HIS 85 Ca 0.13 0.49 -0.21 0.00 -0.26 0.00 0.00 57.72 57.87 3d1h n HIS 85 Cb 0.34 -3.32 0.05 0.00 1.12 0.00 0.00 29.99 28.17 3d1h n HIS 85 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3d1h s LEU 86 N -6.97 2.98 -0.67 2.41 1.43 -1.26 -5.04 118.68 111.57 3d1h s LEU 86 Ca 0.26 -0.96 -0.21 0.00 -1.03 0.00 0.00 54.13 52.19 3d1h s LEU 86 Cb -0.11 -1.49 0.08 0.00 0.03 0.00 0.00 46.19 44.70 3d1h s LEU 86 CO 0.91 -1.31 0.92 -0.62 0.23 0.00 0.00 176.35 176.49 3d1h s ASP 87 N -4.58 6.21 0.54 2.29 3.68 -1.26 -4.88 116.67 118.66 3d1h s ASP 87 Ca 0.55 -1.18 0.36 0.00 2.13 0.00 0.00 52.55 54.41 3d1h s ASP 87 Cb -0.05 -2.39 1.80 0.00 -1.45 0.00 0.00 42.92 40.83 3d1h s ASP 87 CO 0.35 -1.34 2.08 0.00 0.13 0.00 0.00 175.17 176.39 3d1h h ALA 88 N 9.43 1.00 0.00 3.66 0.00 -1.97 -1.45 119.26 129.93 3d1h h ALA 88 Ca -0.25 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.60 3d1h h ALA 88 Cb 1.07 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 3d1h h ALA 88 CO 1.16 0.00 -0.32 0.00 0.00 0.00 0.00 179.25 180.09 3d1h h ALA 89 N 2.03 0.81 -2.75 0.00 0.00 -2.04 -3.46 119.26 113.84 3d1h h ALA 89 Ca 0.00 -0.27 -0.53 0.00 0.00 0.00 0.00 54.91 54.12 3d1h h ALA 89 Cb 0.16 -0.04 0.07 0.00 0.00 0.00 0.00 17.79 17.98 3d1h h ALA 89 CO 0.00 0.36 0.83 -0.47 0.00 0.00 0.00 179.25 179.97 3d1h s TYR 90 N -3.07 2.91 -0.49 0.00 5.04 -0.55 -4.98 117.35 116.20 3d1h s TYR 90 Ca 0.05 0.87 -0.05 0.00 -2.44 0.00 0.00 57.07 55.50 3d1h s TYR 90 Cb 0.07 -3.94 0.13 0.00 0.35 0.00 0.00 41.96 38.56 3d1h s TYR 90 CO 0.72 -3.16 0.32 0.08 -1.34 0.00 0.00 175.55 172.16 3d1h s VAL 91 N 0.13 3.69 0.49 3.14 1.01 -1.26 -5.05 120.40 122.55 3d1h s VAL 91 Ca 0.62 -2.24 -0.24 0.00 0.00 0.00 0.00 61.98 60.13 3d1h s VAL 91 Cb -0.45 -3.46 -0.07 0.00 0.00 0.00 0.00 36.38 32.41 3d1h s VAL 91 CO 0.44 -0.77 1.39 -2.84 0.00 0.00 0.00 175.10 173.32 3d1h s PRO 92 N 0.85 3.44 0.50 2.72 0.02 -1.26 -4.96 135.00 136.30 3d1h s PRO 92 Ca 0.10 2.33 -0.22 0.00 0.02 0.00 0.00 61.00 63.23 3d1h s PRO 92 Cb -0.23 -2.47 -0.06 0.00 0.02 0.00 0.00 34.50 31.76 3d1h s PRO 92 CO -0.03 -0.99 1.21 0.45 -0.33 0.00 0.00 177.00 177.31 3d1h s SER 93 N -0.71 5.86 -0.09 2.53 0.15 -1.26 -4.92 113.70 115.25 3d1h s SER 93 Ca 0.66 2.41 0.14 0.00 0.70 0.00 0.00 55.95 59.85 3d1h s SER 93 Cb -0.42 -2.61 0.44 0.00 -1.71 0.00 0.00 66.02 61.72 3d1h s SER 93 CO 0.52 -1.14 1.36 0.54 1.20 0.00 0.00 173.24 175.72 3d1h n ARG 94 N -0.76 2.99 -1.68 5.44 1.74 -1.26 -4.92 116.66 118.22 3d1h n ARG 94 Ca 0.09 -2.47 -0.49 0.00 -0.77 0.00 0.00 57.85 54.21 3d1h n ARG 94 Cb 0.48 -1.58 -0.05 0.00 -1.02 0.00 0.00 32.46 30.29 3d1h n ARG 94 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 3d1h n GLU 95 N 0.13 2.05 -0.07 5.56 4.07 -1.26 -1.47 120.64 129.65 3d1h n GLU 95 Ca 0.17 0.75 0.00 0.00 -0.06 0.00 0.00 57.16 58.02 3d1h n GLU 95 Cb 0.67 -2.56 0.00 0.00 -0.06 0.00 0.00 31.44 29.49 3d1h n GLU 95 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3d1h n GLY 96 N 4.16 1.68 0.20 8.31 0.00 -1.26 -4.91 105.19 113.37 3d1h n GLY 96 Ca 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.22 3d1h n GLY 96 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3d1h h MET 97 N 2.92 0.24 -0.81 1.61 2.86 -1.58 -0.82 114.93 119.36 3d1h h MET 97 Ca 0.00 -0.11 0.01 0.00 -2.06 0.00 0.00 59.70 57.53 3d1h h MET 97 Cb 0.00 -0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.62 3d1h h MET 97 CO 0.00 0.62 0.54 -0.44 1.06 0.00 0.00 176.91 178.68 3d1h h ASP 98 N 0.20 0.93 -0.05 1.22 3.45 -1.79 -2.40 116.42 117.98 3d1h h ASP 98 Ca 0.02 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.45 3d1h h ASP 98 Cb 0.81 -0.23 0.00 0.00 -0.56 0.00 0.00 39.33 39.35 3d1h h ASP 98 CO 0.06 0.67 0.00 0.00 -1.57 0.00 0.00 179.24 178.40 3d1h n ALA 99 N -2.41 2.46 -0.15 3.45 0.00 -1.12 -4.50 120.51 118.25 3d1h n ALA 99 Ca 0.09 -0.70 -0.08 0.00 0.00 0.00 0.00 53.44 52.75 3d1h n ALA 99 Cb 0.03 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 18.65 3d1h n ALA 99 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3d1h h LEU 100 N 4.63 0.56 -2.48 0.00 5.85 -0.60 -3.48 115.31 119.78 3d1h h LEU 100 Ca 0.00 -0.11 -0.27 0.00 0.84 0.00 0.00 57.88 58.34 3d1h h LEU 100 Cb 0.98 -0.14 0.19 0.00 0.37 0.00 0.00 40.66 42.06 3d1h h LEU 100 CO 0.00 0.51 -0.86 1.41 -0.34 0.00 0.00 178.44 179.16 3d1h n HIS 101 N -4.68 -2.41 -4.10 1.25 8.25 -1.26 -4.90 115.22 107.36 3d1h n HIS 101 Ca 0.01 0.83 -0.08 0.00 -0.26 0.00 0.00 57.72 58.22 3d1h n HIS 101 Cb 0.10 -4.11 -0.10 0.00 1.12 0.00 0.00 29.99 27.00 3d1h n HIS 101 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 3d1h s ILE 102 N -3.40 0.28 0.19 1.59 -4.36 -1.26 -2.11 121.20 112.13 3d1h s ILE 102 Ca 0.44 -1.83 -0.11 0.00 -0.26 0.00 0.00 60.65 58.90 3d1h s ILE 102 Cb -0.07 -1.56 -0.00 0.00 1.25 0.00 0.00 42.46 42.08 3d1h s ILE 102 CO 0.75 -0.96 0.36 -0.94 0.24 0.00 0.00 174.94 174.39 3d1h s SER 103 N -2.94 -0.03 0.11 4.36 1.04 -0.11 -0.94 113.70 115.18 3d1h s SER 103 Ca 0.08 -0.86 -0.09 0.00 0.48 0.00 0.00 55.95 55.57 3d1h s SER 103 Cb 0.08 0.49 -0.00 0.00 0.10 0.00 0.00 66.02 66.69 3d1h s SER 103 CO -0.09 -0.98 0.22 -0.83 0.98 0.00 0.00 173.24 172.54 3d1h s GLY 104 N -2.98 0.15 0.04 7.32 0.00 -0.08 -0.54 107.32 111.24 3d1h s GLY 104 Ca 0.19 -0.64 -0.28 0.00 0.00 0.00 0.00 44.72 43.98 3d1h s GLY 104 CO 0.03 -0.79 1.19 -1.35 0.00 0.00 0.00 173.10 172.18 3d1h s SER 105 N -2.88 -0.06 0.98 1.64 1.04 -0.82 -1.59 113.70 112.01 3d1h s SER 105 Ca 0.07 -0.28 -0.07 0.00 0.48 0.00 0.00 55.95 56.15 3d1h s SER 105 Cb 0.04 0.27 0.10 0.00 0.10 0.00 0.00 66.02 66.53 3d1h s SER 105 CO -0.09 -0.51 0.58 -1.54 0.98 0.00 0.00 173.24 172.66 3d1h n SER 106 N -0.72 0.07 -4.37 7.02 3.41 0.31 -3.49 113.62 115.87 3d1h n SER 106 Ca -0.05 -1.23 -0.29 0.00 -0.26 0.00 0.00 58.87 57.05 3d1h n SER 106 Cb 0.61 -0.44 0.22 0.00 -0.26 0.00 0.00 64.21 64.34 3d1h n SER 106 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3d1h s ALA 107 N -3.93 0.35 0.19 7.33 0.00 -0.13 -4.70 121.76 120.87 3d1h s ALA 107 Ca 0.33 -0.48 -0.17 0.00 0.00 0.00 0.00 51.96 51.63 3d1h s ALA 107 Cb -0.01 -3.08 0.03 0.00 0.00 0.00 0.00 23.12 20.06 3d1h s ALA 107 CO 0.23 -3.41 0.52 -0.59 0.00 0.00 0.00 175.76 172.51 3d1h s PHE 108 N -2.80 -0.12 0.65 0.00 -0.12 -1.26 -4.54 117.98 109.78 3d1h s PHE 108 Ca 0.68 -0.22 -0.06 0.00 -0.05 0.00 0.00 56.93 57.27 3d1h s PHE 108 Cb -0.18 0.39 0.04 0.00 -0.63 0.00 0.00 43.02 42.64 3d1h s PHE 108 CO 0.59 -0.91 0.96 0.95 -0.05 0.00 0.00 175.22 176.76 3d1h s THR 109 N -3.87 2.89 0.22 -4.49 -4.23 -1.26 -4.65 115.64 100.25 3d1h s THR 109 Ca 0.09 -0.14 -0.09 0.00 -1.18 0.00 0.00 61.69 60.37 3d1h s THR 109 Cb -0.01 -3.20 0.19 0.00 1.34 0.00 0.00 72.50 70.82 3d1h s THR 109 CO -0.03 -0.21 1.89 -0.65 -0.54 0.00 0.00 174.62 175.07 3d1h h PRO 110 N -0.41 1.12 -0.80 3.99 0.11 -1.98 -1.59 132.00 132.45 3d1h h PRO 110 Ca -0.45 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3d1h h PRO 110 Cb 1.29 -0.25 -0.04 0.00 0.11 0.00 0.00 31.00 32.11 3d1h h PRO 110 CO 0.60 0.76 0.51 0.00 -0.21 0.00 0.00 178.00 179.67 3d1h h ALA 111 N 1.30 1.01 -0.74 -0.75 0.00 -1.94 -2.12 119.26 116.02 3d1h h ALA 111 Ca 0.31 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 3d1h h ALA 111 Cb -0.10 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.33 3d1h h ALA 111 CO -0.06 0.44 0.31 1.96 0.00 0.00 0.00 179.25 181.89 3d1h h GLN 112 N 1.08 1.11 -0.83 0.00 4.20 -1.65 -2.24 115.11 116.78 3d1h h GLN 112 Ca 0.29 -0.19 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 3d1h h GLN 112 Cb -0.10 -0.18 -0.04 0.00 0.30 0.00 0.00 27.48 27.46 3d1h h GLN 112 CO -0.06 0.90 0.41 1.25 -0.67 0.00 0.00 178.83 180.66 3d1h h LEU 113 N 1.07 1.07 -1.03 1.46 5.85 -0.75 -1.35 115.31 121.63 3d1h h LEU 113 Ca 0.25 -0.12 0.01 0.00 0.84 0.00 0.00 57.88 58.86 3d1h h LEU 113 Cb 0.20 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.90 3d1h h LEU 113 CO -0.02 0.89 0.66 0.11 -0.34 0.00 0.00 178.44 179.74 3d1h h LYS 114 N 1.18 1.29 -0.35 1.25 1.57 -1.07 -0.33 116.57 120.11 3d1h h LYS 114 Ca 0.29 -0.08 -0.09 0.00 -1.87 0.00 0.00 60.65 58.90 3d1h h LYS 114 Cb 0.10 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.10 3d1h h LYS 114 CO -0.04 0.86 -0.14 -0.91 -0.57 0.00 0.00 179.45 178.65 3d1h h ASN 115 N 1.33 0.60 -0.29 0.86 2.35 -0.77 -1.46 115.58 118.20 3d1h h ASN 115 Ca 0.37 -0.17 -0.08 0.00 -0.55 0.00 0.00 56.30 55.87 3d1h h ASN 115 Cb -0.14 -0.16 -0.01 0.00 0.05 0.00 0.00 38.32 38.06 3d1h h ASN 115 CO -0.08 0.77 -0.11 0.58 -1.65 0.00 0.00 177.43 176.93 3d1h h VAL 116 N 0.56 1.29 -0.64 2.81 2.07 -0.44 -1.93 116.25 119.97 3d1h h VAL 116 Ca 0.10 -1.19 0.00 0.00 0.82 0.00 0.00 66.70 66.43 3d1h h VAL 116 Cb 0.57 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.75 3d1h h VAL 116 CO 0.04 0.38 0.41 0.00 0.02 0.00 0.00 177.57 178.41 3d1h h ALA 117 N 0.76 0.81 -0.62 1.67 0.00 -0.88 0.43 119.26 121.43 3d1h h ALA 117 Ca 0.07 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3d1h h ALA 117 Cb 0.62 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3d1h h ALA 117 CO 0.04 0.25 0.28 0.00 0.00 0.00 0.00 179.25 179.82 3d1h h ALA 118 N 1.22 0.80 0.01 0.00 0.00 -1.23 0.11 119.26 120.17 3d1h h ALA 118 Ca 0.23 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3d1h h ALA 118 Cb -0.07 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.47 3d1h h ALA 118 CO -0.05 0.38 -0.01 0.87 0.00 0.00 0.00 179.25 180.45 3d1h h LYS 119 N 0.85 -0.02 -0.56 0.00 1.57 -0.82 -3.02 116.57 114.57 3d1h h LYS 119 Ca 0.21 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.93 3d1h h LYS 119 Cb 0.15 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.44 3d1h h LYS 119 CO -0.02 0.05 0.09 -0.07 -0.57 0.00 0.00 179.45 178.92 3d1h h LEU 120 N -0.08 0.85 -2.96 2.94 3.38 -0.73 -2.27 115.31 116.45 3d1h h LEU 120 Ca -0.00 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.79 3d1h h LEU 120 Cb 0.07 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 3d1h h LEU 120 CO 0.00 0.87 0.00 -0.09 0.09 0.00 0.00 178.44 179.31 3d1h h ARG 121 N 0.85 0.00 0.00 1.13 9.65 -0.66 0.46 114.38 125.82 3d1h h ARG 121 Ca 0.18 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.06 3d1h h ARG 121 Cb 0.38 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.96 3d1h h ARG 121 CO 0.01 0.00 0.00 0.39 2.80 0.00 0.00 179.97 183.17 3d1h n GLU 122 N -3.12 0.00 0.00 0.20 1.02 -0.85 -3.29 120.64 114.60 3d1h n GLU 122 Ca -0.03 0.08 0.06 0.00 -0.02 0.00 0.00 57.16 57.25 3d1h n GLU 122 Cb 0.07 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.96 3d1h n GLU 122 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3d1h n LYS 123 N -1.50 2.33 -3.50 3.49 5.02 0.16 -5.04 118.16 119.13 3d1h n LYS 123 Ca 0.06 -0.42 -0.11 0.00 -2.02 0.00 0.00 58.31 55.82 3d1h n LYS 123 Cb 0.28 -1.13 -0.03 0.00 -0.02 0.00 0.00 35.03 34.13 3d1h n LYS 123 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3d1h s THR 124 N -1.83 0.02 -0.83 -0.18 -1.32 -1.14 -5.01 115.64 105.35 3d1h s THR 124 Ca 0.08 -0.20 0.07 0.00 -1.21 0.00 0.00 61.69 60.44 3d1h s THR 124 Cb 0.10 -1.10 0.11 0.00 -1.51 0.00 0.00 72.50 70.10 3d1h s THR 124 CO 0.40 -0.08 0.88 0.00 -2.21 0.00 0.00 174.62 173.61 3d1h n ALA 125 N -0.35 2.36 -1.99 11.08 0.00 -1.26 -4.70 120.51 125.66 3d1h n ALA 125 Ca -0.16 -0.74 -0.25 0.00 0.00 0.00 0.00 53.44 52.28 3d1h n ALA 125 Cb 0.64 -0.27 0.14 0.00 0.00 0.00 0.00 19.45 19.97 3d1h n ALA 125 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3d1h s GLY 126 N -0.75 1.77 0.31 0.00 0.00 -1.26 -5.03 107.32 102.35 3d1h s GLY 126 Ca 0.11 -1.74 -0.29 0.00 0.00 0.00 0.00 44.72 42.80 3d1h s GLY 126 CO 0.10 -1.06 1.23 2.56 0.00 0.00 0.00 173.10 175.93 3d1h s PRO 127 N -5.39 4.46 -0.25 2.90 0.04 -1.26 -4.81 135.00 130.70 3d1h s PRO 127 Ca 0.70 2.06 -0.07 0.00 0.04 0.00 0.00 61.00 63.73 3d1h s PRO 127 Cb -0.03 -3.12 -0.03 0.00 0.04 0.00 0.00 34.50 31.36 3d1h s PRO 127 CO 0.47 -0.04 0.08 0.42 0.04 0.00 0.00 177.00 177.97 3d1h s ILE 128 N -1.11 4.39 -0.16 0.56 1.01 -1.26 -1.03 121.20 123.60 3d1h s ILE 128 Ca 0.47 -0.15 -0.07 0.00 0.00 0.00 0.00 60.65 60.91 3d1h s ILE 128 Cb -0.37 -3.05 -0.04 0.00 0.01 0.00 0.00 42.46 39.01 3d1h s ILE 128 CO 0.48 0.34 0.07 -0.31 0.00 0.00 0.00 174.94 175.53 3d1h s TYR 129 N 1.55 3.32 -0.56 3.97 1.51 0.29 -0.62 117.35 126.81 3d1h s TYR 129 Ca 0.06 0.20 -0.22 0.00 -1.01 0.00 0.00 57.07 56.09 3d1h s TYR 129 Cb -0.15 -2.02 0.05 0.00 -0.11 0.00 0.00 41.96 39.73 3d1h s TYR 129 CO 0.04 0.31 0.86 0.34 -1.11 0.00 0.00 175.55 175.99 3d1h s ASP 130 N -0.05 6.27 -0.66 2.29 3.68 0.15 -0.53 116.67 127.83 3d1h s ASP 130 Ca 0.07 -0.65 -0.18 0.00 2.13 0.00 0.00 52.55 53.92 3d1h s ASP 130 Cb -0.12 -2.39 0.13 0.00 -1.45 0.00 0.00 42.92 39.09 3d1h s ASP 130 CO 0.01 -1.18 0.73 -0.69 0.13 0.00 0.00 175.17 174.17 3d1h s VAL 131 N 3.59 5.00 -0.51 1.11 1.01 0.40 -1.53 120.40 129.47 3d1h s VAL 131 Ca 0.24 -1.37 -0.29 0.00 0.00 0.00 0.00 61.98 60.57 3d1h s VAL 131 Cb -0.15 -4.49 0.03 0.00 0.00 0.00 0.00 36.38 31.76 3d1h s VAL 131 CO 0.15 -1.11 1.19 -0.62 0.00 0.00 0.00 175.10 174.71 3d1h s ASP 132 N 3.40 6.53 -0.12 3.32 -1.08 -0.42 -2.00 116.67 126.31 3d1h s ASP 132 Ca 0.13 0.37 0.18 0.00 -0.52 0.00 0.00 52.55 52.71 3d1h s ASP 132 Cb -0.21 -2.55 0.73 0.00 -1.46 0.00 0.00 42.92 39.43 3d1h s ASP 132 CO 0.02 -1.36 1.64 0.18 0.52 0.00 0.00 175.17 176.17 3d1h n LEU 133 N 8.17 4.82 -4.60 -1.34 4.77 -0.61 -0.32 117.00 127.89 3d1h n LEU 133 Ca 0.11 -2.43 -0.41 0.00 -0.03 0.00 0.00 56.01 53.25 3d1h n LEU 133 Cb 0.49 -0.59 -0.06 0.00 -2.33 0.00 0.00 43.42 40.93 3d1h n LEU 133 CO 0.72 0.80 0.42 -0.13 -1.33 0.00 0.00 177.39 177.86 3d1h s ARG 134 N -1.90 3.91 0.19 3.23 0.52 -1.20 -2.04 118.95 121.66 3d1h s ARG 134 Ca 0.51 0.34 0.01 0.00 -0.52 0.00 0.00 55.73 56.08 3d1h s ARG 134 Cb 0.33 -3.73 0.09 0.00 0.52 0.00 0.00 34.95 32.16 3d1h s ARG 134 CO 0.24 -0.59 1.45 0.37 0.02 0.00 0.00 175.30 176.79 3d1h h GLN 135 N 8.18 0.31 -7.05 3.54 4.15 -1.46 -3.41 115.11 119.36 3d1h h GLN 135 Ca -0.26 -0.26 -0.55 0.00 0.77 0.00 0.00 58.65 58.35 3d1h h GLN 135 Cb 1.11 0.06 0.13 0.00 0.21 0.00 0.00 27.48 28.99 3d1h h GLN 135 CO 0.82 0.92 0.59 -1.83 -1.93 0.00 0.00 178.83 177.39 3d1h s GLU 136 N -3.55 3.12 0.01 1.69 1.03 -1.26 -4.81 118.70 114.93 3d1h s GLU 136 Ca -0.05 2.17 -0.30 0.00 0.03 0.00 0.00 54.97 56.82 3d1h s GLU 136 Cb 0.11 -2.21 -0.06 0.00 -0.80 0.00 0.00 34.13 31.17 3d1h s GLU 136 CO 0.83 -1.19 1.39 -1.12 -1.33 0.00 0.00 175.26 173.84 3d1h s SER 137 N -1.05 6.86 0.14 0.83 0.01 -1.26 -4.94 113.70 114.29 3d1h s SER 137 Ca 0.72 2.12 -0.08 0.00 1.31 0.00 0.00 55.95 60.03 3d1h s SER 137 Cb -0.39 -2.56 -0.01 0.00 0.21 0.00 0.00 66.02 63.26 3d1h s SER 137 CO 0.45 -0.70 0.23 -1.38 0.41 0.00 0.00 173.24 172.25 3d1h s HIS 138 N 2.22 0.42 0.00 2.43 -0.00 -1.26 -0.40 115.29 118.70 3d1h s HIS 138 Ca 0.64 -0.80 0.00 0.00 -0.00 0.00 0.00 55.06 54.89 3d1h s HIS 138 Cb -0.32 -0.13 0.00 0.00 -0.00 0.00 0.00 32.58 32.14 3d1h s HIS 138 CO 0.27 -0.65 0.00 0.41 -0.00 0.00 0.00 174.74 174.77 3d1h n GLY 139 N -0.16 0.96 2.73 -1.38 0.00 -0.07 -4.63 105.19 102.64 3d1h n GLY 139 Ca -0.09 -0.35 -0.23 0.00 0.00 0.00 0.00 46.02 45.36 3d1h n GLY 139 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d1h s TYR 140 N -1.29 0.48 -0.33 1.61 2.02 -0.10 -0.88 117.35 118.87 3d1h s TYR 140 Ca 0.00 -0.11 -0.09 0.00 -0.37 0.00 0.00 57.07 56.50 3d1h s TYR 140 Cb 0.00 -0.72 0.01 0.00 -0.40 0.00 0.00 41.96 40.85 3d1h s TYR 140 CO 0.00 -0.32 0.14 -0.51 -1.57 0.00 0.00 175.55 173.29 3d1h s LEU 141 N 2.03 4.21 -1.47 -1.29 1.02 -0.28 -1.48 118.68 121.43 3d1h s LEU 141 Ca 0.04 -0.74 -0.07 0.00 0.02 0.00 0.00 54.13 53.39 3d1h s LEU 141 Cb -0.13 -1.97 0.03 0.00 0.02 0.00 0.00 46.19 44.14 3d1h s LEU 141 CO -0.05 -0.25 0.63 0.47 0.02 0.00 0.00 176.35 177.17 3d1h n ASP 142 N 4.94 -5.43 0.00 2.29 8.00 0.13 -1.04 116.55 125.45 3d1h n ASP 142 Ca -0.13 -0.35 0.00 0.00 0.71 0.00 0.00 54.79 55.01 3d1h n ASP 142 Cb 0.48 -4.39 0.00 0.00 -0.02 0.00 0.00 41.12 37.18 3d1h n ASP 142 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3d1h n GLY 143 N -1.47 0.97 3.64 0.44 0.00 -1.26 -5.00 105.19 102.51 3d1h n GLY 143 Ca -0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 3d1h n GLY 143 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d1h s ILE 144 N -3.88 5.13 -0.15 -0.61 1.01 -0.20 -4.30 121.20 118.19 3d1h s ILE 144 Ca 0.00 0.82 -0.29 0.00 0.00 0.00 0.00 60.65 61.17 3d1h s ILE 144 Cb 0.00 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.64 3d1h s ILE 144 CO 0.00 0.17 1.63 -2.16 0.00 0.00 0.00 174.94 174.57 3d1h s PRO 145 N 1.80 3.95 0.16 2.79 0.04 -1.26 -1.12 135.00 141.36 3d1h s PRO 145 Ca 0.21 1.87 0.02 0.00 0.04 0.00 0.00 61.00 63.14 3d1h s PRO 145 Cb -0.15 -4.01 -0.05 0.00 0.04 0.00 0.00 34.50 30.33 3d1h s PRO 145 CO 0.09 -1.11 -0.03 0.14 0.04 0.00 0.00 177.00 176.13 3d1h s VAL 146 N 4.75 0.79 -0.04 -0.36 -7.23 -0.05 -0.66 120.40 117.59 3d1h s VAL 146 Ca 0.72 -1.99 -0.07 0.00 -1.81 0.00 0.00 61.98 58.83 3d1h s VAL 146 Cb -0.28 -2.01 0.01 0.00 0.56 0.00 0.00 36.38 34.66 3d1h s VAL 146 CO 0.29 -0.58 0.17 -0.94 -0.31 0.00 0.00 175.10 173.72 3d1h s SER 147 N -3.16 -0.11 -0.65 4.85 1.04 -0.56 -0.89 113.70 114.22 3d1h s SER 147 Ca 0.21 0.16 -0.27 0.00 0.48 0.00 0.00 55.95 56.52 3d1h s SER 147 Cb 0.05 0.31 0.02 0.00 0.10 0.00 0.00 66.02 66.50 3d1h s SER 147 CO 0.02 -0.18 1.37 0.86 0.98 0.00 0.00 173.24 176.29 3d1h s TRP 148 N -0.47 2.27 -0.17 5.02 -0.00 0.46 0.25 118.94 126.31 3d1h s TRP 148 Ca -0.06 0.27 -0.16 0.00 -0.00 0.00 0.00 56.10 56.16 3d1h s TRP 148 Cb -0.04 -4.48 -0.04 0.00 -0.00 0.00 0.00 33.47 28.91 3d1h s TRP 148 CO 0.01 -1.99 0.39 -0.47 -0.00 0.00 0.00 176.95 174.88 3d1h s TYR 149 N 6.06 3.44 0.39 5.86 5.04 0.37 -4.54 117.35 133.98 3d1h s TYR 149 Ca 0.45 0.68 0.08 0.00 -2.44 0.00 0.00 57.07 55.84 3d1h s TYR 149 Cb -0.09 -2.48 -0.06 0.00 0.35 0.00 0.00 41.96 39.69 3d1h s TYR 149 CO 0.20 0.11 0.12 0.20 -1.34 0.00 0.00 175.55 174.85 3d1h s GLY 150 N 0.76 2.29 0.32 8.97 0.00 -1.26 -0.74 107.32 117.65 3d1h s GLY 150 Ca 0.20 -2.10 -0.28 0.00 0.00 0.00 0.00 44.72 42.54 3d1h s GLY 150 CO 0.07 -1.93 1.24 1.18 0.00 0.00 0.00 173.10 173.66 3d1h n GLU 151 N -1.14 1.94 -1.16 2.90 1.02 -1.24 -0.16 120.64 122.80 3d1h n GLU 151 Ca -0.02 0.68 -0.06 0.00 -0.02 0.00 0.00 57.16 57.74 3d1h n GLU 151 Cb 0.64 -2.22 -0.02 0.00 -0.02 0.00 0.00 31.44 29.81 3d1h n GLU 151 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3d1h n ARG 152 N 0.75 -1.48 -3.29 3.49 1.74 -1.26 -2.19 116.66 114.42 3d1h n ARG 152 Ca 0.07 0.63 -0.23 0.00 -0.77 0.00 0.00 57.85 57.54 3d1h n ARG 152 Cb 0.35 -4.85 0.05 0.00 -1.02 0.00 0.00 32.46 26.98 3d1h n ARG 152 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3d1h n ASP 153 N -0.79 -6.11 -1.97 0.55 2.03 0.77 -4.83 116.55 106.21 3d1h n ASP 153 Ca -0.06 -0.41 -0.24 0.00 0.52 0.00 0.00 54.79 54.61 3d1h n ASP 153 Cb 0.46 -4.88 0.08 0.00 -0.72 0.00 0.00 41.12 36.06 3d1h n ASP 153 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 3d1h n TRP 154 N -4.70 2.60 0.29 -0.67 8.01 -0.93 -4.49 117.44 117.55 3d1h n TRP 154 Ca -0.06 -2.37 0.16 0.00 -1.31 0.00 0.00 57.50 53.92 3d1h n TRP 154 Cb 0.59 -0.79 0.84 0.00 -2.01 0.00 0.00 31.31 29.94 3d1h n TRP 154 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 3d1h h ALA 155 N 1.83 1.17 -0.15 6.99 0.00 -1.80 -2.39 119.26 124.89 3d1h h ALA 155 Ca 0.44 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.25 3d1h h ALA 155 Cb 1.37 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 3d1h h ALA 155 CO 1.00 0.08 -0.10 0.09 0.00 0.00 0.00 179.25 180.32 3d1h n ASN 156 N -3.41 2.71 -4.73 0.00 3.02 -1.26 -4.51 115.26 107.09 3d1h n ASN 156 Ca -0.02 -3.36 -0.42 0.00 -0.03 0.00 0.00 54.58 50.75 3d1h n ASN 156 Cb 0.21 -0.53 -0.01 0.00 -0.61 0.00 0.00 39.78 38.84 3d1h n ASN 156 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3d1h n LEU 157 N -1.05 4.04 0.00 3.41 7.94 -0.90 -2.17 117.00 128.26 3d1h n LEU 157 Ca 0.22 1.17 0.00 0.00 -1.11 0.00 0.00 56.01 56.29 3d1h n LEU 157 Cb 0.81 -1.55 0.00 0.00 0.53 0.00 0.00 43.42 43.22 3d1h n LEU 157 CO 0.08 -0.09 0.00 0.61 -1.11 0.00 0.00 177.39 176.88 3d1h n GLY 158 N 1.58 2.36 3.81 -3.96 0.00 -1.26 -4.73 105.19 103.00 3d1h n GLY 158 Ca 0.07 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 3d1h n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d1h s LYS 159 N -0.05 4.26 1.04 1.61 1.02 -0.92 -5.05 119.74 121.64 3d1h s LYS 159 Ca 0.00 0.90 -0.12 0.00 0.02 0.00 0.00 55.97 56.77 3d1h s LYS 159 Cb 0.00 -2.81 0.21 0.00 -0.52 0.00 0.00 37.83 34.71 3d1h s LYS 159 CO 0.00 0.35 1.07 -1.54 -0.92 0.00 0.00 175.35 174.31 3d1h s SER 160 N -1.72 2.18 0.36 2.83 1.04 -1.26 -4.70 113.70 112.42 3d1h s SER 160 Ca 0.45 1.44 0.04 0.00 0.48 0.00 0.00 55.95 58.37 3d1h s SER 160 Cb -0.16 -2.14 0.67 0.00 0.10 0.00 0.00 66.02 64.50 3d1h s SER 160 CO 0.21 -3.44 1.95 -0.61 0.98 0.00 0.00 173.24 172.32 3d1h h GLN 161 N -2.10 0.59 -0.01 4.02 4.15 -1.97 -0.84 115.11 118.95 3d1h h GLN 161 Ca -0.55 -0.08 0.02 0.00 0.77 0.00 0.00 58.65 58.81 3d1h h GLN 161 Cb 1.32 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.87 3d1h h GLN 161 CO 0.53 0.51 -0.14 1.25 -1.93 0.00 0.00 178.83 179.05 3d1h h HIS 162 N 0.59 -0.35 -0.39 3.99 2.76 -1.99 -0.64 115.15 119.11 3d1h h HIS 162 Ca 0.14 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.28 3d1h h HIS 162 Cb 0.15 0.16 -0.02 0.00 1.55 0.00 0.00 27.41 29.25 3d1h h HIS 162 CO 0.01 -0.20 0.06 0.93 -1.30 0.00 0.00 177.93 177.43 3d1h h GLU 163 N -0.23 0.65 -0.61 5.26 5.08 -1.85 -2.03 114.58 120.85 3d1h h GLU 163 Ca 0.05 -0.17 0.03 0.00 -1.00 0.00 0.00 59.36 58.26 3d1h h GLU 163 Cb 0.29 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.43 3d1h h GLU 163 CO -0.14 0.70 0.38 0.00 -1.00 0.00 0.00 179.01 178.95 3d1h h ALA 164 N 0.92 0.79 0.00 3.43 0.00 -0.89 -0.81 119.26 122.70 3d1h h ALA 164 Ca 0.12 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 3d1h h ALA 164 Cb 0.36 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3d1h h ALA 164 CO 0.01 0.12 -0.41 -0.07 0.00 0.00 0.00 179.25 178.90 3d1h h LEU 165 N 0.74 0.00 -0.20 0.00 -0.00 -1.04 -1.92 115.31 112.89 3d1h h LEU 165 Ca 0.24 0.00 -0.09 0.00 -0.00 0.00 0.00 57.88 58.03 3d1h h LEU 165 Cb 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.67 3d1h h LEU 165 CO -0.10 0.41 -0.24 0.00 -0.00 0.00 0.00 178.44 178.51 3d1h h ALA 166 N 1.59 0.30 -0.32 1.53 0.00 -0.76 -1.56 119.26 120.05 3d1h h ALA 166 Ca -0.00 -0.38 0.06 0.00 0.00 0.00 0.00 54.91 54.59 3d1h h ALA 166 Cb 0.73 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.41 3d1h h ALA 166 CO 0.05 0.27 -0.01 0.22 0.00 0.00 0.00 179.25 179.78 3d1h h ASP 167 N 0.19 -0.16 -0.15 0.00 1.82 -0.89 -1.29 116.42 115.95 3d1h h ASP 167 Ca 0.03 0.08 0.01 0.00 -0.39 0.00 0.00 57.03 56.76 3d1h h ASP 167 Cb 0.81 0.14 -0.02 0.00 0.68 0.00 0.00 39.33 40.94 3d1h h ASP 167 CO 0.06 -0.04 0.04 -0.08 -1.61 0.00 0.00 179.24 177.61 3d1h h GLU 168 N 0.08 0.11 -0.65 0.28 4.81 -1.30 -0.62 114.58 117.29 3d1h h GLU 168 Ca 0.16 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.37 3d1h h GLU 168 Cb 0.22 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.54 3d1h h GLU 168 CO -0.27 0.07 0.35 0.00 -0.73 0.00 0.00 179.01 178.43 3d1h h ARG 169 N 0.11 0.90 -0.15 1.92 3.08 -1.04 -0.58 114.38 118.63 3d1h h ARG 169 Ca 0.06 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 3d1h h ARG 169 Cb 0.04 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 3d1h h ARG 169 CO -0.07 0.68 0.02 0.45 -1.07 0.00 0.00 179.97 179.99 3d1h h HIS 170 N 0.88 0.27 -0.41 3.04 3.86 -1.02 -1.92 115.15 119.86 3d1h h HIS 170 Ca 0.23 -0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.37 3d1h h HIS 170 Cb 0.04 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.42 3d1h h HIS 170 CO -0.01 0.43 0.14 0.00 0.86 0.00 0.00 177.93 179.35 3d1h h ARG 171 N 0.03 0.62 -0.09 2.45 3.08 -1.00 0.01 114.38 119.47 3d1h h ARG 171 Ca 0.05 -0.13 0.01 0.00 0.07 0.00 0.00 59.98 59.98 3d1h h ARG 171 Cb 0.31 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3d1h h ARG 171 CO 0.00 0.61 0.01 -0.07 -1.07 0.00 0.00 179.97 179.46 3d1h h LEU 172 N 0.51 -0.00 -1.18 3.04 3.38 -1.10 -2.44 115.31 117.52 3d1h h LEU 172 Ca 0.13 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 3d1h h LEU 172 Cb 0.24 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3d1h h LEU 172 CO -0.01 0.01 0.02 -0.74 0.09 0.00 0.00 178.44 177.81 3d1h h HIS 173 N 0.05 0.60 0.00 1.13 2.76 -1.21 -1.96 115.15 116.53 3d1h h HIS 173 Ca 0.04 -0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 3d1h h HIS 173 Cb 0.04 -0.17 0.00 0.00 1.55 0.00 0.00 27.41 28.82 3d1h h HIS 173 CO -0.11 0.57 0.00 0.00 -1.30 0.00 0.00 177.93 177.09 3d1h h ALA 174 N 1.47 1.00 0.00 5.26 0.00 -0.57 -2.87 119.26 123.55 3d1h h ALA 174 Ca 0.12 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 3d1h h ALA 174 Cb 0.33 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3d1h h ALA 174 CO 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 179.25 179.03 3d1h h ALA 175 N 2.12 0.88 -2.66 0.00 0.00 -0.89 -3.43 119.26 115.27 3d1h h ALA 175 Ca 0.00 -0.11 -0.53 0.00 0.00 0.00 0.00 54.91 54.27 3d1h h ALA 175 Cb 0.41 -0.01 0.07 0.00 0.00 0.00 0.00 17.79 18.25 3d1h h ALA 175 CO 0.00 0.14 0.97 -0.11 0.00 0.00 0.00 179.25 180.26 3d1h n LEU 176 N -3.08 4.04 -1.24 0.00 7.94 -1.08 -1.15 117.00 122.43 3d1h n LEU 176 Ca 0.03 1.08 -0.16 0.00 -1.11 0.00 0.00 56.01 55.85 3d1h n LEU 176 Cb 0.58 -1.57 -0.07 0.00 0.53 0.00 0.00 43.42 42.89 3d1h n LEU 176 CO 0.36 0.16 -0.15 1.41 -1.11 0.00 0.00 177.39 178.05 3d1h n HIS 177 N 3.54 0.00 -4.41 1.96 8.25 0.19 -4.98 115.22 119.77 3d1h n HIS 177 Ca 0.14 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.37 3d1h n HIS 177 Cb 0.35 -2.94 -0.09 0.00 1.12 0.00 0.00 29.99 28.43 3d1h n HIS 177 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 3d1h s LYS 178 N -3.34 1.89 -0.08 -0.41 -0.14 -0.30 -4.84 119.74 112.52 3d1h s LYS 178 Ca 0.00 -1.66 -0.24 0.00 -1.36 0.00 0.00 55.97 52.71 3d1h s LYS 178 Cb 0.00 -1.90 -0.03 0.00 -1.68 0.00 0.00 37.83 34.22 3d1h s LYS 178 CO 0.00 0.33 0.74 0.99 -0.76 0.00 0.00 175.35 176.65 3d1h s THR 179 N -2.45 5.00 0.12 2.17 2.01 -1.26 -1.34 115.64 119.89 3d1h s THR 179 Ca 0.31 1.52 0.05 0.00 0.31 0.00 0.00 61.69 63.88 3d1h s THR 179 Cb -0.05 -4.08 -0.04 0.00 0.01 0.00 0.00 72.50 68.34 3d1h s THR 179 CO 0.17 0.20 -0.12 0.68 -0.69 0.00 0.00 174.62 174.86 3d1h s VAL 180 N 1.07 1.19 -0.26 3.82 -7.23 0.75 -4.96 120.40 114.78 3d1h s VAL 180 Ca 0.39 -1.71 -0.04 0.00 -1.81 0.00 0.00 61.98 58.80 3d1h s VAL 180 Cb -0.18 -1.49 0.01 0.00 0.56 0.00 0.00 36.38 35.28 3d1h s VAL 180 CO 0.18 -0.48 -0.00 -0.47 -0.31 0.00 0.00 175.10 174.02 3d1h s TYR 181 N -2.30 3.06 -0.17 2.82 5.04 -1.26 -1.22 117.35 123.32 3d1h s TYR 181 Ca 0.08 -1.12 -0.02 0.00 -2.44 0.00 0.00 57.07 53.58 3d1h s TYR 181 Cb -0.04 -2.15 -0.01 0.00 0.35 0.00 0.00 41.96 40.11 3d1h s TYR 181 CO 0.02 -0.60 -0.10 0.42 -1.34 0.00 0.00 175.55 173.94 3d1h s ILE 182 N 1.45 3.12 -0.01 3.14 1.01 -0.48 -3.75 121.20 125.68 3d1h s ILE 182 Ca 0.03 -0.61 -0.15 0.00 0.00 0.00 0.00 60.65 59.92 3d1h s ILE 182 Cb -0.16 -2.35 0.02 0.00 0.01 0.00 0.00 42.46 39.98 3d1h s ILE 182 CO -0.01 0.49 0.31 0.00 0.00 0.00 0.00 174.94 175.73 3d1h s ALA 183 N 0.83 -0.78 0.55 9.38 0.00 -0.85 -1.10 121.76 129.79 3d1h s ALA 183 Ca -0.03 0.29 -0.08 0.00 0.00 0.00 0.00 51.96 52.13 3d1h s ALA 183 Cb -0.15 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 3d1h s ALA 183 CO 0.01 -0.29 0.91 -1.25 0.00 0.00 0.00 175.76 175.14 3d1h s PRO 184 N -1.52 3.58 0.11 0.00 0.04 -1.26 -1.38 135.00 134.58 3d1h s PRO 184 Ca -0.12 0.49 -0.15 0.00 0.04 0.00 0.00 61.00 61.25 3d1h s PRO 184 Cb -0.04 -2.23 -0.07 0.00 0.04 0.00 0.00 34.50 32.20 3d1h s PRO 184 CO 0.03 -0.38 0.53 -0.51 0.04 0.00 0.00 177.00 176.72 3d1h s LEU 185 N -4.92 4.40 0.00 -3.56 1.43 -1.26 -2.35 118.68 112.42 3d1h s LEU 185 Ca 0.51 1.10 0.00 0.00 -1.03 0.00 0.00 54.13 54.71 3d1h s LEU 185 Cb -0.11 -3.10 0.00 0.00 0.03 0.00 0.00 46.19 43.01 3d1h s LEU 185 CO 0.49 0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.84 3d1h n GLY 186 N 1.11 2.17 3.71 -3.19 0.00 -0.34 -4.89 105.19 103.77 3d1h n GLY 186 Ca -0.07 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 3d1h n GLY 186 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d1h s LYS 187 N 3.53 4.14 -1.71 1.61 0.00 -1.26 -2.34 119.74 123.71 3d1h s LYS 187 Ca 0.00 2.58 0.00 0.00 0.00 0.00 0.00 55.97 58.55 3d1h s LYS 187 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 37.83 34.64 3d1h s LYS 187 CO 0.00 -0.76 0.00 0.72 0.00 0.00 0.00 175.35 175.31 3d1h n HIS 188 N 4.35 -0.83 -2.89 1.78 8.25 -1.26 -2.77 115.22 121.85 3d1h n HIS 188 Ca 0.16 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.43 3d1h n HIS 188 Cb 0.36 -3.73 0.03 0.00 1.12 0.00 0.00 29.99 27.77 3d1h n HIS 188 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3d1h n LYS 189 N -2.83 -4.15 -4.39 -0.41 4.76 -0.99 -5.01 118.16 105.14 3d1h n LYS 189 Ca -0.23 0.81 -0.29 0.00 -2.87 0.00 0.00 58.31 55.73 3d1h n LYS 189 Cb 0.67 -5.43 -0.13 0.00 -1.84 0.00 0.00 35.03 28.30 3d1h n LYS 189 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3d1h s LEU 190 N -5.87 2.35 0.39 -0.35 1.43 -1.11 -4.85 118.68 110.66 3d1h s LEU 190 Ca 0.25 -0.74 -0.24 0.00 -1.03 0.00 0.00 54.13 52.37 3d1h s LEU 190 Cb -0.11 -1.24 -0.13 0.00 0.03 0.00 0.00 46.19 44.75 3d1h s LEU 190 CO 0.31 0.18 0.69 -2.65 0.23 0.00 0.00 176.35 175.11 3d1h n PRO 191 N 0.87 0.77 -3.41 1.29 -0.02 -1.26 -1.19 135.00 132.05 3d1h n PRO 191 Ca -0.18 0.28 -0.13 0.00 -2.02 0.00 0.00 63.50 61.45 3d1h n PRO 191 Cb 0.53 -1.61 -0.10 0.00 -0.02 0.00 0.00 33.50 32.30 3d1h n PRO 191 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3d1h s GLU 192 N -1.63 0.29 4.94 -0.52 2.12 -0.99 -4.71 118.70 118.20 3d1h s GLU 192 Ca 0.63 0.37 0.00 0.00 0.36 0.00 0.00 54.97 56.33 3d1h s GLU 192 Cb -0.63 -0.76 0.00 0.00 0.26 0.00 0.00 34.13 33.00 3d1h s GLU 192 CO 0.58 -0.67 0.00 0.41 -0.54 0.00 0.00 175.26 175.03 3d1h n GLY 193 N 5.34 1.64 0.00 -1.50 0.00 -1.26 -4.31 105.19 105.11 3d1h n GLY 193 Ca -0.04 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.33 3d1h n GLY 193 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d1h n GLY 194 N 0.00 -0.50 3.29 -0.02 0.00 -1.26 -4.70 105.19 101.99 3d1h n GLY 194 Ca 0.00 -1.93 -0.10 0.00 0.00 0.00 0.00 46.02 43.99 3d1h n GLY 194 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3d1h s GLU 195 N 0.00 1.02 -0.09 1.61 -1.05 -0.26 -5.00 118.70 114.93 3d1h s GLU 195 Ca 0.00 -0.75 0.04 0.00 -0.15 0.00 0.00 54.97 54.11 3d1h s GLU 195 Cb 0.00 0.44 -0.01 0.00 -0.44 0.00 0.00 34.13 34.12 3d1h s GLU 195 CO 0.00 -0.38 -0.22 0.08 0.95 0.00 0.00 175.26 175.69 3d1h s VAL 196 N -3.78 2.32 0.10 1.83 1.01 -1.26 -1.38 120.40 119.24 3d1h s VAL 196 Ca 0.03 -0.95 -0.15 0.00 0.00 0.00 0.00 61.98 60.91 3d1h s VAL 196 Cb 0.02 -1.89 0.03 0.00 0.00 0.00 0.00 36.38 34.54 3d1h s VAL 196 CO -0.12 0.56 0.37 0.00 0.00 0.00 0.00 175.10 175.91 3d1h s ARG 197 N 0.08 0.99 -0.43 2.72 1.70 -0.36 -4.97 118.95 118.67 3d1h s ARG 197 Ca -0.10 -0.66 -0.16 0.00 -0.47 0.00 0.00 55.73 54.35 3d1h s ARG 197 Cb -0.15 0.43 0.04 0.00 -0.57 0.00 0.00 34.95 34.69 3d1h s ARG 197 CO 0.06 -0.36 0.37 0.50 -1.08 0.00 0.00 175.30 174.78 3d1h s ARG 198 N -3.46 3.00 0.07 3.89 3.52 -1.26 -0.18 118.95 124.54 3d1h s ARG 198 Ca 0.01 -1.06 -0.31 0.00 -0.13 0.00 0.00 55.73 54.24 3d1h s ARG 198 Cb 0.02 -4.03 -0.08 0.00 -1.56 0.00 0.00 34.95 29.30 3d1h s ARG 198 CO -0.09 -0.87 1.62 0.08 -0.81 0.00 0.00 175.30 175.23 3d1h s VAL 199 N 1.79 3.07 -0.46 7.11 1.01 -0.45 -4.89 120.40 127.59 3d1h s VAL 199 Ca 0.06 0.55 0.13 0.00 0.00 0.00 0.00 61.98 62.72 3d1h s VAL 199 Cb -0.20 -3.35 -0.16 0.00 0.00 0.00 0.00 36.38 32.67 3d1h s VAL 199 CO 0.10 0.00 0.49 0.00 0.00 0.00 0.00 175.10 175.69 3d1h n GLN 200 N 5.41 2.01 -3.77 2.72 1.13 -1.26 0.55 117.38 124.17 3d1h n GLN 200 Ca 0.15 -0.03 -0.13 0.00 -1.94 0.00 0.00 57.00 55.05 3d1h n GLN 200 Cb 0.41 -1.18 -0.13 0.00 0.11 0.00 0.00 30.24 29.45 3d1h n GLN 200 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 3d1h s LYS 201 N -2.44 0.21 -0.06 -1.09 2.20 -1.26 -4.89 119.74 112.40 3d1h s LYS 201 Ca 0.02 0.38 0.03 0.00 -0.36 0.00 0.00 55.97 56.05 3d1h s LYS 201 Cb 0.10 -0.01 0.00 0.00 -1.51 0.00 0.00 37.83 36.41 3d1h s LYS 201 CO 0.55 -0.10 -0.16 0.08 -0.36 0.00 0.00 175.35 175.36 3d1h s VAL 202 N 0.67 1.43 0.02 4.02 1.01 -1.26 -0.70 120.40 125.59 3d1h s VAL 202 Ca -0.05 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.26 3d1h s VAL 202 Cb -0.06 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 3d1h s VAL 202 CO -0.04 0.42 -0.03 -1.10 0.00 0.00 0.00 175.10 174.35 3d1h s GLN 203 N 0.35 0.29 0.50 2.72 -0.21 -0.55 -5.01 119.66 117.74 3d1h s GLN 203 Ca -0.11 -0.51 -0.03 0.00 0.02 0.00 0.00 55.36 54.73 3d1h s GLN 203 Cb -0.14 0.03 -0.01 0.00 1.00 0.00 0.00 33.01 33.89 3d1h s GLN 203 CO 0.04 -0.03 0.76 0.95 -2.12 0.00 0.00 175.29 174.90 3d1h s THR 204 N -1.17 4.11 0.43 -0.19 -4.23 -1.26 -0.93 115.64 112.40 3d1h s THR 204 Ca -0.12 -0.20 0.19 0.00 -1.18 0.00 0.00 61.69 60.38 3d1h s THR 204 Cb -0.08 -3.56 0.22 0.00 1.34 0.00 0.00 72.50 70.41 3d1h s THR 204 CO -0.01 -0.49 2.01 -0.08 -0.54 0.00 0.00 174.62 175.52 3d1h h GLU 205 N 0.19 0.00 -0.45 3.99 4.81 -1.92 -2.08 114.58 119.12 3d1h h GLU 205 Ca -0.46 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.77 3d1h h GLU 205 Cb 1.24 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.60 3d1h h GLU 205 CO 0.59 0.17 0.27 0.37 -0.73 0.00 0.00 179.01 179.69 3d1h h GLN 206 N 0.00 0.62 -0.44 1.92 4.15 -1.98 0.65 115.11 120.04 3d1h h GLN 206 Ca -0.00 -0.06 -0.05 0.00 0.77 0.00 0.00 58.65 59.31 3d1h h GLN 206 Cb 0.35 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.90 3d1h h GLN 206 CO 0.02 0.45 0.09 0.93 -1.93 0.00 0.00 178.83 178.39 3d1h h GLU 207 N 0.60 0.71 -0.57 1.69 5.08 -1.83 -0.21 114.58 120.05 3d1h h GLU 207 Ca 0.16 -0.18 -0.05 0.00 -1.00 0.00 0.00 59.36 58.29 3d1h h GLU 207 Cb -0.00 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 3d1h h GLU 207 CO -0.03 0.73 0.16 0.28 -1.00 0.00 0.00 179.01 179.15 3d1h h VAL 208 N 0.58 1.23 -0.03 3.13 2.07 -0.94 -0.85 116.25 121.44 3d1h h VAL 208 Ca 0.13 -0.81 -0.00 0.00 0.82 0.00 0.00 66.70 66.84 3d1h h VAL 208 Cb 0.35 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.74 3d1h h VAL 208 CO 0.01 0.31 0.01 0.00 0.02 0.00 0.00 177.57 177.91 3d1h h ALA 209 N 1.33 0.04 -0.63 1.67 0.00 0.63 -2.57 119.26 119.73 3d1h h ALA 209 Ca 0.19 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 55.00 3d1h h ALA 209 Cb 0.28 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 3d1h h ALA 209 CO -0.00 -0.32 0.38 0.93 0.00 0.00 0.00 179.25 180.23 3d1h h GLU 210 N -0.20 0.70 0.00 0.00 5.08 -0.83 0.50 114.58 119.83 3d1h h GLU 210 Ca 0.01 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3d1h h GLU 210 Cb 0.27 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.36 3d1h h GLU 210 CO 0.00 0.47 -0.00 0.00 -1.00 0.00 0.00 179.01 178.48 3d1h h ALA 211 N 1.29 1.03 -0.43 3.43 0.00 -1.10 0.17 119.26 123.64 3d1h h ALA 211 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3d1h h ALA 211 Cb 0.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3d1h h ALA 211 CO -0.12 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.13 3d1h n ALA 212 N -2.09 2.42 -1.29 0.00 0.00 0.07 -4.94 120.51 114.68 3d1h n ALA 212 Ca -0.03 -0.99 -0.00 0.00 0.00 0.00 0.00 53.44 52.42 3d1h n ALA 212 Cb 0.09 -0.92 -0.00 0.00 0.00 0.00 0.00 19.45 18.62 3d1h n ALA 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d1h n GLY 213 N 1.48 0.40 3.44 0.00 0.00 0.59 -4.84 105.19 106.26 3d1h n GLY 213 Ca 0.20 -1.02 -0.31 0.00 0.00 0.00 0.00 46.02 44.89 3d1h n GLY 213 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3d1h s MET 214 N -2.59 2.00 0.74 1.61 -1.94 -0.65 -4.70 119.30 113.77 3d1h s MET 214 Ca 0.00 -1.02 -0.11 0.00 -1.71 0.00 0.00 55.69 52.85 3d1h s MET 214 Cb 0.00 -2.14 0.04 0.00 2.01 0.00 0.00 34.83 34.73 3d1h s MET 214 CO 0.00 0.53 1.08 1.03 -0.01 0.00 0.00 175.02 177.65 3d1h s ARG 215 N -1.45 2.54 -0.04 2.03 0.52 0.21 -3.44 118.95 119.33 3d1h s ARG 215 Ca 0.14 0.73 0.04 0.00 -0.52 0.00 0.00 55.73 56.12 3d1h s ARG 215 Cb -0.10 -1.96 -0.01 0.00 0.52 0.00 0.00 34.95 33.40 3d1h s ARG 215 CO 0.05 -1.32 -0.17 -0.47 0.02 0.00 0.00 175.30 173.41 3d1h s TYR 216 N -3.14 1.64 -0.08 -0.53 5.04 -1.26 0.29 117.35 119.31 3d1h s TYR 216 Ca 0.59 -0.43 -0.03 0.00 -2.44 0.00 0.00 57.07 54.76 3d1h s TYR 216 Cb -0.14 -1.10 0.04 0.00 0.35 0.00 0.00 41.96 41.12 3d1h s TYR 216 CO 0.54 -0.13 0.15 0.12 -1.34 0.00 0.00 175.55 174.89 3d1h s PHE 217 N -0.05 -0.16 -0.15 4.97 5.36 -0.58 -4.94 117.98 122.43 3d1h s PHE 217 Ca -0.01 0.56 -0.06 0.00 -0.96 0.00 0.00 56.93 56.46 3d1h s PHE 217 Cb -0.10 -0.23 -0.04 0.00 -0.34 0.00 0.00 43.02 42.31 3d1h s PHE 217 CO 0.01 -0.24 0.04 0.50 -1.46 0.00 0.00 175.22 174.08 3d1h s ARG 218 N 2.01 3.65 -0.24 10.12 6.06 -1.26 -1.30 118.95 137.99 3d1h s ARG 218 Ca 0.00 -0.36 0.00 0.00 -2.50 0.00 0.00 55.73 52.88 3d1h s ARG 218 Cb -0.12 -3.07 0.07 0.00 0.06 0.00 0.00 34.95 31.88 3d1h s ARG 218 CO -0.06 0.43 -0.02 0.42 -2.50 0.00 0.00 175.30 173.57 3d1h s ILE 219 N -0.08 1.34 -1.26 4.11 1.01 0.57 -4.98 121.20 121.91 3d1h s ILE 219 Ca 0.06 -1.21 -0.19 0.00 0.00 0.00 0.00 60.65 59.31 3d1h s ILE 219 Cb -0.12 -1.71 0.01 0.00 0.01 0.00 0.00 42.46 40.64 3d1h s ILE 219 CO 0.01 -0.21 1.85 0.00 0.00 0.00 0.00 174.94 176.59 3d1h n ALA 220 N 4.72 3.27 -2.64 9.38 0.00 -1.26 -3.27 120.51 130.72 3d1h n ALA 220 Ca -0.09 -3.60 -0.37 0.00 0.00 0.00 0.00 53.44 49.37 3d1h n ALA 220 Cb 0.44 -3.57 -0.06 0.00 0.00 0.00 0.00 19.45 16.26 3d1h n ALA 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d1h s ALA 221 N 6.03 3.64 0.14 0.00 0.00 -0.86 -4.48 121.76 126.23 3d1h s ALA 221 Ca 0.57 -0.31 -0.30 0.00 0.00 0.00 0.00 51.96 51.92 3d1h s ALA 221 Cb 0.04 -2.40 -0.07 0.00 0.00 0.00 0.00 23.12 20.69 3d1h s ALA 221 CO 0.08 0.30 1.16 0.99 0.00 0.00 0.00 175.76 178.29 3d1h s THR 222 N -0.35 3.82 0.45 0.00 2.01 -1.26 -1.46 115.64 118.85 3d1h s THR 222 Ca 0.21 1.47 -0.24 0.00 0.31 0.00 0.00 61.69 63.44 3d1h s THR 222 Cb -0.15 -3.94 -0.09 0.00 0.01 0.00 0.00 72.50 68.33 3d1h s THR 222 CO 0.09 0.20 1.18 -0.67 -0.69 0.00 0.00 174.62 174.73 3d1h n ASP 223 N 2.91 2.03 0.00 3.53 4.64 -1.26 -3.16 116.55 125.24 3d1h n ASP 223 Ca 0.05 1.05 0.00 0.00 -1.38 0.00 0.00 54.79 54.51 3d1h n ASP 223 Cb 0.46 -1.46 0.00 0.00 -1.04 0.00 0.00 41.12 39.08 3d1h n ASP 223 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 3d1h n HIS 224 N -0.51 0.00 -4.47 -0.67 8.25 -1.26 -4.98 115.22 111.57 3d1h n HIS 224 Ca 0.08 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.32 3d1h n HIS 224 Cb 0.41 -0.34 -0.11 0.00 1.12 0.00 0.00 29.99 31.07 3d1h n HIS 224 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 3d1h s VAL 225 N -2.58 1.42 0.12 1.59 -7.23 -1.19 -4.80 120.40 107.74 3d1h s VAL 225 Ca 0.00 -2.03 -0.31 0.00 -1.81 0.00 0.00 61.98 57.83 3d1h s VAL 225 Cb 0.00 -2.75 -0.09 0.00 0.56 0.00 0.00 36.38 34.10 3d1h s VAL 225 CO 0.00 -0.07 1.56 0.86 -0.31 0.00 0.00 175.10 177.15 3d1h s TRP 226 N -3.14 2.88 0.44 2.82 -0.11 -1.26 -4.83 118.94 115.75 3d1h s TRP 226 Ca 0.35 0.58 -0.23 0.00 1.22 0.00 0.00 56.10 58.02 3d1h s TRP 226 Cb 0.08 -3.89 -0.11 0.00 -1.50 0.00 0.00 33.47 28.05 3d1h s TRP 226 CO 0.15 -3.37 0.82 -2.30 -4.62 0.00 0.00 176.95 167.62 3d1h n PRO 227 N 4.54 0.98 -1.64 5.86 -0.02 -1.26 -4.94 135.00 138.51 3d1h n PRO 227 Ca 0.14 0.36 -0.30 0.00 -2.02 0.00 0.00 63.50 61.68 3d1h n PRO 227 Cb 0.40 -1.84 0.07 0.00 -0.02 0.00 0.00 33.50 32.11 3d1h n PRO 227 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3d1h s THR 228 N -1.39 3.34 0.41 3.45 -4.23 -1.26 -4.80 115.64 111.16 3d1h s THR 228 Ca 0.65 0.43 0.11 0.00 -1.18 0.00 0.00 61.69 61.70 3d1h s THR 228 Cb -0.56 -3.24 0.31 0.00 1.34 0.00 0.00 72.50 70.35 3d1h s THR 228 CO 0.56 -0.57 1.98 -0.65 -0.54 0.00 0.00 174.62 175.41 3d1h h PRO 229 N -0.92 0.49 -0.26 3.99 0.11 -1.92 -1.00 132.00 132.49 3d1h h PRO 229 Ca -0.46 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 3d1h h PRO 229 Cb 1.25 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 3d1h h PRO 229 CO 0.60 0.33 0.09 0.93 -0.21 0.00 0.00 178.00 179.74 3d1h h GLU 230 N 0.51 0.40 0.06 1.05 3.07 -1.99 0.96 114.58 118.64 3d1h h GLU 230 Ca 0.27 -0.08 0.01 0.00 -0.50 0.00 0.00 59.36 59.07 3d1h h GLU 230 Cb 0.41 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.24 3d1h h GLU 230 CO -0.08 0.45 -0.12 -0.91 -1.40 0.00 0.00 179.01 176.95 3d1h h ASN 231 N 0.27 -0.33 -0.59 1.42 2.35 -1.60 -1.84 115.58 115.25 3d1h h ASN 231 Ca 0.09 0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.79 3d1h h ASN 231 Cb 0.21 0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.68 3d1h h ASN 231 CO -0.01 -0.18 0.05 0.40 -1.65 0.00 0.00 177.43 176.05 3d1h h ILE 232 N -0.23 1.26 -0.58 2.81 2.04 -1.15 -1.29 117.51 120.37 3d1h h ILE 232 Ca 0.02 -1.07 0.03 0.00 1.00 0.00 0.00 64.86 64.84 3d1h h ILE 232 Cb 0.26 0.74 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 3d1h h ILE 232 CO -0.08 0.39 0.35 0.44 0.00 0.00 0.00 178.15 179.25 3d1h h ASP 233 N 0.95 0.56 -0.69 1.72 3.32 -0.60 0.36 116.42 122.04 3d1h h ASP 233 Ca 0.18 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 57.17 3d1h h ASP 233 Cb 0.48 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.89 3d1h h ASP 233 CO 0.02 0.39 0.19 -0.09 -1.72 0.00 0.00 179.24 178.04 3d1h h ARG 234 N 0.68 1.10 -0.39 3.56 2.43 -1.07 -1.90 114.38 118.79 3d1h h ARG 234 Ca 0.24 -0.25 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 3d1h h ARG 234 Cb 0.04 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.42 3d1h h ARG 234 CO -0.11 0.95 0.04 0.35 -1.51 0.00 0.00 179.97 179.70 3d1h h PHE 235 N 1.05 0.71 -0.64 2.20 3.57 -0.65 -1.78 116.94 121.40 3d1h h PHE 235 Ca 0.22 -0.11 -0.05 0.00 3.53 0.00 0.00 57.97 61.56 3d1h h PHE 235 Cb 0.33 -0.19 -0.03 0.00 2.79 0.00 0.00 35.95 38.85 3d1h h PHE 235 CO 0.03 0.72 0.20 -0.07 -2.23 0.00 0.00 178.31 176.95 3d1h h LEU 236 N 0.50 0.94 -0.74 0.59 3.38 -0.74 0.75 115.31 119.99 3d1h h LEU 236 Ca 0.12 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 3d1h h LEU 236 Cb 0.41 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 3d1h h LEU 236 CO 0.01 0.90 0.33 0.00 0.09 0.00 0.00 178.44 179.77 3d1h h ALA 237 N 1.07 0.96 -0.14 1.53 0.00 -1.25 -1.57 119.26 119.85 3d1h h ALA 237 Ca 0.21 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3d1h h ALA 237 Cb 0.30 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3d1h h ALA 237 CO -0.01 0.55 0.09 0.35 0.00 0.00 0.00 179.25 180.23 3d1h h PHE 238 N 1.05 0.17 -0.89 0.00 3.04 -0.95 -2.98 116.94 116.39 3d1h h PHE 238 Ca 0.25 0.00 0.04 0.00 3.98 0.00 0.00 57.97 62.25 3d1h h PHE 238 Cb 0.16 -0.06 -0.06 0.00 2.56 0.00 0.00 35.95 38.56 3d1h h PHE 238 CO 0.01 0.11 0.57 -0.92 -2.02 0.00 0.00 178.31 176.06 3d1h h TYR 239 N 0.19 1.06 -0.11 0.41 3.20 -0.55 -2.79 116.97 118.38 3d1h h TYR 239 Ca 0.05 0.03 0.01 0.00 3.14 0.00 0.00 58.73 61.96 3d1h h TYR 239 Cb -0.02 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 37.90 3d1h h TYR 239 CO -0.07 0.59 0.08 -0.09 -1.64 0.00 0.00 178.16 177.03 3d1h h ARG 240 N 1.09 0.12 -0.60 1.82 2.43 -1.13 -2.64 114.38 115.47 3d1h h ARG 240 Ca 0.36 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.53 3d1h h ARG 240 Cb 0.05 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.57 3d1h h ARG 240 CO -0.13 0.08 0.00 0.25 -1.51 0.00 0.00 179.97 178.66 3d1h n THR 241 N -4.52 1.19 -2.44 0.20 -2.24 -1.06 -4.99 114.28 100.42 3d1h n THR 241 Ca -0.01 -1.06 -0.37 0.00 -2.27 0.00 0.00 64.05 60.34 3d1h n THR 241 Cb 0.10 0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 3d1h n THR 241 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3d1h s LEU 242 N -1.21 4.12 0.64 3.22 1.43 -1.00 -5.00 118.68 120.88 3d1h s LEU 242 Ca 0.42 2.14 -0.17 0.00 -1.03 0.00 0.00 54.13 55.49 3d1h s LEU 242 Cb 0.23 -4.18 -0.01 0.00 0.03 0.00 0.00 46.19 42.27 3d1h s LEU 242 CO 0.26 -0.62 1.20 -2.84 0.23 0.00 0.00 176.35 174.58 3d1h s PRO 243 N -2.52 2.73 0.40 1.29 0.02 -1.26 -4.89 135.00 130.77 3d1h s PRO 243 Ca 0.59 1.76 0.14 0.00 0.02 0.00 0.00 61.00 63.50 3d1h s PRO 243 Cb -0.25 -1.91 0.98 0.00 0.02 0.00 0.00 34.50 33.34 3d1h s PRO 243 CO 0.31 -1.38 1.90 0.37 -0.33 0.00 0.00 177.00 177.87 3d1h h GLN 244 N 0.47 0.49 -0.65 5.54 4.15 -2.00 -1.31 115.11 121.80 3d1h h GLN 244 Ca -0.49 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.90 3d1h h GLN 244 Cb 1.29 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.87 3d1h h GLN 244 CO 0.54 0.33 0.00 -0.40 -1.93 0.00 0.00 178.83 177.36 3d1h n ASP 245 N -4.51 4.28 -4.77 -0.69 5.75 -1.26 -4.96 116.55 110.39 3d1h n ASP 245 Ca 0.16 -2.53 -0.40 0.00 -0.01 0.00 0.00 54.79 52.00 3d1h n ASP 245 Cb 0.52 -0.58 -0.01 0.00 -1.03 0.00 0.00 41.12 40.03 3d1h n ASP 245 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3d1h s ALA 246 N -2.07 3.33 -0.17 2.12 0.00 -0.50 -4.04 121.76 120.43 3d1h s ALA 246 Ca 0.42 1.25 -0.02 0.00 0.00 0.00 0.00 51.96 53.61 3d1h s ALA 246 Cb 0.29 -3.49 -0.01 0.00 0.00 0.00 0.00 23.12 19.92 3d1h s ALA 246 CO 0.16 -0.78 -0.10 -0.46 0.00 0.00 0.00 175.76 174.58 3d1h s TRP 247 N -1.23 2.88 -0.27 0.00 -0.11 -0.20 -4.87 118.94 115.15 3d1h s TRP 247 Ca 0.55 -0.87 -0.08 0.00 1.22 0.00 0.00 56.10 56.92 3d1h s TRP 247 Cb -0.39 -1.96 -0.02 0.00 -1.50 0.00 0.00 33.47 29.59 3d1h s TRP 247 CO 0.50 -0.41 0.10 -0.51 -4.62 0.00 0.00 176.95 172.01 3d1h s LEU 248 N 0.92 3.67 -0.47 5.86 1.43 -0.90 -0.55 118.68 128.65 3d1h s LEU 248 Ca -0.02 -0.28 -0.13 0.00 -1.03 0.00 0.00 54.13 52.68 3d1h s LEU 248 Cb -0.15 -1.96 0.10 0.00 0.03 0.00 0.00 46.19 44.21 3d1h s LEU 248 CO -0.00 -0.08 0.37 -2.28 0.23 0.00 0.00 176.35 174.59 3d1h s HIS 249 N 1.63 3.31 0.31 0.29 5.65 0.31 -0.93 115.29 125.85 3d1h s HIS 249 Ca 0.06 -1.37 -0.12 0.00 0.25 0.00 0.00 55.06 53.88 3d1h s HIS 249 Cb -0.16 -3.32 -0.08 0.00 -1.18 0.00 0.00 32.58 27.84 3d1h s HIS 249 CO 0.05 -0.90 0.68 -0.06 -0.65 0.00 0.00 174.74 173.86 3d1h s PHE 250 N 1.52 3.41 0.02 3.88 0.08 0.30 -0.45 117.98 126.73 3d1h s PHE 250 Ca 0.04 1.06 -0.28 0.00 0.12 0.00 0.00 56.93 57.88 3d1h s PHE 250 Cb -0.26 -2.42 0.09 0.00 -0.57 0.00 0.00 43.02 39.86 3d1h s PHE 250 CO 0.03 0.10 0.75 -3.38 -0.10 0.00 0.00 175.22 172.62 3d1h s HIS 251 N -2.02 -0.50 0.00 0.36 -3.43 -0.85 -1.95 115.29 106.90 3d1h s HIS 251 Ca 0.51 0.56 0.00 0.00 -0.80 0.00 0.00 55.06 55.33 3d1h s HIS 251 Cb -0.10 0.50 0.00 0.00 -1.43 0.00 0.00 32.58 31.54 3d1h s HIS 251 CO 0.22 -0.64 0.00 0.00 -2.00 0.00 0.00 174.74 172.32 3d1h h GLU 253 N 0.00 0.00 0.00 0.00 4.57 -1.92 -2.69 114.58 114.54 3d1h h GLU 253 Ca 0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 3d1h h GLU 253 Cb 0.00 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.59 3d1h h GLU 253 CO 0.00 0.36 -1.09 0.00 -1.18 0.00 0.00 179.01 177.10 3d1h n ALA 254 N -2.76 2.47 -1.31 2.92 0.00 -1.26 -0.96 120.51 119.61 3d1h n ALA 254 Ca -0.04 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.12 3d1h n ALA 254 Cb 0.18 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.56 3d1h n ALA 254 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d1h n GLY 255 N 1.21 0.47 0.56 0.00 0.00 -1.25 -4.05 105.19 102.12 3d1h n GLY 255 Ca -0.01 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.09 3d1h n GLY 255 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3d1h n VAL 256 N -3.27 0.00 0.20 1.61 0.31 -1.26 -4.59 118.33 111.33 3d1h n VAL 256 Ca 0.00 0.08 -0.08 0.00 -0.01 0.00 0.00 64.34 64.33 3d1h n VAL 256 Cb 0.20 -0.97 -0.04 0.00 -0.91 0.00 0.00 33.84 32.12 3d1h n VAL 256 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3d1h h GLY 257 N 0.00 -0.53 0.95 2.92 0.00 -1.99 -1.59 103.07 102.82 3d1h h GLY 257 Ca 0.00 0.20 -0.06 0.00 0.00 0.00 0.00 47.33 47.47 3d1h h GLY 257 CO 0.00 -0.19 0.01 3.21 0.00 0.00 0.00 176.54 179.57 3d1h h ARG 258 N -0.53 0.70 -0.17 4.80 3.08 -1.93 -2.36 114.38 117.96 3d1h h ARG 258 Ca -0.05 -0.22 0.04 0.00 0.07 0.00 0.00 59.98 59.82 3d1h h ARG 258 Cb 0.39 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.34 3d1h h ARG 258 CO 0.09 0.78 -0.08 1.15 -1.07 0.00 0.00 179.97 180.84 3d1h h THR 259 N 0.53 0.75 -0.45 2.04 2.02 -1.85 -2.43 112.91 113.52 3d1h h THR 259 Ca 0.12 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.20 3d1h h THR 259 Cb 0.45 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 3d1h h THR 259 CO 0.02 0.00 -0.10 0.74 0.37 0.00 0.00 175.52 176.55 3d1h h THR 260 N -0.05 1.26 -0.27 3.16 2.02 -1.27 -1.33 112.91 116.42 3d1h h THR 260 Ca 0.09 -1.17 0.06 0.00 0.77 0.00 0.00 66.41 66.17 3d1h h THR 260 Cb 0.19 1.02 -0.06 0.00 -1.74 0.00 0.00 68.15 67.56 3d1h h THR 260 CO -0.21 0.40 -0.13 0.00 0.37 0.00 0.00 175.52 175.95 3d1h h ALA 261 N 1.15 0.09 -0.08 6.16 0.00 -0.95 0.33 119.26 125.96 3d1h h ALA 261 Ca 0.12 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 3d1h h ALA 261 Cb 0.59 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3d1h h ALA 261 CO 0.04 -0.53 -0.58 0.74 0.00 0.00 0.00 179.25 178.91 3d1h h PHE 262 N -0.10 0.33 -0.63 0.00 0.04 -1.37 -0.51 116.94 114.70 3d1h h PHE 262 Ca 0.14 -0.12 -0.04 0.00 2.80 0.00 0.00 57.97 60.75 3d1h h PHE 262 Cb 0.31 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 3d1h h PHE 262 CO -0.32 0.77 0.23 0.52 -0.60 0.00 0.00 178.31 178.91 3d1h h MET 263 N 0.20 0.95 -0.15 1.51 2.86 -0.52 -0.05 114.93 119.73 3d1h h MET 263 Ca -0.00 -0.19 -0.01 0.00 -2.06 0.00 0.00 59.70 57.44 3d1h h MET 263 Cb 1.07 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.58 3d1h h MET 263 CO 0.09 0.82 0.07 0.28 1.06 0.00 0.00 176.91 179.23 3d1h h VAL 264 N 0.88 1.14 -0.63 -2.22 2.07 -0.08 -0.51 116.25 116.90 3d1h h VAL 264 Ca 0.21 -0.41 0.07 0.00 0.82 0.00 0.00 66.70 67.38 3d1h h VAL 264 Cb 0.24 1.13 -0.06 0.00 -1.52 0.00 0.00 31.29 31.09 3d1h h VAL 264 CO -0.01 0.13 0.32 0.24 0.02 0.00 0.00 177.57 178.27 3d1h h MET 265 N 0.10 0.58 -0.76 1.57 2.07 -0.95 -0.23 114.93 117.31 3d1h h MET 265 Ca 0.05 -0.03 -0.05 0.00 -2.07 0.00 0.00 59.70 57.59 3d1h h MET 265 Cb 0.14 -0.13 -0.03 0.00 -1.87 0.00 0.00 31.60 29.71 3d1h h MET 265 CO -0.01 0.38 0.27 1.15 1.07 0.00 0.00 176.91 179.78 3d1h h THR 266 N 0.59 1.26 -0.33 2.22 2.02 -0.68 -0.50 112.91 117.49 3d1h h THR 266 Ca 0.29 -0.87 -0.00 0.00 0.77 0.00 0.00 66.41 66.60 3d1h h THR 266 Cb 0.23 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.01 3d1h h THR 266 CO -0.21 0.35 0.19 -0.78 0.37 0.00 0.00 175.52 175.44 3d1h h ASP 267 N 1.12 0.40 -0.66 4.18 1.82 -0.18 -0.14 116.42 122.96 3d1h h ASP 267 Ca 0.25 -0.07 -0.04 0.00 -0.39 0.00 0.00 57.03 56.77 3d1h h ASP 267 Cb 0.26 -0.10 -0.03 0.00 0.68 0.00 0.00 39.33 40.14 3d1h h ASP 267 CO -0.01 0.36 0.24 0.24 -1.61 0.00 0.00 179.24 178.46 3d1h h MET 268 N 0.41 1.00 -0.08 0.28 2.86 -0.78 0.13 114.93 118.76 3d1h h MET 268 Ca 0.12 -0.20 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 3d1h h MET 268 Cb 0.04 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 31.54 3d1h h MET 268 CO -0.02 0.85 0.03 -0.07 1.06 0.00 0.00 176.91 178.76 3d1h h LEU 269 N 0.94 0.11 -0.04 1.22 3.38 -0.88 -2.51 115.31 117.53 3d1h h LEU 269 Ca 0.22 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3d1h h LEU 269 Cb 0.24 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 3d1h h LEU 269 CO -0.01 0.27 -0.09 0.50 0.09 0.00 0.00 178.44 179.19 3d1h h LYS 270 N -0.06 0.00 -2.08 1.13 3.64 -0.92 -3.37 116.57 114.92 3d1h h LYS 270 Ca 0.02 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.88 3d1h h LYS 270 Cb 0.20 0.00 -0.40 0.00 -0.41 0.00 0.00 32.23 31.61 3d1h h LYS 270 CO -0.00 0.09 -1.02 0.09 -2.27 0.00 0.00 179.45 176.34 3d1h n ASN 271 N -3.13 1.75 0.19 4.20 3.02 0.43 -4.95 115.26 116.78 3d1h n ASN 271 Ca 0.04 -3.14 0.18 0.00 -0.03 0.00 0.00 54.58 51.62 3d1h n ASN 271 Cb 0.56 -0.61 0.82 0.00 -0.61 0.00 0.00 39.78 39.94 3d1h n ASN 271 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 3d1h h PRO 272 N 3.21 0.00 0.00 3.52 0.13 -1.62 -1.10 132.00 136.14 3d1h h PRO 272 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3d1h h PRO 272 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 3d1h h PRO 272 CO 0.59 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 177.23 3d1h n SER 273 N -3.69 0.27 -4.75 1.44 3.41 -1.26 -4.79 113.62 104.25 3d1h n SER 273 Ca 0.03 0.53 -0.40 0.00 -0.26 0.00 0.00 58.87 58.77 3d1h n SER 273 Cb 0.40 -0.60 -0.06 0.00 -0.26 0.00 0.00 64.21 63.69 3d1h n SER 273 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3d1h s VAL 274 N -3.04 4.28 0.63 -3.33 1.01 -0.42 -5.02 120.40 114.50 3d1h s VAL 274 Ca 0.12 1.96 -0.16 0.00 0.00 0.00 0.00 61.98 63.89 3d1h s VAL 274 Cb 0.16 -4.27 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 3d1h s VAL 274 CO 0.52 0.46 1.14 -0.94 0.00 0.00 0.00 175.10 176.28 3d1h s SER 275 N -0.85 5.12 0.19 3.32 1.04 -1.26 -4.83 113.70 116.43 3d1h s SER 275 Ca 0.41 2.14 -0.12 0.00 0.48 0.00 0.00 55.95 58.86 3d1h s SER 275 Cb -0.24 -2.57 0.22 0.00 0.10 0.00 0.00 66.02 63.52 3d1h s SER 275 CO 0.29 -1.62 1.72 0.25 0.98 0.00 0.00 173.24 174.86 3d1h h LEU 276 N 0.36 0.05 -0.51 2.42 5.85 -1.96 -1.29 115.31 120.23 3d1h h LEU 276 Ca -0.48 0.09 0.06 0.00 0.84 0.00 0.00 57.88 58.39 3d1h h LEU 276 Cb 1.26 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.35 3d1h h LEU 276 CO 0.54 0.05 0.21 0.50 -0.34 0.00 0.00 178.44 179.40 3d1h h LYS 277 N 0.27 0.39 -0.02 1.25 3.64 -1.99 -0.78 116.57 119.33 3d1h h LYS 277 Ca 0.27 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.62 3d1h h LYS 277 Cb 0.35 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 32.08 3d1h h LYS 277 CO -0.33 0.26 0.01 -0.44 -2.27 0.00 0.00 179.45 176.68 3d1h h ASP 278 N 0.40 0.02 -0.20 4.20 3.32 -1.71 -0.34 116.42 122.12 3d1h h ASP 278 Ca 0.24 -0.11 0.05 0.00 0.02 0.00 0.00 57.03 57.23 3d1h h ASP 278 Cb 0.22 -0.01 -0.06 0.00 0.22 0.00 0.00 39.33 39.71 3d1h h ASP 278 CO -0.22 0.13 -0.17 0.40 -1.72 0.00 0.00 179.24 177.66 3d1h h ILE 279 N -0.09 0.54 -0.36 0.35 1.08 -0.83 -0.35 117.51 117.86 3d1h h ILE 279 Ca 0.01 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.46 3d1h h ILE 279 Cb 0.11 0.54 -0.02 0.00 -3.07 0.00 0.00 36.82 34.39 3d1h h ILE 279 CO -0.00 0.00 0.17 -0.07 -0.69 0.00 0.00 178.15 177.56 3d1h h LEU 280 N -0.18 0.47 0.20 1.44 3.38 -1.03 -0.42 115.31 119.16 3d1h h LEU 280 Ca 0.12 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3d1h h LEU 280 Cb 0.36 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.99 3d1h h LEU 280 CO -0.30 0.46 -0.09 1.88 0.09 0.00 0.00 178.44 180.48 3d1h h TYR 281 N 0.44 -0.24 -0.47 1.13 0.05 -0.82 -2.47 116.97 114.58 3d1h h TYR 281 Ca 0.12 -0.01 -0.10 0.00 0.05 0.00 0.00 58.73 58.80 3d1h h TYR 281 Cb 0.12 0.08 -0.02 0.00 1.01 0.00 0.00 36.73 37.93 3d1h h TYR 281 CO -0.01 -0.06 -0.09 0.07 -1.05 0.00 0.00 178.16 177.01 3d1h h ARG 282 N -0.38 0.85 0.00 4.88 0.11 -0.97 0.32 114.38 119.18 3d1h h ARG 282 Ca -0.03 -0.28 -0.06 0.00 0.10 0.00 0.00 59.98 59.72 3d1h h ARG 282 Cb 0.29 -0.07 -0.01 0.00 1.11 0.00 0.00 29.97 31.29 3d1h h ARG 282 CO 0.04 0.90 -0.27 1.96 0.10 0.00 0.00 179.97 182.71 3d1h h GLN 283 N 0.77 0.00 -0.04 0.08 1.08 -1.09 -1.95 115.11 113.97 3d1h h GLN 283 Ca 0.13 0.00 -0.16 0.00 -1.45 0.00 0.00 58.65 57.17 3d1h h GLN 283 Cb 0.59 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.03 3d1h h GLN 283 CO 0.04 0.27 -0.60 1.25 -0.95 0.00 0.00 178.83 178.83 3d1h h HIS 284 N 0.00 0.68 0.00 2.96 2.76 -0.87 -2.04 115.15 118.64 3d1h h HIS 284 Ca -0.00 -0.34 0.00 0.00 -2.20 0.00 0.00 60.37 57.83 3d1h h HIS 284 Cb 0.50 -0.09 0.00 0.00 1.55 0.00 0.00 27.41 29.37 3d1h h HIS 284 CO 0.00 1.15 0.00 0.39 -1.30 0.00 0.00 177.93 178.17 3d1h n GLU 285 N -4.20 0.05 -0.08 5.26 1.02 0.10 -1.36 120.64 121.43 3d1h n GLU 285 Ca -0.10 0.19 0.11 0.00 -0.02 0.00 0.00 57.16 57.35 3d1h n GLU 285 Cb 0.66 -1.57 0.35 0.00 -0.02 0.00 0.00 31.44 30.86 3d1h n GLU 285 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 3d1h n ILE 286 N -1.66 0.21 0.00 -3.67 -5.35 -0.77 -0.61 119.36 107.51 3d1h n ILE 286 Ca 0.05 -0.41 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 3d1h n ILE 286 Cb 0.25 0.58 0.00 0.00 -1.74 0.00 0.00 39.64 38.73 3d1h n ILE 286 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d1h n GLY 287 N 1.22 1.69 0.78 3.28 0.00 -0.47 -4.72 105.19 106.96 3d1h n GLY 287 Ca 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.14 3d1h n GLY 287 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d1h n GLY 288 N -0.13 2.64 3.83 -0.02 0.00 -0.77 -5.00 105.19 105.74 3d1h n GLY 288 Ca 0.00 -2.18 -0.32 0.00 0.00 0.00 0.00 46.02 43.52 3d1h n GLY 288 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3d1h s PHE 289 N -0.27 3.27 -0.32 1.61 2.19 -1.26 -4.45 117.98 118.73 3d1h s PHE 289 Ca 0.08 1.47 -0.15 0.00 0.33 0.00 0.00 56.93 58.66 3d1h s PHE 289 Cb -0.01 -2.88 -0.02 0.00 -1.31 0.00 0.00 43.02 38.81 3d1h s PHE 289 CO 0.05 -0.74 0.34 -0.47 1.83 0.00 0.00 175.22 176.23 3d1h s TYR 290 N -2.64 3.22 -0.73 10.12 6.14 -1.26 -3.96 117.35 128.24 3d1h s TYR 290 Ca 0.60 0.06 0.12 0.00 0.64 0.00 0.00 57.07 58.49 3d1h s TYR 290 Cb -0.13 -2.61 0.60 0.00 0.42 0.00 0.00 41.96 40.24 3d1h s TYR 290 CO 0.37 -0.36 1.44 0.66 0.64 0.00 0.00 175.55 178.30 3d1h n TYR 291 N 5.32 1.43 -3.06 4.97 4.02 -1.26 -4.92 117.16 123.66 3d1h n TYR 291 Ca -0.10 -0.52 -0.13 0.00 -0.01 0.00 0.00 57.90 57.15 3d1h n TYR 291 Cb 0.50 -0.34 0.04 0.00 -0.02 0.00 0.00 39.34 39.53 3d1h n TYR 291 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3d1h n GLY 292 N 0.65 1.99 3.77 2.72 0.00 -1.26 -4.64 105.19 108.43 3d1h n GLY 292 Ca 0.21 -2.20 -0.41 0.00 0.00 0.00 0.00 46.02 43.62 3d1h n GLY 292 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d1h s GLU 293 N -3.73 4.27 0.21 1.61 2.02 -1.26 -4.95 118.70 116.87 3d1h s GLU 293 Ca 0.39 2.33 -0.22 0.00 0.02 0.00 0.00 54.97 57.50 3d1h s GLU 293 Cb -0.03 -3.05 0.05 0.00 0.10 0.00 0.00 34.13 31.20 3d1h s GLU 293 CO 0.25 -0.32 0.65 -0.59 0.02 0.00 0.00 175.26 175.27 3d1h s PHE 294 N -0.99 -0.37 -0.82 1.61 -0.12 -1.26 -5.02 117.98 111.02 3d1h s PHE 294 Ca 0.51 0.05 -0.25 0.00 -0.05 0.00 0.00 56.93 57.19 3d1h s PHE 294 Cb -0.42 0.62 -0.01 0.00 -0.63 0.00 0.00 43.02 42.58 3d1h s PHE 294 CO 0.55 -1.02 1.75 -1.25 -0.05 0.00 0.00 175.22 175.20 3d1h s PRO 295 N -3.83 2.83 0.07 1.99 0.04 -1.26 -4.94 135.00 129.90 3d1h s PRO 295 Ca 0.06 -0.16 -0.31 0.00 0.04 0.00 0.00 61.00 60.63 3d1h s PRO 295 Cb -0.03 -4.80 -0.08 0.00 0.04 0.00 0.00 34.50 29.62 3d1h s PRO 295 CO -0.04 -2.84 1.68 0.42 0.04 0.00 0.00 177.00 176.26 3d1h s ILE 296 N 8.38 2.99 -0.07 0.56 1.01 -1.26 -4.98 121.20 127.81 3d1h s ILE 296 Ca 0.61 0.43 -0.02 0.00 0.00 0.00 0.00 60.65 61.67 3d1h s ILE 296 Cb -0.07 -3.28 0.03 0.00 0.01 0.00 0.00 42.46 39.15 3d1h s ILE 296 CO 0.06 -0.00 0.02 -0.54 0.00 0.00 0.00 174.94 174.48 3d1h s LYS 297 N 2.70 0.44 0.15 2.79 1.02 -1.26 -5.14 119.74 120.43 3d1h s LYS 297 Ca 0.75 0.13 0.07 0.00 0.02 0.00 0.00 55.97 56.94 3d1h s LYS 297 Cb -0.40 -0.96 -0.04 0.00 -0.52 0.00 0.00 37.83 35.91 3d1h s LYS 297 CO 0.33 -0.34 -0.14 0.95 -0.92 0.00 0.00 175.35 175.22 3d1h s THR 298 N 2.02 1.48 0.76 2.17 -4.23 -1.26 -5.13 115.64 111.45 3d1h s THR 298 Ca 0.05 -1.89 -0.11 0.00 -1.18 0.00 0.00 61.69 58.56 3d1h s THR 298 Cb -0.13 -1.72 0.05 0.00 1.34 0.00 0.00 72.50 72.04 3d1h s THR 298 CO -0.05 -0.47 1.08 -0.54 -0.54 0.00 0.00 174.62 174.10 3d1h s LYS 299 N -3.00 2.39 0.24 3.99 1.02 -1.26 -4.80 119.74 118.31 3d1h s LYS 299 Ca 0.14 0.96 -0.06 0.00 0.02 0.00 0.00 55.97 57.03 3d1h s LYS 299 Cb -0.03 -1.93 0.34 0.00 -0.52 0.00 0.00 37.83 35.68 3d1h s LYS 299 CO 0.04 -1.49 1.83 -0.44 -0.92 0.00 0.00 175.35 174.38 3d1h h ASP 300 N -1.00 0.75 0.43 2.83 3.32 -2.00 0.61 116.42 121.35 3d1h h ASP 300 Ca -0.45 0.03 0.00 0.00 0.02 0.00 0.00 57.03 56.63 3d1h h ASP 300 Cb 1.23 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.66 3d1h h ASP 300 CO 0.55 0.47 0.00 2.29 -1.72 0.00 0.00 179.24 180.83 3d1h n LYS 301 N -4.68 0.31 -0.09 3.56 2.85 -1.26 -2.46 118.16 116.39 3d1h n LYS 301 Ca 0.12 0.08 0.04 0.00 -1.05 0.00 0.00 58.31 57.50 3d1h n LYS 301 Cb 0.20 -1.50 0.09 0.00 -0.65 0.00 0.00 35.03 33.17 3d1h n LYS 301 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3d1h n ASP 302 N -1.29 2.44 0.19 -5.58 8.00 0.09 -4.67 116.55 115.73 3d1h n ASP 302 Ca 0.10 -2.35 0.13 0.00 0.71 0.00 0.00 54.79 53.38 3d1h n ASP 302 Cb 0.18 -0.20 0.69 0.00 -0.02 0.00 0.00 41.12 41.77 3d1h n ASP 302 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3d1h h SER 303 N 0.56 0.00 0.98 -2.24 4.64 -0.92 -1.31 113.55 115.27 3d1h h SER 303 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 3d1h h SER 303 Cb 0.75 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3d1h h SER 303 CO 0.02 0.00 -0.11 4.11 -0.87 0.00 0.00 176.83 179.98 3d1h h TRP 304 N 0.00 0.00 0.00 4.77 5.08 -1.84 -3.09 115.95 120.87 3d1h h TRP 304 Ca 0.00 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 59.86 3d1h h TRP 304 Cb 0.03 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.17 3d1h h TRP 304 CO 0.00 0.11 -0.51 0.87 -1.28 0.00 0.00 178.44 177.63 3d1h h LYS 305 N 0.00 0.00 -0.68 0.12 1.57 -1.62 -3.38 116.57 112.58 3d1h h LYS 305 Ca -0.00 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.86 3d1h h LYS 305 Cb 0.63 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 32.84 3d1h h LYS 305 CO 0.01 0.51 -0.53 1.15 -0.57 0.00 0.00 179.45 180.02 3d1h h THR 306 N 0.00 0.02 0.00 -0.16 2.02 -1.69 0.62 112.91 113.71 3d1h h THR 306 Ca -0.01 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 3d1h h THR 306 Cb 1.17 0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 67.59 3d1h h THR 306 CO 0.07 0.00 -0.12 0.07 0.37 0.00 0.00 175.52 175.91 3d1h h LYS 307 N -0.20 0.00 -0.07 6.66 2.10 -1.81 -1.78 116.57 121.46 3d1h h LYS 307 Ca 0.14 0.00 -0.17 0.00 -2.00 0.00 0.00 60.65 58.62 3d1h h LYS 307 Cb 0.53 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.85 3d1h h LYS 307 CO -0.76 0.12 -0.70 1.88 -2.00 0.00 0.00 179.45 177.99 3d1h h TYR 308 N 0.00 0.46 -0.51 0.07 -1.99 -1.14 -0.63 116.97 113.24 3d1h h TYR 308 Ca -0.00 -0.20 -0.13 0.00 2.00 0.00 0.00 58.73 60.40 3d1h h TYR 308 Cb 0.46 -0.07 -0.01 0.00 2.00 0.00 0.00 36.73 39.10 3d1h h TYR 308 CO 0.00 0.94 -0.18 1.88 -0.00 0.00 0.00 178.16 180.79 3d1h h TYR 309 N 0.24 1.15 -0.46 4.88 0.05 -0.53 -1.15 116.97 121.15 3d1h h TYR 309 Ca -0.02 -0.27 -0.13 0.00 0.05 0.00 0.00 58.73 58.36 3d1h h TYR 309 Cb 1.26 -0.27 -0.01 0.00 1.01 0.00 0.00 36.73 38.72 3d1h h TYR 309 CO 0.04 1.10 -0.22 0.00 -1.05 0.00 0.00 178.16 178.02 3d1h h ARG 310 N 0.88 0.96 -0.40 4.88 3.08 -1.23 -2.51 114.38 120.05 3d1h h ARG 310 Ca 0.12 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 59.74 3d1h h ARG 310 Cb 0.76 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.76 3d1h h ARG 310 CO 0.06 1.09 0.23 1.49 -1.07 0.00 0.00 179.97 181.77 3d1h h GLU 311 N 0.81 0.55 -0.48 0.04 4.81 -1.00 -2.57 114.58 116.73 3d1h h GLU 311 Ca 0.10 -0.06 0.05 0.00 -0.13 0.00 0.00 59.36 59.32 3d1h h GLU 311 Cb 0.80 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 30.03 3d1h h GLU 311 CO 0.07 0.43 0.22 0.87 -0.73 0.00 0.00 179.01 179.87 3d1h h LYS 312 N 0.52 0.43 -0.69 1.92 1.57 -1.13 0.27 116.57 119.45 3d1h h LYS 312 Ca 0.14 -0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.97 3d1h h LYS 312 Cb 0.03 -0.10 -0.06 0.00 0.08 0.00 0.00 32.23 32.18 3d1h h LYS 312 CO -0.02 0.28 0.37 0.82 -0.57 0.00 0.00 179.45 180.33 3d1h h ILE 313 N 0.44 0.92 -0.33 1.86 2.04 -1.19 -0.09 117.51 121.15 3d1h h ILE 313 Ca 0.22 -0.22 -0.17 0.00 1.00 0.00 0.00 64.86 65.68 3d1h h ILE 313 Cb 0.15 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 36.44 3d1h h ILE 313 CO -0.17 0.12 -0.46 0.58 0.00 0.00 0.00 178.15 178.22 3d1h h VAL 314 N 0.65 1.27 -0.04 1.67 2.07 -1.05 -3.08 116.25 117.75 3d1h h VAL 314 Ca 0.32 -1.64 -0.12 0.00 0.82 0.00 0.00 66.70 66.08 3d1h h VAL 314 Cb 0.26 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 3d1h h VAL 314 CO -0.22 0.54 -0.51 0.24 0.02 0.00 0.00 177.57 177.64 3d1h h MET 315 N 0.70 0.11 -0.48 1.57 2.86 -0.47 -1.84 114.93 117.38 3d1h h MET 315 Ca 0.04 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3d1h h MET 315 Cb 1.07 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.71 3d1h h MET 315 CO 0.11 0.60 0.31 0.82 1.06 0.00 0.00 176.91 179.81 3d1h h ILE 316 N 0.09 1.13 -0.74 -1.22 1.08 -0.99 0.98 117.51 117.84 3d1h h ILE 316 Ca 0.00 -0.24 -0.06 0.00 -0.39 0.00 0.00 64.86 64.18 3d1h h ILE 316 Cb 0.93 0.43 -0.03 0.00 -3.07 0.00 0.00 36.82 35.08 3d1h h ILE 316 CO 0.07 0.12 0.23 -0.33 -0.69 0.00 0.00 178.15 177.56 3d1h h GLU 317 N 0.64 1.14 -0.33 2.37 5.08 -1.42 -1.68 114.58 120.38 3d1h h GLU 317 Ca 0.17 -0.24 -0.11 0.00 -1.00 0.00 0.00 59.36 58.18 3d1h h GLU 317 Cb -0.07 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.00 3d1h h GLU 317 CO -0.04 0.97 -0.27 0.37 -1.00 0.00 0.00 179.01 179.05 3d1h h GLN 318 N 1.09 0.67 -0.44 2.33 5.75 -0.81 -1.42 115.11 122.28 3d1h h GLN 318 Ca 0.24 -0.28 -0.10 0.00 -0.15 0.00 0.00 58.65 58.36 3d1h h GLN 318 Cb 0.30 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.81 3d1h h GLN 318 CO -0.01 0.87 -0.11 0.35 -2.65 0.00 0.00 178.83 177.28 3d1h h PHE 319 N 0.58 0.97 -0.84 3.99 3.57 -0.60 -0.31 116.94 124.29 3d1h h PHE 319 Ca 0.08 -0.21 0.05 0.00 3.53 0.00 0.00 57.97 61.42 3d1h h PHE 319 Cb 0.75 -0.24 -0.06 0.00 2.79 0.00 0.00 35.95 39.20 3d1h h PHE 319 CO 0.03 0.96 0.53 -0.92 -2.23 0.00 0.00 178.31 176.69 3d1h h TYR 320 N 0.69 0.98 -0.77 0.41 5.03 -1.08 0.44 116.97 122.67 3d1h h TYR 320 Ca 0.11 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.40 3d1h h TYR 320 Cb 0.65 -0.32 -0.03 0.00 1.55 0.00 0.00 36.73 38.58 3d1h h TYR 320 CO 0.05 0.52 0.30 -0.09 -1.32 0.00 0.00 178.16 177.61 3d1h h ARG 321 N 0.98 1.15 -0.02 1.82 2.43 -0.95 -0.77 114.38 119.02 3d1h h ARG 321 Ca 0.36 -0.21 0.01 0.00 -0.81 0.00 0.00 59.98 59.33 3d1h h ARG 321 Cb 0.12 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 3d1h h ARG 321 CO -0.16 0.94 -0.04 -0.92 -1.51 0.00 0.00 179.97 178.28 3d1h h TYR 322 N 1.12 -0.10 -0.65 2.20 3.20 0.41 -0.66 116.97 122.49 3d1h h TYR 322 Ca 0.26 0.00 0.04 0.00 3.14 0.00 0.00 58.73 62.17 3d1h h TYR 322 Cb 0.22 0.05 -0.05 0.00 1.54 0.00 0.00 36.73 38.49 3d1h h TYR 322 CO 0.02 -0.06 0.39 0.28 -1.64 0.00 0.00 178.16 177.15 3d1h h VAL 323 N -0.06 1.04 -0.42 1.81 2.07 -0.62 -0.59 116.25 119.48 3d1h h VAL 323 Ca 0.02 -0.26 -0.12 0.00 0.82 0.00 0.00 66.70 67.17 3d1h h VAL 323 Cb 0.09 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 3d1h h VAL 323 CO -0.06 0.14 -0.20 1.56 0.02 0.00 0.00 177.57 179.03 3d1h h GLN 324 N 0.75 0.83 -0.00 1.57 1.08 -0.86 -2.73 115.11 115.75 3d1h h GLN 324 Ca 0.27 -0.33 0.00 0.00 -1.45 0.00 0.00 58.65 57.14 3d1h h GLN 324 Cb 0.08 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 3d1h h GLN 324 CO -0.13 0.96 -0.41 0.39 -0.95 0.00 0.00 178.83 178.69 3d1h n GLU 325 N -4.12 0.19 0.00 1.46 1.02 -0.28 -4.21 120.64 114.71 3d1h n GLU 325 Ca 0.00 -0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.04 3d1h n GLU 325 Cb 0.43 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 3d1h n GLU 325 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3d1h n ASN 326 N -1.31 1.02 -0.00 1.62 3.02 -0.26 -4.68 115.26 114.66 3d1h n ASN 326 Ca 0.07 -1.02 -0.13 0.00 -0.03 0.00 0.00 54.58 53.47 3d1h n ASN 326 Cb 0.34 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.50 3d1h n ASN 326 CO 0.00 0.00 0.00 0.08 -2.62 0.00 0.00 177.26 174.72 3d1h h ARG 327 N 0.00 0.64 -0.76 3.52 -0.00 -1.65 0.11 114.38 116.23 3d1h h ARG 327 Ca 0.00 -0.48 0.16 0.00 -0.00 0.00 0.00 59.98 59.66 3d1h h ARG 327 Cb 0.02 0.09 -0.10 0.00 -0.00 0.00 0.00 29.97 29.97 3d1h h ARG 327 CO 0.00 1.10 0.27 0.00 -0.00 0.00 0.00 179.97 181.34 3d1h h ALA 328 N 0.78 1.07 -0.54 0.08 0.00 -1.83 0.95 119.26 119.76 3d1h h ALA 328 Ca -0.02 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3d1h h ALA 328 Cb 1.27 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.21 3d1h h ALA 328 CO 0.13 -0.27 0.00 -0.40 0.00 0.00 0.00 179.25 178.72 3d1h n ASP 329 N -5.06 3.23 -0.80 0.00 3.85 -1.23 -4.92 116.55 111.62 3d1h n ASP 329 Ca 0.15 -2.11 -0.04 0.00 -0.71 0.00 0.00 54.79 52.08 3d1h n ASP 329 Cb 0.46 -0.41 0.01 0.00 -1.35 0.00 0.00 41.12 39.82 3d1h n ASP 329 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3d1h n GLY 330 N 1.24 0.47 3.69 6.12 0.00 0.33 -4.06 105.19 112.98 3d1h n GLY 330 Ca 0.19 -0.60 -0.21 0.00 0.00 0.00 0.00 46.02 45.40 3d1h n GLY 330 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3d1h n TYR 331 N -3.44 -1.92 -0.29 1.61 4.01 0.38 -4.90 117.16 112.61 3d1h n TYR 331 Ca -0.02 0.84 -0.06 0.00 -0.16 0.00 0.00 57.90 58.50 3d1h n TYR 331 Cb 0.52 -4.41 0.06 0.00 -0.31 0.00 0.00 39.34 35.20 3d1h n TYR 331 CO 0.00 0.00 0.00 1.96 -0.46 0.00 0.00 176.86 178.36 3d1h h GLN 332 N -1.87 1.19 -5.31 -0.72 1.08 -1.79 -3.40 115.11 104.29 3d1h h GLN 332 Ca -0.61 -0.22 -0.61 0.00 -1.45 0.00 0.00 58.65 55.76 3d1h h GLN 332 Cb 1.36 -0.19 -0.12 0.00 -0.05 0.00 0.00 27.48 28.47 3d1h h GLN 332 CO 0.56 0.97 -0.32 -0.08 -0.95 0.00 0.00 178.83 179.01 3d1h s THR 333 N -5.53 5.27 0.75 -0.54 -1.32 -1.26 -5.05 115.64 107.95 3d1h s THR 333 Ca -0.12 0.50 -0.15 0.00 -1.21 0.00 0.00 61.69 60.71 3d1h s THR 333 Cb 0.16 -3.64 0.05 0.00 -1.51 0.00 0.00 72.50 67.56 3d1h s THR 333 CO 0.84 0.30 1.21 -2.16 -2.21 0.00 0.00 174.62 172.60 3d1h s PRO 334 N 1.14 2.02 0.16 7.08 0.04 -1.26 -4.74 135.00 139.43 3d1h s PRO 334 Ca 0.15 1.76 -0.20 0.00 0.04 0.00 0.00 61.00 62.74 3d1h s PRO 334 Cb -0.14 -1.82 0.07 0.00 0.04 0.00 0.00 34.50 32.65 3d1h s PRO 334 CO 0.06 -1.93 1.64 2.35 0.04 0.00 0.00 177.00 179.16 3d1h h TRP 335 N -0.45 -0.51 -0.57 0.56 2.91 -1.93 0.15 115.95 116.10 3d1h h TRP 335 Ca -0.47 0.04 0.08 0.00 1.13 0.00 0.00 58.89 59.67 3d1h h TRP 335 Cb 1.30 0.28 -0.07 0.00 -0.51 0.00 0.00 29.16 30.16 3d1h h TRP 335 CO 0.47 -0.28 0.22 0.66 -1.03 0.00 0.00 178.44 178.48 3d1h h SER 336 N -0.15 0.24 -0.23 2.65 4.64 -1.92 0.21 113.55 118.98 3d1h h SER 336 Ca 0.17 0.07 -0.07 0.00 -0.47 0.00 0.00 61.79 61.49 3d1h h SER 336 Cb 0.42 0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.55 3d1h h SER 336 CO -0.44 0.15 -0.12 0.58 -0.87 0.00 0.00 176.83 176.13 3d1h h VAL 337 N 0.41 1.30 -0.76 0.95 2.07 -1.81 -2.29 116.25 116.13 3d1h h VAL 337 Ca 0.28 -1.21 -0.01 0.00 0.82 0.00 0.00 66.70 66.58 3d1h h VAL 337 Cb 0.32 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.65 3d1h h VAL 337 CO -0.27 0.37 0.43 -0.25 0.02 0.00 0.00 177.57 177.87 3d1h h TRP 338 N 0.21 1.04 -0.88 1.57 7.01 -0.44 -2.83 115.95 121.63 3d1h h TRP 338 Ca 0.05 -0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.02 3d1h h TRP 338 Cb 0.63 -0.33 -0.04 0.00 -2.10 0.00 0.00 29.16 27.31 3d1h h TRP 338 CO 0.06 0.72 0.51 1.25 -2.79 0.00 0.00 178.44 178.20 3d1h h LEU 339 N 1.05 1.06 -0.77 0.65 6.46 -0.50 0.71 115.31 123.97 3d1h h LEU 339 Ca 0.27 -0.07 -0.06 0.00 -0.12 0.00 0.00 57.88 57.90 3d1h h LEU 339 Cb 0.02 -0.27 -0.03 0.00 -0.73 0.00 0.00 40.66 39.65 3d1h h LEU 339 CO -0.04 0.83 0.22 0.11 -0.62 0.00 0.00 178.44 178.93 3d1h h LYS 340 N 1.21 1.14 0.00 1.25 1.57 -1.19 -1.64 116.57 118.91 3d1h h LYS 340 Ca 0.31 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 3d1h h LYS 340 Cb -0.03 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.12 3d1h h LYS 340 CO -0.06 0.98 -0.23 -1.13 -0.57 0.00 0.00 179.45 178.44 3d1h n SER 341 N -4.25 0.29 -3.21 0.86 3.41 -0.89 -4.18 113.62 105.65 3d1h n SER 341 Ca 0.06 0.19 -0.23 0.00 -0.26 0.00 0.00 58.87 58.63 3d1h n SER 341 Cb 0.24 -0.19 -0.06 0.00 -0.26 0.00 0.00 64.21 63.94 3d1h n SER 341 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3d1h n HIS 342 N -1.59 0.79 -1.74 7.33 8.25 0.19 -5.11 115.22 123.35 3d1h n HIS 342 Ca 0.06 -3.76 -0.41 0.00 -0.26 0.00 0.00 57.72 53.36 3d1h n HIS 342 Cb 0.35 -0.41 0.01 0.00 1.12 0.00 0.00 29.99 31.06 3d1h n HIS 342 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3d1h n PRO 343 N 0.90 2.21 -1.91 -0.41 -0.02 -0.65 -4.64 135.00 130.48 3d1h n PRO 343 Ca 0.24 0.78 -0.32 0.00 -2.02 0.00 0.00 63.50 62.19 3d1h n PRO 343 Cb 0.53 -2.54 0.02 0.00 -0.02 0.00 0.00 33.50 31.48 3d1h n PRO 343 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d1h s ALA 344 N -1.18 2.84 -0.05 3.55 0.00 -1.26 -5.06 121.76 120.60 3d1h s ALA 344 Ca 0.60 0.16 0.04 0.00 0.00 0.00 0.00 51.96 52.76 3d1h s ALA 344 Cb -0.48 -3.17 -0.02 0.00 0.00 0.00 0.00 23.12 19.45 3d1h s ALA 344 CO 0.59 -0.84 -0.16 0.15 0.00 0.00 0.00 175.76 175.50 3d1h s LYS 345 N -4.61 2.51 0.00 0.00 1.02 -1.26 -4.56 119.74 112.84 3d1h s LYS 345 Ca 0.59 -0.74 0.07 0.00 0.02 0.00 0.00 55.97 55.91 3d1h s LYS 345 Cb -0.13 -2.34 0.40 0.00 -0.52 0.00 0.00 37.83 35.24 3d1h s LYS 345 CO 0.45 0.57 0.86 0.00 -0.92 0.00 0.00 175.35 176.32