#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 5.34 -0.01 12.58 0.11 -1.26 -5.02 120.40 132.14 3d1h s VAL 35 Ca 0.00 0.43 -0.24 0.00 -2.93 0.00 0.00 61.98 59.23 3d1h s VAL 35 Cb 0.00 -3.52 -0.19 0.00 -1.53 0.00 0.00 36.38 31.13 3d1h s VAL 35 CO 0.00 0.56 1.23 0.74 -3.33 0.00 0.00 175.10 174.30 3d1h h THR 36 N 4.08 1.42 -3.25 5.04 2.02 -2.07 -3.43 112.91 116.72 3d1h h THR 36 Ca -0.51 -1.37 -0.48 0.00 0.77 0.00 0.00 66.41 64.82 3d1h h THR 36 Cb 1.21 2.24 -0.37 0.00 -1.74 0.00 0.00 68.15 69.49 3d1h h THR 36 CO 0.63 0.37 -0.79 -1.61 0.37 0.00 0.00 175.52 174.50 3d1h s GLU 37 N -4.00 1.18 0.75 6.66 0.41 -1.26 -5.10 118.70 117.34 3d1h s GLU 37 Ca -0.16 -0.14 -0.11 0.00 -0.41 0.00 0.00 54.97 54.16 3d1h s GLU 37 Cb 0.02 -1.30 0.04 0.00 -1.78 0.00 0.00 34.13 31.12 3d1h s GLU 37 CO 0.71 -0.23 1.08 -1.25 -0.49 0.00 0.00 175.26 175.07 3d1h s PRO 38 N 1.61 2.50 0.44 0.39 0.04 -1.26 -4.86 135.00 133.86 3d1h s PRO 38 Ca 0.02 0.82 -0.25 0.00 0.04 0.00 0.00 61.00 61.63 3d1h s PRO 38 Cb -0.13 -1.95 -0.09 0.00 0.04 0.00 0.00 34.50 32.37 3d1h s PRO 38 CO -0.05 -1.38 1.22 0.28 0.04 0.00 0.00 177.00 177.11 3d1h n VAL 39 N -3.30 2.73 -0.02 -0.36 0.31 -1.26 -1.52 118.33 114.91 3d1h n VAL 39 Ca 0.07 -0.50 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 3d1h n VAL 39 Cb 0.55 -1.49 0.00 0.00 -0.91 0.00 0.00 33.84 31.98 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 0.89 0.70 0.81 2.92 0.00 -1.26 -4.69 105.19 104.55 3d1h n GLY 40 Ca 0.08 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.14 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 1.17 -0.27 1.61 7.64 -0.57 -4.76 113.62 118.44 3d1h n SER 41 Ca 0.00 -2.66 0.03 0.00 1.01 0.00 0.00 58.87 57.24 3d1h n SER 41 Cb 0.00 -0.36 0.24 0.00 -1.01 0.00 0.00 64.21 63.09 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 0.61 1.01 0.00 1.43 0.05 -1.89 -2.14 116.97 116.04 3d1h h TYR 42 Ca -0.08 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.72 3d1h h TYR 42 Cb 1.41 -0.33 -0.00 0.00 1.01 0.00 0.00 36.73 38.82 3d1h h TYR 42 CO 0.28 0.57 -0.01 0.00 -1.05 0.00 0.00 178.16 177.95 3d1h h ALA 43 N 1.51 1.05 0.00 3.88 0.00 -1.95 -0.93 119.26 122.83 3d1h h ALA 43 Ca 0.35 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.25 3d1h h ALA 43 Cb 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3d1h h ALA 43 CO -0.11 0.01 0.00 0.00 0.00 0.00 0.00 179.25 179.14 3d1h h ARG 44 N 0.00 0.00 0.00 0.00 3.08 -1.79 -1.72 114.38 113.96 3d1h h ARG 44 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3d1h h ARG 44 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.13 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 -2.32 0.04 0.00 -1.35 -3.46 119.26 115.20 3d1h h ALA 45 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.43 3d1h h ALA 45 Cb 0.15 0.00 0.05 0.00 0.00 0.00 0.00 17.79 17.98 3d1h h ALA 45 CO 0.00 0.00 0.38 -1.21 0.00 0.00 0.00 179.25 178.42 3d1h s GLU 46 N -3.23 3.56 -0.44 0.00 0.41 -0.65 -5.01 118.70 113.33 3d1h s GLU 46 Ca 0.07 1.23 -0.18 0.00 -0.41 0.00 0.00 54.97 55.69 3d1h s GLU 46 Cb 0.07 -2.07 0.03 0.00 -1.78 0.00 0.00 34.13 30.39 3d1h s GLU 46 CO 0.64 -0.62 0.50 1.03 -0.49 0.00 0.00 175.26 176.32 3d1h s ARG 47 N -3.78 3.11 0.30 1.61 0.52 -1.26 -4.96 118.95 114.50 3d1h s ARG 47 Ca 0.64 -0.78 0.07 0.00 -0.52 0.00 0.00 55.73 55.14 3d1h s ARG 47 Cb -0.15 -4.01 0.78 0.00 0.52 0.00 0.00 34.95 32.09 3d1h s ARG 47 CO 0.30 -0.96 1.75 -1.35 0.02 0.00 0.00 175.30 175.06 3d1h h PRO 48 N 8.80 0.62 0.00 3.54 0.11 -1.94 0.61 132.00 143.74 3d1h h PRO 48 Ca -0.27 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3d1h h PRO 48 Cb 1.11 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.08 3d1h h PRO 48 CO 0.85 0.41 0.00 -0.56 -0.21 0.00 0.00 178.00 178.49 3d1h h GLN 49 N 0.64 0.00 -0.13 1.05 -0.00 -1.92 -0.66 115.11 114.09 3d1h h GLN 49 Ca 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.25 3d1h h GLN 49 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.51 3d1h h GLN 49 CO -0.44 0.00 0.00 -0.25 -0.00 0.00 0.00 178.83 178.14 3d1h n ASP 50 N -2.31 1.95 -1.92 0.06 8.00 0.21 -4.19 116.55 118.35 3d1h n ASP 50 Ca -0.01 -1.70 -0.01 0.00 0.71 0.00 0.00 54.79 53.78 3d1h n ASP 50 Cb 0.05 -0.08 0.06 0.00 -0.02 0.00 0.00 41.12 41.13 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 0.51 0.82 -1.94 1.24 3.01 -0.25 -4.82 117.46 116.02 3d1h n PHE 51 Ca 0.17 -1.45 -0.37 0.00 1.01 0.00 0.00 57.45 56.81 3d1h n PHE 51 Cb 0.40 -0.22 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 -2.29 3.22 0.49 -1.08 0.41 -1.24 -3.11 118.70 115.10 3d1h s GLU 52 Ca 0.34 2.03 -0.23 0.00 -0.41 0.00 0.00 54.97 56.70 3d1h s GLU 52 Cb 0.37 -2.20 -0.07 0.00 -1.78 0.00 0.00 34.13 30.45 3d1h s GLU 52 CO -0.08 -1.06 1.31 0.20 -0.49 0.00 0.00 175.26 175.13 3d1h s GLY 53 N -1.21 2.87 0.00 -1.39 0.00 -1.26 -4.21 107.32 102.12 3d1h s GLY 53 Ca 0.71 1.23 0.00 0.00 0.00 0.00 0.00 44.72 46.66 3d1h s GLY 53 CO 0.41 1.75 0.00 1.97 0.00 0.00 0.00 173.10 177.23 3d1h n PHE 54 N -0.60 0.00 -3.55 1.90 1.16 0.58 -4.87 117.46 112.08 3d1h n PHE 54 Ca 0.08 0.00 -0.16 0.00 -1.87 0.00 0.00 57.45 55.50 3d1h n PHE 54 Cb 0.45 0.00 -0.06 0.00 -1.61 0.00 0.00 39.48 38.27 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 -0.54 1.97 0.11 -1.14 -5.02 120.40 115.78 3d1h s VAL 55 Ca 0.00 0.00 -0.27 0.00 -2.93 0.00 0.00 61.98 58.78 3d1h s VAL 55 Cb 0.00 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.88 3d1h s VAL 55 CO 0.00 0.00 1.11 0.26 -3.33 0.00 0.00 175.10 173.14 3d1h s TRP 56 N -0.92 2.71 0.21 1.54 0.52 -1.25 -0.91 118.94 120.84 3d1h s TRP 56 Ca -0.07 0.39 -0.30 0.00 0.02 0.00 0.00 56.10 56.15 3d1h s TRP 56 Cb -0.01 -4.37 -0.08 0.00 -1.15 0.00 0.00 33.47 27.85 3d1h s TRP 56 CO 0.06 -1.44 0.93 0.50 0.02 0.00 0.00 176.95 177.03 3d1h s ARG 57 N 4.57 4.81 -0.25 4.98 3.52 0.77 -1.96 118.95 135.40 3d1h s ARG 57 Ca 0.41 1.46 -0.29 0.00 -0.13 0.00 0.00 55.73 57.18 3d1h s ARG 57 Cb -0.08 -3.30 -0.01 0.00 -1.56 0.00 0.00 34.95 30.00 3d1h s ARG 57 CO 0.26 0.47 1.37 -1.17 -0.81 0.00 0.00 175.30 175.42 3d1h s LEU 58 N -0.98 3.96 0.12 -0.88 2.96 -0.16 -1.63 118.68 122.07 3d1h s LEU 58 Ca 0.42 1.43 0.03 0.00 -0.22 0.00 0.00 54.13 55.79 3d1h s LEU 58 Cb -0.25 -3.54 -0.18 0.00 0.50 0.00 0.00 46.19 42.72 3d1h s LEU 58 CO 0.31 -1.04 1.27 0.44 -1.32 0.00 0.00 176.35 176.01 3d1h h ASP 59 N 9.37 0.16 -3.36 3.68 3.32 -0.88 -3.45 116.42 125.26 3d1h h ASP 59 Ca -0.28 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.59 3d1h h ASP 59 Cb 1.11 -0.05 -0.22 0.00 0.22 0.00 0.00 39.33 40.39 3d1h h ASP 59 CO 1.01 1.09 0.00 0.21 -1.72 0.00 0.00 179.24 179.83 3d1h s ASN 60 N -6.88 -0.82 0.00 6.45 3.84 -1.26 -4.71 114.94 111.57 3d1h s ASN 60 Ca -0.01 1.39 0.21 0.00 0.21 0.00 0.00 52.86 54.66 3d1h s ASN 60 Cb 0.09 1.32 0.93 0.00 -0.55 0.00 0.00 41.25 43.04 3d1h s ASN 60 CO 0.84 -0.23 1.68 -0.90 -2.79 0.00 0.00 177.10 175.69 3d1h n ASP 61 N 3.76 0.00 -1.00 -4.21 5.68 -1.26 -4.70 116.55 114.81 3d1h n ASP 61 Ca -0.18 0.41 -0.12 0.00 -0.50 0.00 0.00 54.79 54.40 3d1h n ASP 61 Cb 0.57 -0.46 -0.04 0.00 -1.14 0.00 0.00 41.12 40.05 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 0.65 1.02 0.08 6.12 0.00 -1.26 -4.91 105.19 106.89 3d1h n GLY 62 Ca 0.06 -0.46 -0.09 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 0.05 -6.72 1.61 1.57 -1.96 -3.46 116.57 107.66 3d1h h LYS 63 Ca -0.25 -0.09 -0.49 0.00 -1.87 0.00 0.00 60.65 57.95 3d1h h LYS 63 Cb 0.86 0.03 0.01 0.00 0.08 0.00 0.00 32.23 33.22 3d1h h LYS 63 CO 0.35 0.89 -0.02 -1.21 -0.57 0.00 0.00 179.45 178.89 3d1h s GLU 64 N -2.66 3.58 0.37 3.15 0.41 -1.26 -4.99 118.70 117.30 3d1h s GLU 64 Ca -0.02 0.07 0.17 0.00 -0.41 0.00 0.00 54.97 54.77 3d1h s GLU 64 Cb 0.09 -2.51 0.70 0.00 -1.78 0.00 0.00 34.13 30.63 3d1h s GLU 64 CO 0.83 0.00 1.76 0.00 -0.49 0.00 0.00 175.26 177.36 3d1h h ALA 65 N 0.84 1.09 -2.20 5.21 0.00 -1.99 -3.45 119.26 118.76 3d1h h ALA 65 Ca -0.48 -0.36 -0.42 0.00 0.00 0.00 0.00 54.91 53.65 3d1h h ALA 65 Cb 1.20 -0.06 -0.14 0.00 0.00 0.00 0.00 17.79 18.78 3d1h h ALA 65 CO 0.63 0.50 -0.72 -0.51 0.00 0.00 0.00 179.25 179.15 3d1h s LEU 66 N -7.41 2.52 1.06 0.00 1.43 -1.26 -4.46 118.68 110.56 3d1h s LEU 66 Ca -0.01 -1.05 -0.13 0.00 -1.03 0.00 0.00 54.13 51.91 3d1h s LEU 66 Cb 0.12 -0.58 0.23 0.00 0.03 0.00 0.00 46.19 45.99 3d1h s LEU 66 CO 0.70 -0.25 1.07 -2.16 0.23 0.00 0.00 176.35 175.94 3d1h s PRO 67 N -3.69 -0.09 0.75 1.29 0.04 -1.26 -5.00 135.00 127.03 3d1h s PRO 67 Ca 0.22 0.61 -0.11 0.00 0.04 0.00 0.00 61.00 61.76 3d1h s PRO 67 Cb 0.01 -1.67 0.04 0.00 0.04 0.00 0.00 34.50 32.92 3d1h s PRO 67 CO 0.06 -3.11 1.09 1.03 0.04 0.00 0.00 177.00 176.12 3d1h s ARG 68 N -4.79 2.52 -1.16 4.56 1.81 -1.26 -3.92 118.95 116.70 3d1h s ARG 68 Ca 0.66 0.60 -0.06 0.00 -1.72 0.00 0.00 55.73 55.22 3d1h s ARG 68 Cb -0.21 -1.97 0.05 0.00 -0.45 0.00 0.00 34.95 32.37 3d1h s ARG 68 CO 0.60 -1.31 0.33 0.09 -0.68 0.00 0.00 175.30 174.33 3d1h n ASN 69 N -3.22 -3.70 -4.72 0.23 3.02 -1.26 -1.37 115.26 104.25 3d1h n ASN 69 Ca 0.07 -0.18 -0.42 0.00 -0.03 0.00 0.00 54.58 54.02 3d1h n ASN 69 Cb 0.56 -3.09 -0.03 0.00 -0.61 0.00 0.00 39.78 36.61 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 -2.80 3.33 0.11 3.10 5.36 -1.25 -4.09 117.98 121.73 3d1h s PHE 70 Ca 0.26 1.11 -0.22 0.00 -0.96 0.00 0.00 56.93 57.13 3d1h s PHE 70 Cb -0.14 -3.57 0.06 0.00 -0.34 0.00 0.00 43.02 39.03 3d1h s PHE 70 CO 0.32 -1.90 0.53 -0.98 -1.46 0.00 0.00 175.22 171.74 3d1h s ARG 71 N 0.98 1.14 0.16 10.12 3.03 -0.71 -4.99 118.95 128.68 3d1h s ARG 71 Ca 0.62 -0.42 0.05 0.00 2.03 0.00 0.00 55.73 58.00 3d1h s ARG 71 Cb -0.34 0.52 -0.05 0.00 -1.03 0.00 0.00 34.95 34.06 3d1h s ARG 71 CO 0.30 -0.46 -0.09 0.95 -1.13 0.00 0.00 175.30 174.88 3d1h s THR 72 N -3.25 1.18 -1.77 4.99 -4.23 -1.26 -0.86 115.64 110.44 3d1h s THR 72 Ca -0.01 -2.07 0.14 0.00 -1.18 0.00 0.00 61.69 58.57 3d1h s THR 72 Cb -0.00 -1.94 0.34 0.00 1.34 0.00 0.00 72.50 72.24 3d1h s THR 72 CO -0.08 -0.67 1.31 -1.54 -0.54 0.00 0.00 174.62 173.10 3d1h n SER 73 N -0.24 0.00 0.02 3.99 3.41 -0.24 -1.51 113.62 119.04 3d1h n SER 73 Ca -0.09 -0.23 0.11 0.00 -0.26 0.00 0.00 58.87 58.40 3d1h n SER 73 Cb 0.61 -0.11 0.07 0.00 -0.26 0.00 0.00 64.21 64.52 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 -1.11 3.65 -1.59 7.33 0.00 -1.26 -4.47 120.51 123.06 3d1h n ALA 74 Ca 0.09 -0.41 -0.35 0.00 0.00 0.00 0.00 53.44 52.77 3d1h n ALA 74 Cb 0.07 -0.99 0.05 0.00 0.00 0.00 0.00 19.45 18.58 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 -3.50 4.95 0.41 0.00 1.11 -0.57 -5.00 116.67 114.06 3d1h s ASP 75 Ca 0.07 2.27 -0.24 0.00 0.18 0.00 0.00 52.55 54.82 3d1h s ASP 75 Cb 0.16 -2.58 -0.09 0.00 1.07 0.00 0.00 42.92 41.47 3d1h s ASP 75 CO 0.78 -1.75 1.07 0.00 1.18 0.00 0.00 175.17 176.45 3d1h s ALA 76 N -1.90 3.08 0.17 5.23 0.00 -1.26 -4.95 121.76 122.13 3d1h s ALA 76 Ca 0.74 0.74 -0.30 0.00 0.00 0.00 0.00 51.96 53.13 3d1h s ALA 76 Cb -0.27 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 19.49 3d1h s ALA 76 CO 0.38 -0.27 1.09 -0.51 0.00 0.00 0.00 175.76 176.44 3d1h s LEU 77 N -2.67 4.49 0.42 0.00 1.43 -1.26 -4.69 118.68 116.40 3d1h s LEU 77 Ca 0.58 2.07 0.07 0.00 -1.03 0.00 0.00 54.13 55.82 3d1h s LEU 77 Cb -0.23 -3.60 -0.03 0.00 0.03 0.00 0.00 46.19 42.36 3d1h s LEU 77 CO 0.29 -0.21 0.30 -0.13 0.23 0.00 0.00 176.35 176.83 3d1h s ARG 78 N -0.35 2.38 0.45 1.70 0.52 -0.11 -5.00 118.95 118.55 3d1h s ARG 78 Ca 0.49 -1.70 -0.24 0.00 -0.52 0.00 0.00 55.73 53.75 3d1h s ARG 78 Cb -0.29 -2.19 -0.09 0.00 0.52 0.00 0.00 34.95 32.91 3d1h s ARG 78 CO 0.34 -0.19 1.25 0.00 0.02 0.00 0.00 175.30 176.72 3d1h n ALA 79 N -1.43 1.20 -1.66 2.13 0.00 -1.26 -4.71 120.51 114.78 3d1h n ALA 79 Ca 0.01 0.23 -0.33 0.00 0.00 0.00 0.00 53.44 53.34 3d1h n ALA 79 Cb 0.63 -2.26 0.01 0.00 0.00 0.00 0.00 19.45 17.84 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 -2.32 3.22 0.20 0.00 0.04 -1.26 -4.94 135.00 129.95 3d1h s PRO 80 Ca 0.63 1.38 -0.30 0.00 0.04 0.00 0.00 61.00 62.75 3d1h s PRO 80 Cb -0.49 -2.01 -0.09 0.00 0.04 0.00 0.00 34.50 31.95 3d1h s PRO 80 CO 0.56 -0.91 1.28 -1.21 0.04 0.00 0.00 177.00 176.76 3d1h s GLU 81 N -3.79 4.42 0.31 4.56 2.02 -1.26 -4.93 118.70 120.02 3d1h s GLU 81 Ca 0.67 2.01 0.03 0.00 0.02 0.00 0.00 54.97 57.70 3d1h s GLU 81 Cb -0.19 -3.20 0.61 0.00 0.10 0.00 0.00 34.13 31.45 3d1h s GLU 81 CO 0.34 -0.20 1.86 0.87 0.02 0.00 0.00 175.26 178.16 3d1h h LYS 82 N 5.20 0.91 -0.02 1.61 1.57 -1.98 -2.09 116.57 121.77 3d1h h LYS 82 Ca -0.45 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.28 3d1h h LYS 82 Cb 1.21 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 33.32 3d1h h LYS 82 CO 0.76 0.60 0.17 1.57 -0.57 0.00 0.00 179.45 181.97 3d1h h LYS 83 N 0.93 0.00 -0.01 3.15 2.10 -1.99 0.79 116.57 121.54 3d1h h LYS 83 Ca 0.46 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.11 3d1h h LYS 83 Cb 0.47 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.80 3d1h h LYS 83 CO -0.22 0.00 -0.15 1.19 -2.00 0.00 0.00 179.45 178.27 3d1h n PHE 84 N -3.07 0.00 -3.98 0.07 3.01 -0.78 -4.67 117.46 108.04 3d1h n PHE 84 Ca -0.02 0.00 -0.32 0.00 1.01 0.00 0.00 57.45 58.12 3d1h n PHE 84 Cb 0.23 -0.06 -0.01 0.00 -0.01 0.00 0.00 39.48 39.63 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 -0.18 -1.59 -3.00 1.38 8.25 0.27 -4.69 115.22 115.66 3d1h n HIS 85 Ca 0.15 0.53 -0.18 0.00 -0.26 0.00 0.00 57.72 57.96 3d1h n HIS 85 Cb 0.37 -3.34 0.02 0.00 1.12 0.00 0.00 29.99 28.16 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 -7.01 3.52 -0.63 2.41 1.43 -1.26 -5.02 118.68 112.12 3d1h s LEU 86 Ca 0.20 -0.51 -0.25 0.00 -1.03 0.00 0.00 54.13 52.54 3d1h s LEU 86 Cb -0.09 -2.42 0.04 0.00 0.03 0.00 0.00 46.19 43.75 3d1h s LEU 86 CO 0.92 -0.91 1.07 -0.62 0.23 0.00 0.00 176.35 177.03 3d1h s ASP 87 N -4.43 6.28 0.55 2.29 3.68 -1.26 -4.88 116.67 118.90 3d1h s ASP 87 Ca 0.57 -0.45 0.36 0.00 2.13 0.00 0.00 52.55 55.16 3d1h s ASP 87 Cb -0.09 -2.48 1.72 0.00 -1.45 0.00 0.00 42.92 40.62 3d1h s ASP 87 CO 0.35 -1.46 2.08 0.00 0.13 0.00 0.00 175.17 176.26 3d1h h ALA 88 N 9.58 1.00 0.00 3.66 0.00 -1.96 -1.60 119.26 129.93 3d1h h ALA 88 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3d1h h ALA 88 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3d1h h ALA 88 CO 1.17 0.00 -0.43 0.00 0.00 0.00 0.00 179.25 180.00 3d1h h ALA 89 N 2.03 0.77 -2.55 0.00 0.00 -2.04 -3.46 119.26 114.00 3d1h h ALA 89 Ca 0.00 0.00 -0.53 0.00 0.00 0.00 0.00 54.91 54.38 3d1h h ALA 89 Cb 0.27 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.08 3d1h h ALA 89 CO 0.00 0.00 0.66 -0.47 0.00 0.00 0.00 179.25 179.44 3d1h s TYR 90 N -3.24 3.31 -0.35 0.00 5.04 -0.60 -5.00 117.35 116.51 3d1h s TYR 90 Ca 0.05 1.11 -0.03 0.00 -2.44 0.00 0.00 57.07 55.76 3d1h s TYR 90 Cb 0.09 -3.58 0.07 0.00 0.35 0.00 0.00 41.96 38.89 3d1h s TYR 90 CO 0.71 -1.93 0.10 0.08 -1.34 0.00 0.00 175.55 173.17 3d1h s VAL 91 N 0.90 3.23 0.54 3.14 1.01 -1.26 -5.03 120.40 122.93 3d1h s VAL 91 Ca 0.61 -1.63 -0.20 0.00 0.00 0.00 0.00 61.98 60.76 3d1h s VAL 91 Cb -0.34 -3.01 -0.06 0.00 0.00 0.00 0.00 36.38 32.97 3d1h s VAL 91 CO 0.31 -0.36 1.13 -2.16 0.00 0.00 0.00 175.10 174.02 3d1h s PRO 92 N 1.23 3.39 0.43 2.72 0.04 -1.26 -4.99 135.00 136.56 3d1h s PRO 92 Ca 0.01 1.62 -0.25 0.00 0.04 0.00 0.00 61.00 62.42 3d1h s PRO 92 Cb -0.21 -2.03 -0.08 0.00 0.04 0.00 0.00 34.50 32.22 3d1h s PRO 92 CO -0.02 -0.82 1.33 0.45 0.04 0.00 0.00 177.00 177.98 3d1h s SER 93 N -1.74 6.10 -0.06 6.66 0.15 -1.26 -4.92 113.70 118.63 3d1h s SER 93 Ca 0.72 2.70 0.17 0.00 0.70 0.00 0.00 55.95 60.24 3d1h s SER 93 Cb -0.24 -2.64 0.55 0.00 -1.71 0.00 0.00 66.02 61.98 3d1h s SER 93 CO 0.27 -1.00 1.47 0.54 1.20 0.00 0.00 173.24 175.72 3d1h n ARG 94 N -0.10 3.14 -1.67 5.44 1.74 -1.26 -4.91 116.66 119.04 3d1h n ARG 94 Ca 0.05 -2.57 -0.51 0.00 -0.77 0.00 0.00 57.85 54.04 3d1h n ARG 94 Cb 0.44 -1.62 -0.06 0.00 -1.02 0.00 0.00 32.46 30.20 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 0.87 1.67 -0.56 5.56 4.07 -1.26 -0.79 120.64 130.21 3d1h n GLU 95 Ca 0.21 0.61 0.00 0.00 -0.06 0.00 0.00 57.16 57.91 3d1h n GLU 95 Cb 0.68 -2.35 0.00 0.00 -0.06 0.00 0.00 31.44 29.71 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 3.75 1.57 0.26 8.31 0.00 -1.26 -4.91 105.19 112.92 3d1h n GLY 96 Ca 0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.15 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 2.86 0.77 -0.09 1.61 2.86 -1.28 -1.61 114.93 120.06 3d1h h MET 97 Ca 0.00 -0.33 -0.04 0.00 -2.06 0.00 0.00 59.70 57.27 3d1h h MET 97 Cb 0.00 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 3d1h h MET 97 CO 0.00 0.95 -0.12 -0.44 1.06 0.00 0.00 176.91 178.36 3d1h h ASP 98 N 0.67 0.13 0.09 1.22 3.45 -1.78 -2.22 116.42 117.97 3d1h h ASP 98 Ca 0.09 -0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.52 3d1h h ASP 98 Cb 0.78 -0.03 0.00 0.00 -0.56 0.00 0.00 39.33 39.51 3d1h h ASP 98 CO 0.06 0.27 -0.36 0.00 -1.57 0.00 0.00 179.24 177.64 3d1h n ALA 99 N -2.50 3.31 0.15 3.45 0.00 -1.12 -4.48 120.51 119.33 3d1h n ALA 99 Ca -0.01 -0.54 -0.13 0.00 0.00 0.00 0.00 53.44 52.75 3d1h n ALA 99 Cb 0.23 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.67 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 1.97 -0.62 -1.88 0.00 5.85 -0.64 -3.47 115.31 116.52 3d1h h LEU 100 Ca 0.00 0.06 -0.20 0.00 0.84 0.00 0.00 57.88 58.58 3d1h h LEU 100 Cb 0.65 0.22 0.11 0.00 0.37 0.00 0.00 40.66 42.01 3d1h h LEU 100 CO 0.00 -0.33 -0.49 1.41 -0.34 0.00 0.00 178.44 178.69 3d1h n HIS 101 N -5.35 -1.39 -4.17 1.25 8.25 -1.26 -4.90 115.22 107.65 3d1h n HIS 101 Ca -0.08 0.58 -0.11 0.00 -0.26 0.00 0.00 57.72 57.86 3d1h n HIS 101 Cb 0.26 -3.89 -0.10 0.00 1.12 0.00 0.00 29.99 27.38 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 -3.23 0.70 0.24 1.59 -4.36 -1.26 -1.59 121.20 113.30 3d1h s ILE 102 Ca 0.03 -1.89 -0.08 0.00 -0.26 0.00 0.00 60.65 58.45 3d1h s ILE 102 Cb -0.00 -1.63 -0.02 0.00 1.25 0.00 0.00 42.46 42.06 3d1h s ILE 102 CO 0.46 -0.84 0.36 -0.94 0.24 0.00 0.00 174.94 174.22 3d1h s SER 103 N -2.97 0.10 0.11 4.36 1.04 -0.21 -1.08 113.70 115.05 3d1h s SER 103 Ca 0.11 -1.14 -0.13 0.00 0.48 0.00 0.00 55.95 55.27 3d1h s SER 103 Cb 0.04 0.53 0.02 0.00 0.10 0.00 0.00 66.02 66.71 3d1h s SER 103 CO -0.04 -1.06 0.32 -0.83 0.98 0.00 0.00 173.24 172.61 3d1h s GLY 104 N -3.09 -0.13 0.11 7.32 0.00 -0.04 -1.32 107.32 110.17 3d1h s GLY 104 Ca 0.29 -0.26 -0.25 0.00 0.00 0.00 0.00 44.72 44.50 3d1h s GLY 104 CO 0.11 -0.49 1.13 -1.35 0.00 0.00 0.00 173.10 172.50 3d1h s SER 105 N -2.80 -0.01 0.80 1.64 1.04 -0.72 -1.74 113.70 111.92 3d1h s SER 105 Ca 0.03 -0.47 -0.03 0.00 0.48 0.00 0.00 55.95 55.96 3d1h s SER 105 Cb 0.03 0.36 0.05 0.00 0.10 0.00 0.00 66.02 66.56 3d1h s SER 105 CO -0.11 -0.72 0.32 -1.54 0.98 0.00 0.00 173.24 172.17 3d1h n SER 106 N -1.08 0.15 -4.63 7.02 3.41 -0.47 -3.09 113.62 114.93 3d1h n SER 106 Ca -0.01 -1.19 -0.29 0.00 -0.26 0.00 0.00 58.87 57.11 3d1h n SER 106 Cb 0.59 -0.23 0.19 0.00 -0.26 0.00 0.00 64.21 64.50 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 -3.57 0.68 0.15 7.33 0.00 -0.51 -4.68 121.76 121.14 3d1h s ALA 107 Ca 0.19 -0.24 -0.14 0.00 0.00 0.00 0.00 51.96 51.77 3d1h s ALA 107 Cb -0.01 -3.17 0.02 0.00 0.00 0.00 0.00 23.12 19.97 3d1h s ALA 107 CO 0.13 -3.03 0.39 -0.59 0.00 0.00 0.00 175.76 172.66 3d1h s PHE 108 N -2.82 -0.04 0.69 0.00 -0.12 -1.26 -4.49 117.98 109.95 3d1h s PHE 108 Ca 0.66 -0.31 -0.09 0.00 -0.05 0.00 0.00 56.93 57.14 3d1h s PHE 108 Cb -0.20 0.20 0.04 0.00 -0.63 0.00 0.00 43.02 42.43 3d1h s PHE 108 CO 0.59 -0.74 1.04 0.95 -0.05 0.00 0.00 175.22 177.01 3d1h s THR 109 N -3.86 2.99 0.19 -4.49 -4.23 -1.26 -4.69 115.64 100.30 3d1h s THR 109 Ca 0.07 0.10 -0.12 0.00 -1.18 0.00 0.00 61.69 60.57 3d1h s THR 109 Cb 0.02 -3.28 0.11 0.00 1.34 0.00 0.00 72.50 70.68 3d1h s THR 109 CO -0.07 -0.33 1.82 -0.65 -0.54 0.00 0.00 174.62 174.84 3d1h h PRO 110 N -0.59 0.67 -0.78 3.99 0.11 -1.98 -1.60 132.00 131.82 3d1h h PRO 110 Ca -0.45 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.63 3d1h h PRO 110 Cb 1.28 -0.15 -0.04 0.00 0.11 0.00 0.00 31.00 32.20 3d1h h PRO 110 CO 0.63 0.44 0.52 0.00 -0.21 0.00 0.00 178.00 179.38 3d1h h ALA 111 N 1.28 0.99 -0.90 -0.75 0.00 -1.93 -1.60 119.26 116.35 3d1h h ALA 111 Ca 0.25 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 3d1h h ALA 111 Cb 0.06 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.50 3d1h h ALA 111 CO -0.12 0.40 0.48 1.96 0.00 0.00 0.00 179.25 181.97 3d1h h GLN 112 N 1.06 1.26 -0.29 0.00 4.20 -1.64 -1.65 115.11 118.04 3d1h h GLN 112 Ca 0.29 -0.15 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 3d1h h GLN 112 Cb -0.12 -0.24 -0.02 0.00 0.30 0.00 0.00 27.48 27.40 3d1h h GLN 112 CO -0.06 0.92 -0.14 1.25 -0.67 0.00 0.00 178.83 180.14 3d1h h LEU 113 N 1.26 0.48 -0.92 1.46 5.85 -0.71 -1.42 115.31 121.31 3d1h h LEU 113 Ca 0.31 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 3d1h h LEU 113 Cb 0.04 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.92 3d1h h LEU 113 CO -0.05 0.65 -0.11 0.11 -0.34 0.00 0.00 178.44 178.70 3d1h h LYS 114 N 0.46 0.67 -0.67 1.25 1.57 -0.66 -1.06 116.57 118.12 3d1h h LYS 114 Ca 0.08 -0.21 -0.08 0.00 -1.87 0.00 0.00 60.65 58.57 3d1h h LYS 114 Cb 0.51 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.73 3d1h h LYS 114 CO 0.03 0.77 0.11 -0.91 -0.57 0.00 0.00 179.45 178.88 3d1h h ASN 115 N 0.61 1.07 -0.15 0.86 2.35 -0.58 -1.50 115.58 118.24 3d1h h ASN 115 Ca 0.11 -0.25 -0.01 0.00 -0.55 0.00 0.00 56.30 55.59 3d1h h ASN 115 Cb 0.55 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.63 3d1h h ASN 115 CO 0.03 1.05 0.05 0.58 -1.65 0.00 0.00 177.43 177.50 3d1h h VAL 116 N 1.04 1.17 -0.39 2.81 2.07 -0.91 -1.94 116.25 120.10 3d1h h VAL 116 Ca 0.21 -0.53 0.03 0.00 0.82 0.00 0.00 66.70 67.22 3d1h h VAL 116 Cb 0.44 1.25 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 3d1h h VAL 116 CO 0.01 0.16 0.20 0.00 0.02 0.00 0.00 177.57 177.96 3d1h h ALA 117 N 0.87 0.49 -0.91 1.67 0.00 -1.07 0.22 119.26 120.53 3d1h h ALA 117 Ca 0.05 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.01 3d1h h ALA 117 Cb 0.21 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.88 3d1h h ALA 117 CO -0.00 -0.16 0.59 0.00 0.00 0.00 0.00 179.25 179.68 3d1h h ALA 118 N 1.20 1.21 -0.41 0.00 0.00 -1.20 0.30 119.26 120.37 3d1h h ALA 118 Ca 0.17 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 3d1h h ALA 118 Cb 0.07 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3d1h h ALA 118 CO -0.11 0.43 -0.03 -0.22 0.00 0.00 0.00 179.25 179.32 3d1h h LYS 119 N 1.13 0.74 -0.02 0.00 3.64 -0.50 -2.87 116.57 118.69 3d1h h LYS 119 Ca 0.37 -0.25 -0.12 0.00 -1.27 0.00 0.00 60.65 59.38 3d1h h LYS 119 Cb 0.03 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.78 3d1h h LYS 119 CO -0.13 0.84 -0.54 -0.07 -2.27 0.00 0.00 179.45 177.29 3d1h h LEU 120 N 0.56 0.06 -1.71 5.20 3.38 -0.03 -2.90 115.31 119.88 3d1h h LEU 120 Ca 0.11 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 3d1h h LEU 120 Cb 0.53 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 3d1h h LEU 120 CO 0.03 0.59 -0.15 -0.09 0.09 0.00 0.00 178.44 178.90 3d1h h ARG 121 N 0.04 0.00 0.00 1.13 9.65 -0.20 -0.45 114.38 124.55 3d1h h ARG 121 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3d1h h ARG 121 Cb 0.96 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.54 3d1h h ARG 121 CO 0.07 0.15 0.00 0.93 2.80 0.00 0.00 179.97 183.93 3d1h h GLU 122 N 0.00 0.00 -0.02 0.20 5.08 -1.39 -2.86 114.58 115.59 3d1h h GLU 122 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3d1h h GLU 122 Cb 0.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.52 3d1h h GLU 122 CO 0.02 0.00 -0.22 1.63 -1.00 0.00 0.00 179.01 179.44 3d1h n LYS 123 N -2.44 1.57 -3.51 2.33 5.02 -0.19 -5.01 118.16 115.92 3d1h n LYS 123 Ca 0.01 -1.10 -0.10 0.00 -2.02 0.00 0.00 58.31 55.09 3d1h n LYS 123 Cb 0.19 -1.31 -0.03 0.00 -0.02 0.00 0.00 35.03 33.86 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 -1.78 0.00 -0.74 -0.18 -1.32 -1.08 -5.00 115.64 105.54 3d1h s THR 124 Ca 0.16 0.00 0.12 0.00 -1.21 0.00 0.00 61.69 60.77 3d1h s THR 124 Cb 0.14 -1.00 0.37 0.00 -1.51 0.00 0.00 72.50 70.50 3d1h s THR 124 CO 0.35 0.00 1.30 0.00 -2.21 0.00 0.00 174.62 174.06 3d1h n ALA 125 N 0.04 2.39 -2.03 11.08 0.00 -1.26 -4.67 120.51 126.06 3d1h n ALA 125 Ca -0.11 -1.44 -0.20 0.00 0.00 0.00 0.00 53.44 51.70 3d1h n ALA 125 Cb 0.61 -0.51 0.06 0.00 0.00 0.00 0.00 19.45 19.61 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 -1.23 1.75 0.31 0.00 0.00 -1.26 -5.05 107.32 101.84 3d1h s GLY 126 Ca 0.28 -2.09 -0.29 0.00 0.00 0.00 0.00 44.72 42.62 3d1h s GLY 126 CO 0.14 -1.64 1.32 2.56 0.00 0.00 0.00 173.10 175.47 3d1h s PRO 127 N -4.67 4.36 -0.26 2.90 0.04 -1.26 -4.79 135.00 131.32 3d1h s PRO 127 Ca 0.62 2.20 -0.07 0.00 0.04 0.00 0.00 61.00 63.78 3d1h s PRO 127 Cb -0.06 -3.09 -0.02 0.00 0.04 0.00 0.00 34.50 31.37 3d1h s PRO 127 CO 0.39 -0.21 0.07 0.42 0.04 0.00 0.00 177.00 177.72 3d1h s ILE 128 N -0.88 4.23 -0.16 0.56 1.01 -1.26 -1.30 121.20 123.39 3d1h s ILE 128 Ca 0.51 -0.31 -0.07 0.00 0.00 0.00 0.00 60.65 60.78 3d1h s ILE 128 Cb -0.39 -3.03 -0.04 0.00 0.01 0.00 0.00 42.46 39.00 3d1h s ILE 128 CO 0.50 0.27 0.08 -0.31 0.00 0.00 0.00 174.94 175.48 3d1h s TYR 129 N 1.59 3.35 -0.52 3.97 1.51 -0.35 -0.21 117.35 126.69 3d1h s TYR 129 Ca 0.05 0.25 -0.23 0.00 -1.01 0.00 0.00 57.07 56.14 3d1h s TYR 129 Cb -0.16 -2.02 0.04 0.00 -0.11 0.00 0.00 41.96 39.72 3d1h s TYR 129 CO 0.03 0.37 0.83 0.34 -1.11 0.00 0.00 175.55 176.01 3d1h s ASP 130 N -0.16 6.32 -0.64 2.29 2.15 0.11 -0.94 116.67 125.80 3d1h s ASP 130 Ca 0.08 -0.47 -0.16 0.00 0.43 0.00 0.00 52.55 52.44 3d1h s ASP 130 Cb -0.12 -2.39 0.16 0.00 -0.30 0.00 0.00 42.92 40.27 3d1h s ASP 130 CO 0.01 -1.09 0.61 -0.69 -0.17 0.00 0.00 175.17 173.84 3d1h s VAL 131 N 3.48 5.32 -0.43 1.11 1.01 0.45 -1.54 120.40 129.81 3d1h s VAL 131 Ca 0.26 -1.80 -0.29 0.00 0.00 0.00 0.00 61.98 60.15 3d1h s VAL 131 Cb -0.14 -4.40 0.02 0.00 0.00 0.00 0.00 36.38 31.86 3d1h s VAL 131 CO 0.18 -0.94 1.33 -0.62 0.00 0.00 0.00 175.10 175.04 3d1h s ASP 132 N 3.12 6.44 -0.18 3.32 -1.08 -0.31 -2.21 116.67 125.77 3d1h s ASP 132 Ca 0.09 0.74 0.16 0.00 -0.52 0.00 0.00 52.55 53.02 3d1h s ASP 132 Cb -0.23 -2.54 0.77 0.00 -1.46 0.00 0.00 42.92 39.46 3d1h s ASP 132 CO -0.01 -1.36 1.69 0.18 0.52 0.00 0.00 175.17 176.18 3d1h n LEU 133 N 8.47 5.25 -4.63 -1.34 4.77 -0.87 0.06 117.00 128.72 3d1h n LEU 133 Ca 0.15 -2.73 -0.40 0.00 -0.03 0.00 0.00 56.01 53.00 3d1h n LEU 133 Cb 0.48 -0.63 -0.08 0.00 -2.33 0.00 0.00 43.42 40.86 3d1h n LEU 133 CO 0.70 0.71 0.20 -0.13 -1.33 0.00 0.00 177.39 177.55 3d1h s ARG 134 N -2.38 4.09 0.10 3.23 0.52 -1.17 -2.40 118.95 120.94 3d1h s ARG 134 Ca 0.53 0.28 -0.08 0.00 -0.52 0.00 0.00 55.73 55.93 3d1h s ARG 134 Cb 0.38 -3.63 -0.18 0.00 0.52 0.00 0.00 34.95 32.04 3d1h s ARG 134 CO 0.19 -0.28 1.23 0.37 0.02 0.00 0.00 175.30 176.83 3d1h h GLN 135 N 7.91 0.51 -6.87 3.54 4.15 -1.40 -3.41 115.11 119.54 3d1h h GLN 135 Ca -0.31 -0.59 -0.54 0.00 0.77 0.00 0.00 58.65 57.98 3d1h h GLN 135 Cb 1.15 0.18 0.10 0.00 0.21 0.00 0.00 27.48 29.12 3d1h h GLN 135 CO 0.71 1.22 0.77 -0.85 -1.93 0.00 0.00 178.83 178.74 3d1h n GLU 136 N -3.76 2.60 -1.86 1.69 0.00 -1.26 -4.81 120.64 113.24 3d1h n GLU 136 Ca -0.09 0.92 -0.42 0.00 0.00 0.00 0.00 57.16 57.57 3d1h n GLU 136 Cb 0.89 -2.64 -0.03 0.00 0.00 0.00 0.00 31.44 29.66 3d1h n GLU 136 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.13 176.01 3d1h s SER 137 N 0.03 6.54 0.21 -1.84 0.01 -1.26 -4.90 113.70 112.49 3d1h s SER 137 Ca 0.57 2.60 -0.11 0.00 1.31 0.00 0.00 55.95 60.32 3d1h s SER 137 Cb -0.50 -2.57 -0.01 0.00 0.21 0.00 0.00 66.02 63.16 3d1h s SER 137 CO 0.59 -0.91 0.38 -1.38 0.41 0.00 0.00 173.24 172.33 3d1h s HIS 138 N 2.34 0.42 -1.76 2.43 -0.00 -1.26 -0.13 115.29 117.33 3d1h s HIS 138 Ca 0.75 -0.77 0.00 0.00 -0.00 0.00 0.00 55.06 55.05 3d1h s HIS 138 Cb -0.43 0.05 0.00 0.00 -0.00 0.00 0.00 32.58 32.20 3d1h s HIS 138 CO 0.33 -0.86 0.00 0.41 -0.00 0.00 0.00 174.74 174.62 3d1h n GLY 139 N -0.32 -0.68 2.83 -1.38 0.00 -0.48 -4.59 105.19 100.58 3d1h n GLY 139 Ca -0.04 -0.48 -0.20 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.86 0.59 -0.30 1.61 2.02 -0.03 -1.08 117.35 116.30 3d1h s TYR 140 Ca 0.00 -0.13 -0.08 0.00 -0.37 0.00 0.00 57.07 56.49 3d1h s TYR 140 Cb 0.00 -0.64 0.00 0.00 -0.40 0.00 0.00 41.96 40.92 3d1h s TYR 140 CO 0.00 -0.22 0.11 -0.51 -1.57 0.00 0.00 175.55 173.36 3d1h s LEU 141 N 1.32 3.96 -1.54 -1.29 1.02 -0.14 -1.62 118.68 120.39 3d1h s LEU 141 Ca -0.05 -0.65 -0.14 0.00 0.02 0.00 0.00 54.13 53.31 3d1h s LEU 141 Cb -0.13 -1.93 0.09 0.00 0.02 0.00 0.00 46.19 44.24 3d1h s LEU 141 CO -0.02 -0.20 0.95 0.47 0.02 0.00 0.00 176.35 177.57 3d1h n ASP 142 N 4.91 -4.52 0.00 2.29 8.00 -0.01 -0.25 116.55 126.96 3d1h n ASP 142 Ca -0.14 -0.81 0.00 0.00 0.71 0.00 0.00 54.79 54.55 3d1h n ASP 142 Cb 0.48 -3.77 0.00 0.00 -0.02 0.00 0.00 41.12 37.81 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 -1.67 1.65 3.63 0.44 0.00 -1.26 -4.99 105.19 102.99 3d1h n GLY 143 Ca 0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.42 5.01 -0.20 -0.61 1.01 0.65 -4.33 121.20 119.31 3d1h s ILE 144 Ca 0.00 1.08 -0.29 0.00 0.00 0.00 0.00 60.65 61.44 3d1h s ILE 144 Cb 0.00 -3.91 -0.03 0.00 0.01 0.00 0.00 42.46 38.53 3d1h s ILE 144 CO 0.00 0.04 1.67 -2.16 0.00 0.00 0.00 174.94 174.49 3d1h s PRO 145 N 2.43 3.79 0.15 2.79 0.04 -1.26 -0.97 135.00 141.97 3d1h s PRO 145 Ca 0.25 1.75 0.05 0.00 0.04 0.00 0.00 61.00 63.09 3d1h s PRO 145 Cb -0.16 -4.06 -0.04 0.00 0.04 0.00 0.00 34.50 30.28 3d1h s PRO 145 CO 0.09 -1.30 -0.11 0.14 0.04 0.00 0.00 177.00 175.86 3d1h s VAL 146 N 5.29 1.22 0.02 -0.36 -7.23 -0.24 -0.14 120.40 118.95 3d1h s VAL 146 Ca 0.74 -2.05 0.01 0.00 -1.81 0.00 0.00 61.98 58.87 3d1h s VAL 146 Cb -0.27 -1.84 -0.02 0.00 0.56 0.00 0.00 36.38 34.82 3d1h s VAL 146 CO 0.30 -0.72 -0.04 -0.94 -0.31 0.00 0.00 175.10 173.39 3d1h s SER 147 N -3.13 0.42 -0.67 4.85 1.04 -0.65 -1.38 113.70 114.18 3d1h s SER 147 Ca 0.16 -0.36 -0.26 0.00 0.48 0.00 0.00 55.95 55.97 3d1h s SER 147 Cb 0.02 0.04 0.04 0.00 0.10 0.00 0.00 66.02 66.21 3d1h s SER 147 CO 0.01 -0.17 1.19 0.86 0.98 0.00 0.00 173.24 176.11 3d1h s TRP 148 N -0.97 2.46 -0.12 5.02 -0.00 0.81 -0.16 118.94 125.96 3d1h s TRP 148 Ca -0.09 -0.01 -0.17 0.00 -0.00 0.00 0.00 56.10 55.84 3d1h s TRP 148 Cb -0.07 -4.51 -0.04 0.00 -0.00 0.00 0.00 33.47 28.85 3d1h s TRP 148 CO -0.00 -1.84 0.42 -0.47 -0.00 0.00 0.00 176.95 175.05 3d1h s TYR 149 N 5.17 3.51 0.38 5.86 5.04 -0.09 -4.55 117.35 132.67 3d1h s TYR 149 Ca 0.35 0.81 0.07 0.00 -2.44 0.00 0.00 57.07 55.85 3d1h s TYR 149 Cb -0.09 -2.48 -0.07 0.00 0.35 0.00 0.00 41.96 39.66 3d1h s TYR 149 CO 0.17 0.21 0.01 0.20 -1.34 0.00 0.00 175.55 174.80 3d1h s GLY 150 N 0.49 2.37 0.25 8.97 0.00 -1.26 -0.31 107.32 117.83 3d1h s GLY 150 Ca 0.23 -2.23 -0.31 0.00 0.00 0.00 0.00 44.72 42.42 3d1h s GLY 150 CO 0.08 -2.03 1.28 1.18 0.00 0.00 0.00 173.10 173.62 3d1h n GLU 151 N -0.88 1.78 -1.14 2.90 1.02 -1.25 0.01 120.64 123.07 3d1h n GLU 151 Ca -0.04 0.63 -0.05 0.00 -0.02 0.00 0.00 57.16 57.68 3d1h n GLU 151 Cb 0.66 -2.20 -0.02 0.00 -0.02 0.00 0.00 31.44 29.86 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 1.55 -1.42 -2.75 3.49 1.74 -1.26 -2.06 116.66 115.95 3d1h n ARG 152 Ca 0.11 0.59 -0.20 0.00 -0.77 0.00 0.00 57.85 57.58 3d1h n ARG 152 Cb 0.31 -4.76 0.02 0.00 -1.02 0.00 0.00 32.46 27.01 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 -0.72 -5.68 -2.01 0.55 4.64 0.10 -4.84 116.55 108.58 3d1h n ASP 153 Ca -0.05 -0.18 -0.24 0.00 -1.38 0.00 0.00 54.79 52.94 3d1h n ASP 153 Cb 0.43 -4.58 0.12 0.00 -1.04 0.00 0.00 41.12 36.05 3d1h n ASP 153 CO 0.00 0.00 0.00 0.79 -0.82 0.00 0.00 177.20 177.17 3d1h n TRP 154 N -4.28 2.66 0.30 -0.67 8.01 -0.87 -4.55 117.44 118.03 3d1h n TRP 154 Ca -0.15 -2.30 0.18 0.00 -1.31 0.00 0.00 57.50 53.92 3d1h n TRP 154 Cb 0.63 -0.95 0.91 0.00 -2.01 0.00 0.00 31.31 29.90 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 1.56 1.10 -0.17 6.99 0.00 -1.79 -2.41 119.26 124.54 3d1h h ALA 155 Ca 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.38 3d1h h ALA 155 Cb 1.64 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.43 3d1h h ALA 155 CO 1.09 0.04 0.00 0.09 0.00 0.00 0.00 179.25 180.47 3d1h n ASN 156 N -3.27 3.20 -4.69 0.00 3.02 -1.26 -4.51 115.26 107.75 3d1h n ASN 156 Ca -0.02 -2.91 -0.44 0.00 -0.03 0.00 0.00 54.58 51.19 3d1h n ASN 156 Cb 0.19 -0.45 -0.02 0.00 -0.61 0.00 0.00 39.78 38.88 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 -0.74 3.42 0.00 3.41 7.94 -0.91 -1.79 117.00 128.34 3d1h n LEU 157 Ca 0.18 1.14 0.00 0.00 -1.11 0.00 0.00 56.01 56.22 3d1h n LEU 157 Cb 0.74 -1.47 0.00 0.00 0.53 0.00 0.00 43.42 43.22 3d1h n LEU 157 CO 0.09 -0.32 0.00 0.61 -1.11 0.00 0.00 177.39 176.66 3d1h n GLY 158 N 2.24 2.76 3.79 -3.96 0.00 -1.26 -4.68 105.19 104.09 3d1h n GLY 158 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.29 4.46 0.81 1.61 1.02 -0.74 -5.04 119.74 121.58 3d1h s LYS 159 Ca 0.00 1.25 -0.11 0.00 0.02 0.00 0.00 55.97 57.13 3d1h s LYS 159 Cb 0.00 -2.60 0.08 0.00 -0.52 0.00 0.00 37.83 34.79 3d1h s LYS 159 CO 0.00 0.18 1.10 -1.54 -0.92 0.00 0.00 175.35 174.17 3d1h s SER 160 N -1.80 4.16 0.28 2.83 1.04 -1.26 -4.75 113.70 114.20 3d1h s SER 160 Ca 0.54 1.79 0.02 0.00 0.48 0.00 0.00 55.95 58.77 3d1h s SER 160 Cb -0.15 -2.46 0.59 0.00 0.10 0.00 0.00 66.02 64.10 3d1h s SER 160 CO 0.20 -2.25 1.81 -0.61 0.98 0.00 0.00 173.24 173.37 3d1h h GLN 161 N -1.28 0.85 -0.33 4.02 4.15 -1.96 -0.94 115.11 119.62 3d1h h GLN 161 Ca -0.45 -0.05 0.01 0.00 0.77 0.00 0.00 58.65 58.93 3d1h h GLN 161 Cb 1.24 -0.19 -0.02 0.00 0.21 0.00 0.00 27.48 28.72 3d1h h GLN 161 CO 0.51 0.56 0.19 1.25 -1.93 0.00 0.00 178.83 179.42 3d1h h HIS 162 N 0.88 0.37 -0.27 3.99 2.76 -1.99 -0.87 115.15 120.01 3d1h h HIS 162 Ca 0.51 0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.58 3d1h h HIS 162 Cb 0.62 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 29.45 3d1h h HIS 162 CO -0.02 0.22 -0.31 0.93 -1.30 0.00 0.00 177.93 177.45 3d1h h GLU 163 N 0.40 0.56 -0.29 5.26 5.08 -1.67 -1.01 114.58 122.91 3d1h h GLU 163 Ca 0.13 -0.24 -0.05 0.00 -1.00 0.00 0.00 59.36 58.20 3d1h h GLU 163 Cb -0.00 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.22 3d1h h GLU 163 CO -0.06 0.80 0.00 0.00 -1.00 0.00 0.00 179.01 178.76 3d1h h ALA 164 N 1.19 0.38 -0.09 3.43 0.00 -0.88 -0.27 119.26 123.02 3d1h h ALA 164 Ca 0.06 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.65 3d1h h ALA 164 Cb 0.77 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3d1h h ALA 164 CO 0.06 0.13 -0.36 -0.07 0.00 0.00 0.00 179.25 179.00 3d1h h LEU 165 N 0.29 0.18 -0.39 0.00 4.07 -1.10 -1.07 115.31 117.29 3d1h h LEU 165 Ca 0.08 -0.07 -0.10 0.00 0.08 0.00 0.00 57.88 57.88 3d1h h LEU 165 Cb 0.43 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.10 3d1h h LEU 165 CO 0.01 0.54 -0.13 0.00 -1.08 0.00 0.00 178.44 177.79 3d1h h ALA 166 N 1.47 0.54 -0.70 1.53 0.00 -0.95 -0.90 119.26 120.25 3d1h h ALA 166 Ca 0.02 -0.33 0.02 0.00 0.00 0.00 0.00 54.91 54.62 3d1h h ALA 166 Cb 0.72 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 3d1h h ALA 166 CO 0.05 0.44 0.45 0.22 0.00 0.00 0.00 179.25 180.41 3d1h h ASP 167 N 0.58 0.76 0.38 0.00 1.82 -0.75 -0.81 116.42 118.41 3d1h h ASP 167 Ca 0.09 -0.01 -0.02 0.00 -0.39 0.00 0.00 57.03 56.71 3d1h h ASP 167 Cb 0.66 -0.17 -0.00 0.00 0.68 0.00 0.00 39.33 40.50 3d1h h ASP 167 CO 0.05 0.53 -0.21 -0.08 -1.61 0.00 0.00 179.24 177.92 3d1h h GLU 168 N 0.90 -0.53 -0.36 0.28 4.81 -0.98 0.26 114.58 118.95 3d1h h GLU 168 Ca 0.27 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.57 3d1h h GLU 168 Cb -0.03 0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.44 3d1h h GLU 168 CO -0.09 -0.35 0.16 0.00 -0.73 0.00 0.00 179.01 178.00 3d1h h ARG 169 N -0.55 0.33 -0.35 1.92 3.08 -1.03 -0.70 114.38 117.09 3d1h h ARG 169 Ca -0.05 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 3d1h h ARG 169 Cb 0.44 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.40 3d1h h ARG 169 CO 0.06 0.22 0.16 0.45 -1.07 0.00 0.00 179.97 179.80 3d1h h HIS 170 N 0.34 0.51 -0.64 3.04 3.86 -0.89 -1.46 115.15 119.92 3d1h h HIS 170 Ca 0.16 -0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.27 3d1h h HIS 170 Cb 0.09 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.38 3d1h h HIS 170 CO -0.11 0.45 0.11 0.00 0.86 0.00 0.00 177.93 179.24 3d1h h ARG 171 N 0.43 1.05 -0.16 2.45 3.08 -0.29 -1.51 114.38 119.42 3d1h h ARG 171 Ca 0.12 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 3d1h h ARG 171 Cb 0.13 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 3d1h h ARG 171 CO -0.01 0.97 0.05 -0.07 -1.07 0.00 0.00 179.97 179.84 3d1h h LEU 172 N 0.97 0.23 -0.99 3.04 3.38 -0.99 -2.83 115.31 118.12 3d1h h LEU 172 Ca 0.19 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3d1h h LEU 172 Cb 0.42 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 3d1h h LEU 172 CO 0.01 0.37 0.56 -0.74 0.09 0.00 0.00 178.44 178.73 3d1h h HIS 173 N 0.08 1.21 0.00 1.13 2.76 -1.19 -1.75 115.15 117.40 3d1h h HIS 173 Ca 0.05 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.22 3d1h h HIS 173 Cb 0.22 -0.40 0.00 0.00 1.55 0.00 0.00 27.41 28.78 3d1h h HIS 173 CO -0.00 0.80 0.00 0.00 -1.30 0.00 0.00 177.93 177.43 3d1h h ALA 174 N 1.34 1.00 0.00 5.26 0.00 -1.07 -2.32 119.26 123.47 3d1h h ALA 174 Ca 0.33 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.17 3d1h h ALA 174 Cb -0.06 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3d1h h ALA 174 CO -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 179.25 178.87 3d1h h ALA 175 N 2.02 0.82 -2.46 0.00 0.00 -1.08 -3.44 119.26 115.12 3d1h h ALA 175 Ca 0.00 -0.29 -0.54 0.00 0.00 0.00 0.00 54.91 54.08 3d1h h ALA 175 Cb 0.25 -0.05 0.04 0.00 0.00 0.00 0.00 17.79 18.03 3d1h h ALA 175 CO 0.00 0.40 1.10 -0.11 0.00 0.00 0.00 179.25 180.64 3d1h n LEU 176 N -3.21 3.99 -0.97 0.00 7.94 -0.87 -1.29 117.00 122.59 3d1h n LEU 176 Ca 0.02 0.99 -0.12 0.00 -1.11 0.00 0.00 56.01 55.79 3d1h n LEU 176 Cb 0.63 -1.53 -0.04 0.00 0.53 0.00 0.00 43.42 43.00 3d1h n LEU 176 CO 0.38 0.15 -0.12 1.41 -1.11 0.00 0.00 177.39 178.10 3d1h n HIS 177 N 5.65 -0.09 -4.45 1.96 8.25 0.24 -4.98 115.22 121.80 3d1h n HIS 177 Ca 0.18 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.41 3d1h n HIS 177 Cb 0.37 -2.25 -0.10 0.00 1.12 0.00 0.00 29.99 29.13 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 -3.25 1.63 -0.03 -0.41 -0.14 -0.41 -4.84 119.74 112.29 3d1h s LYS 178 Ca 0.00 -1.75 -0.25 0.00 -1.36 0.00 0.00 55.97 52.61 3d1h s LYS 178 Cb 0.00 -1.67 -0.04 0.00 -1.68 0.00 0.00 37.83 34.44 3d1h s LYS 178 CO 0.00 0.30 0.79 0.99 -0.76 0.00 0.00 175.35 176.67 3d1h s THR 179 N -2.58 4.94 0.08 2.17 2.01 -1.26 -1.47 115.64 119.54 3d1h s THR 179 Ca 0.29 1.64 0.05 0.00 0.31 0.00 0.00 61.69 63.98 3d1h s THR 179 Cb -0.04 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.31 3d1h s THR 179 CO 0.14 0.25 -0.13 0.68 -0.69 0.00 0.00 174.62 174.87 3d1h s VAL 180 N 0.70 1.07 -0.26 3.82 -7.23 0.11 -4.96 120.40 113.64 3d1h s VAL 180 Ca 0.41 -1.40 -0.08 0.00 -1.81 0.00 0.00 61.98 59.10 3d1h s VAL 180 Cb -0.19 -1.15 -0.02 0.00 0.56 0.00 0.00 36.38 35.58 3d1h s VAL 180 CO 0.22 -0.32 0.09 -0.47 -0.31 0.00 0.00 175.10 174.30 3d1h s TYR 181 N -1.61 3.11 -0.21 2.82 5.04 -1.26 -1.62 117.35 123.62 3d1h s TYR 181 Ca 0.00 -0.48 -0.02 0.00 -2.44 0.00 0.00 57.07 54.13 3d1h s TYR 181 Cb -0.08 -2.26 -0.00 0.00 0.35 0.00 0.00 41.96 39.97 3d1h s TYR 181 CO 0.02 -0.39 -0.09 0.42 -1.34 0.00 0.00 175.55 174.17 3d1h s ILE 182 N 1.61 3.00 0.02 3.14 1.01 0.14 -3.75 121.20 126.37 3d1h s ILE 182 Ca 0.06 -0.62 -0.04 0.00 0.00 0.00 0.00 60.65 60.05 3d1h s ILE 182 Cb -0.16 -2.34 -0.01 0.00 0.01 0.00 0.00 42.46 39.96 3d1h s ILE 182 CO 0.04 0.46 0.05 0.00 0.00 0.00 0.00 174.94 175.49 3d1h s ALA 183 N 1.42 -0.06 0.49 9.38 0.00 -0.83 -0.92 121.76 131.23 3d1h s ALA 183 Ca 0.05 -0.44 -0.10 0.00 0.00 0.00 0.00 51.96 51.47 3d1h s ALA 183 Cb -0.14 0.16 -0.06 0.00 0.00 0.00 0.00 23.12 23.08 3d1h s ALA 183 CO -0.06 -0.21 0.87 -1.25 0.00 0.00 0.00 175.76 175.10 3d1h s PRO 184 N -1.72 3.72 0.18 0.00 0.04 -1.26 -0.99 135.00 134.97 3d1h s PRO 184 Ca -0.13 0.55 -0.16 0.00 0.04 0.00 0.00 61.00 61.31 3d1h s PRO 184 Cb -0.07 -2.28 -0.07 0.00 0.04 0.00 0.00 34.50 32.12 3d1h s PRO 184 CO -0.01 -0.23 0.61 -0.51 0.04 0.00 0.00 177.00 176.90 3d1h s LEU 185 N -4.37 4.32 0.00 -3.56 1.43 -1.26 -1.88 118.68 113.36 3d1h s LEU 185 Ca 0.52 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 54.81 3d1h s LEU 185 Cb -0.10 -3.41 0.00 0.00 0.03 0.00 0.00 46.19 42.70 3d1h s LEU 185 CO 0.39 0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.64 3d1h n GLY 186 N 0.69 2.67 3.68 -3.19 0.00 -0.09 -4.86 105.19 104.09 3d1h n GLY 186 Ca -0.04 -0.25 -0.47 0.00 0.00 0.00 0.00 46.02 45.26 3d1h n GLY 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3d1h n LYS 187 N 0.00 2.22 -4.00 1.61 5.02 -1.26 -2.55 118.16 119.20 3d1h n LYS 187 Ca 0.00 0.81 -0.29 0.00 -2.02 0.00 0.00 58.31 56.81 3d1h n LYS 187 Cb 0.00 -2.63 -0.01 0.00 -0.02 0.00 0.00 35.03 32.37 3d1h n LYS 187 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 3d1h n HIS 188 N 5.42 -1.85 -2.85 2.13 8.25 -1.26 -2.12 115.22 122.93 3d1h n HIS 188 Ca 0.20 0.81 -0.20 0.00 -0.26 0.00 0.00 57.72 58.27 3d1h n HIS 188 Cb 0.30 -3.63 0.01 0.00 1.12 0.00 0.00 29.99 27.79 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 -4.45 -3.30 -4.35 -0.41 4.76 -1.06 -4.98 118.16 104.37 3d1h n LYS 189 Ca -0.11 0.74 -0.29 0.00 -2.87 0.00 0.00 58.31 55.78 3d1h n LYS 189 Cb 0.59 -5.47 -0.12 0.00 -1.84 0.00 0.00 35.03 28.20 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 -6.26 2.57 0.30 -0.35 1.43 -0.90 -4.85 118.68 110.63 3d1h s LEU 190 Ca 0.20 -0.67 -0.27 0.00 -1.03 0.00 0.00 54.13 52.35 3d1h s LEU 190 Cb -0.10 -1.40 -0.14 0.00 0.03 0.00 0.00 46.19 44.59 3d1h s LEU 190 CO 0.25 0.16 0.92 -2.65 0.23 0.00 0.00 176.35 175.26 3d1h n PRO 191 N 0.65 1.15 -3.59 1.29 -0.02 -1.26 -0.92 135.00 132.30 3d1h n PRO 191 Ca -0.15 0.41 -0.23 0.00 -2.02 0.00 0.00 63.50 61.50 3d1h n PRO 191 Cb 0.54 -1.75 -0.16 0.00 -0.02 0.00 0.00 33.50 32.11 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 -1.54 0.08 7.59 -0.52 2.12 -0.79 -4.72 118.70 120.92 3d1h s GLU 192 Ca 0.60 0.05 0.00 0.00 0.36 0.00 0.00 54.97 55.98 3d1h s GLU 192 Cb -0.70 -1.52 0.00 0.00 0.26 0.00 0.00 34.13 32.17 3d1h s GLU 192 CO 0.59 -0.63 0.00 0.41 -0.54 0.00 0.00 175.26 175.09 3d1h n GLY 193 N 5.29 2.95 0.14 -1.50 0.00 -1.26 -4.18 105.19 106.63 3d1h n GLY 193 Ca -0.06 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 0.03 3.45 -0.02 0.00 -1.26 -4.75 105.19 102.64 3d1h n GLY 194 Ca 0.00 -1.80 -0.11 0.00 0.00 0.00 0.00 46.02 44.11 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 1.30 -0.07 1.61 -1.05 -0.09 -4.99 118.70 115.40 3d1h s GLU 195 Ca 0.00 -0.60 0.04 0.00 -0.15 0.00 0.00 54.97 54.27 3d1h s GLU 195 Cb 0.00 0.56 -0.00 0.00 -0.44 0.00 0.00 34.13 34.25 3d1h s GLU 195 CO 0.00 -0.56 -0.20 0.08 0.95 0.00 0.00 175.26 175.53 3d1h s VAL 196 N -3.79 1.73 0.19 1.83 1.01 -1.26 -0.68 120.40 119.43 3d1h s VAL 196 Ca 0.03 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 61.01 3d1h s VAL 196 Cb -0.01 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.89 3d1h s VAL 196 CO -0.10 0.49 0.44 0.00 0.00 0.00 0.00 175.10 175.93 3d1h s ARG 197 N 0.22 1.31 -0.39 2.72 1.70 -0.64 -4.96 118.95 118.91 3d1h s ARG 197 Ca -0.11 -0.99 -0.11 0.00 -0.47 0.00 0.00 55.73 54.05 3d1h s ARG 197 Cb -0.15 0.47 0.04 0.00 -0.57 0.00 0.00 34.95 34.74 3d1h s ARG 197 CO 0.05 -0.53 0.23 0.50 -1.08 0.00 0.00 175.30 174.47 3d1h s ARG 198 N -3.91 2.78 0.20 3.89 3.52 -1.26 0.05 118.95 124.22 3d1h s ARG 198 Ca 0.12 -1.18 -0.31 0.00 -0.13 0.00 0.00 55.73 54.23 3d1h s ARG 198 Cb 0.00 -3.77 -0.10 0.00 -1.56 0.00 0.00 34.95 29.52 3d1h s ARG 198 CO -0.01 -0.78 1.57 0.08 -0.81 0.00 0.00 175.30 175.35 3d1h s VAL 199 N 1.53 2.48 -0.29 7.11 1.01 -0.54 -4.86 120.40 126.84 3d1h s VAL 199 Ca 0.02 0.36 0.08 0.00 0.00 0.00 0.00 61.98 62.45 3d1h s VAL 199 Cb -0.20 -3.23 -0.10 0.00 0.00 0.00 0.00 36.38 32.84 3d1h s VAL 199 CO 0.06 0.04 0.31 0.00 0.00 0.00 0.00 175.10 175.51 3d1h n GLN 200 N 3.50 3.21 -3.74 2.72 1.13 -1.26 0.82 117.38 123.77 3d1h n GLN 200 Ca 0.12 -0.02 -0.12 0.00 -1.94 0.00 0.00 57.00 55.04 3d1h n GLN 200 Cb 0.38 -0.97 -0.11 0.00 0.11 0.00 0.00 30.24 29.65 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 -2.00 0.37 -0.04 -1.09 2.20 -1.26 -4.89 119.74 113.02 3d1h s LYS 201 Ca 0.02 0.56 0.03 0.00 -0.36 0.00 0.00 55.97 56.22 3d1h s LYS 201 Cb 0.06 0.09 0.00 0.00 -1.51 0.00 0.00 37.83 36.47 3d1h s LYS 201 CO 0.35 -0.09 -0.14 0.08 -0.36 0.00 0.00 175.35 175.18 3d1h s VAL 202 N 0.67 1.23 0.01 4.02 1.01 -1.26 -0.83 120.40 125.25 3d1h s VAL 202 Ca -0.04 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 3d1h s VAL 202 Cb -0.05 -1.08 -0.01 0.00 0.00 0.00 0.00 36.38 35.24 3d1h s VAL 202 CO -0.04 0.36 -0.01 -1.10 0.00 0.00 0.00 175.10 174.31 3d1h s GLN 203 N 0.20 0.27 0.50 2.72 -0.21 -0.64 -5.00 119.66 117.49 3d1h s GLN 203 Ca -0.06 -0.48 -0.03 0.00 0.02 0.00 0.00 55.36 54.81 3d1h s GLN 203 Cb -0.12 0.10 -0.01 0.00 1.00 0.00 0.00 33.01 33.98 3d1h s GLN 203 CO 0.02 -0.05 0.77 0.95 -2.12 0.00 0.00 175.29 174.87 3d1h s THR 204 N -1.18 4.18 0.41 -0.19 -4.23 -1.26 -0.85 115.64 112.51 3d1h s THR 204 Ca -0.13 -0.15 0.17 0.00 -1.18 0.00 0.00 61.69 60.40 3d1h s THR 204 Cb -0.08 -3.59 0.19 0.00 1.34 0.00 0.00 72.50 70.36 3d1h s THR 204 CO -0.01 -0.52 1.96 -0.08 -0.54 0.00 0.00 174.62 175.44 3d1h h GLU 205 N 0.18 0.00 -0.31 3.99 4.81 -1.92 -2.38 114.58 118.96 3d1h h GLU 205 Ca -0.46 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 58.78 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 0.60 0.22 0.16 0.37 -0.73 0.00 0.00 179.01 179.63 3d1h h GLN 206 N 0.00 0.33 -0.62 1.92 4.15 -1.97 0.28 115.11 119.19 3d1h h GLN 206 Ca -0.00 -0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.41 3d1h h GLN 206 Cb 0.43 -0.07 -0.03 0.00 0.21 0.00 0.00 27.48 28.01 3d1h h GLN 206 CO 0.03 0.22 0.41 0.93 -1.93 0.00 0.00 178.83 178.48 3d1h h GLU 207 N 0.34 0.80 -0.79 1.69 5.08 -1.85 -0.49 114.58 119.35 3d1h h GLU 207 Ca 0.12 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 3d1h h GLU 207 Cb 0.03 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 3d1h h GLU 207 CO -0.08 0.53 0.30 0.28 -1.00 0.00 0.00 179.01 179.04 3d1h h VAL 208 N 0.82 1.26 -0.12 3.13 2.07 -0.88 -0.75 116.25 121.79 3d1h h VAL 208 Ca 0.23 -0.86 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 3d1h h VAL 208 Cb -0.07 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.03 3d1h h VAL 208 CO -0.06 0.35 0.04 0.00 0.02 0.00 0.00 177.57 177.92 3d1h h ALA 209 N 1.16 0.16 -0.04 1.67 0.00 0.01 -2.24 119.26 119.99 3d1h h ALA 209 Ca 0.26 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 3d1h h ALA 209 Cb 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3d1h h ALA 209 CO -0.02 -0.23 -0.14 0.93 0.00 0.00 0.00 179.25 179.78 3d1h h GLU 210 N 0.02 0.06 0.00 0.00 5.08 -0.92 0.18 114.58 119.00 3d1h h GLU 210 Ca 0.04 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 3d1h h GLU 210 Cb 0.21 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 3d1h h GLU 210 CO -0.00 0.21 -0.18 0.00 -1.00 0.00 0.00 179.01 178.03 3d1h h ALA 211 N 1.80 1.05 -0.17 3.43 0.00 -0.83 -1.95 119.26 122.60 3d1h h ALA 211 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3d1h h ALA 211 Cb 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3d1h h ALA 211 CO 0.02 0.23 0.00 0.00 0.00 0.00 0.00 179.25 179.50 3d1h n ALA 212 N -2.21 2.51 -1.69 0.00 0.00 -0.09 -4.93 120.51 114.09 3d1h n ALA 212 Ca -0.00 -0.58 -0.03 0.00 0.00 0.00 0.00 53.44 52.83 3d1h n ALA 212 Cb 0.39 -1.06 -0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 1.20 0.38 3.49 0.00 0.00 -0.73 -4.82 105.19 104.70 3d1h n GLY 213 Ca 0.17 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 45.04 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 -3.43 2.05 0.67 1.61 -1.94 -0.34 -4.74 119.30 113.17 3d1h s MET 214 Ca 0.00 -1.01 -0.12 0.00 -1.71 0.00 0.00 55.69 52.85 3d1h s MET 214 Cb 0.00 -2.21 -0.01 0.00 2.01 0.00 0.00 34.83 34.62 3d1h s MET 214 CO 0.00 0.53 1.05 1.03 -0.01 0.00 0.00 175.02 177.62 3d1h s ARG 215 N -1.71 3.09 -0.04 2.03 0.52 0.70 -3.38 118.95 120.17 3d1h s ARG 215 Ca 0.16 0.97 0.05 0.00 -0.52 0.00 0.00 55.73 56.40 3d1h s ARG 215 Cb -0.11 -2.01 -0.01 0.00 0.52 0.00 0.00 34.95 33.35 3d1h s ARG 215 CO 0.08 -0.98 -0.20 -0.47 0.02 0.00 0.00 175.30 173.75 3d1h s TYR 216 N -2.96 1.88 -0.05 -0.53 5.04 -1.26 0.06 117.35 119.54 3d1h s TYR 216 Ca 0.59 -0.48 -0.02 0.00 -2.44 0.00 0.00 57.07 54.72 3d1h s TYR 216 Cb -0.14 -1.24 0.03 0.00 0.35 0.00 0.00 41.96 40.97 3d1h s TYR 216 CO 0.51 -0.13 0.08 0.12 -1.34 0.00 0.00 175.55 174.80 3d1h s PHE 217 N -0.19 -0.01 -0.18 4.97 5.36 -0.59 -4.95 117.98 122.40 3d1h s PHE 217 Ca 0.00 0.31 -0.07 0.00 -0.96 0.00 0.00 56.93 56.21 3d1h s PHE 217 Cb -0.11 -0.35 -0.04 0.00 -0.34 0.00 0.00 43.02 42.18 3d1h s PHE 217 CO 0.01 -0.18 0.06 0.50 -1.46 0.00 0.00 175.22 174.16 3d1h s ARG 218 N 1.86 3.98 -0.21 10.12 6.06 -1.26 -1.17 118.95 138.33 3d1h s ARG 218 Ca 0.00 -0.34 -0.00 0.00 -2.50 0.00 0.00 55.73 52.90 3d1h s ARG 218 Cb -0.12 -3.22 0.06 0.00 0.06 0.00 0.00 34.95 31.72 3d1h s ARG 218 CO -0.04 0.28 -0.04 0.42 -2.50 0.00 0.00 175.30 173.43 3d1h s ILE 219 N 0.35 1.27 -1.28 4.11 1.01 0.11 -4.99 121.20 121.79 3d1h s ILE 219 Ca 0.03 -0.99 -0.19 0.00 0.00 0.00 0.00 60.65 59.51 3d1h s ILE 219 Cb -0.12 -1.56 0.05 0.00 0.01 0.00 0.00 42.46 40.84 3d1h s ILE 219 CO -0.00 -0.07 1.75 0.00 0.00 0.00 0.00 174.94 176.61 3d1h s ALA 220 N 1.52 3.14 -0.12 9.38 0.00 -1.26 -3.05 121.76 131.37 3d1h s ALA 220 Ca -0.04 -2.82 -0.12 0.00 0.00 0.00 0.00 51.96 48.99 3d1h s ALA 220 Cb -0.18 -4.65 -0.05 0.00 0.00 0.00 0.00 23.12 18.25 3d1h s ALA 220 CO -0.07 -3.50 0.25 0.00 0.00 0.00 0.00 175.76 172.44 3d1h s ALA 221 N 4.93 3.71 0.18 0.00 0.00 -1.01 -4.54 121.76 125.03 3d1h s ALA 221 Ca 0.55 -0.49 -0.30 0.00 0.00 0.00 0.00 51.96 51.72 3d1h s ALA 221 Cb 0.03 -2.24 -0.08 0.00 0.00 0.00 0.00 23.12 20.83 3d1h s ALA 221 CO 0.08 0.32 1.24 0.99 0.00 0.00 0.00 175.76 178.39 3d1h s THR 222 N -0.26 3.46 0.51 0.00 2.01 -1.26 -1.28 115.64 118.82 3d1h s THR 222 Ca 0.16 1.20 -0.23 0.00 0.31 0.00 0.00 61.69 63.13 3d1h s THR 222 Cb -0.13 -3.77 -0.06 0.00 0.01 0.00 0.00 72.50 68.55 3d1h s THR 222 CO 0.05 0.18 1.36 -0.62 -0.69 0.00 0.00 174.62 174.89 3d1h s ASP 223 N 0.28 5.52 0.00 3.53 -1.08 -1.26 -3.40 116.67 120.26 3d1h s ASP 223 Ca 0.55 2.76 0.00 0.00 -0.52 0.00 0.00 52.55 55.34 3d1h s ASP 223 Cb -0.34 -2.64 0.00 0.00 -1.46 0.00 0.00 42.92 38.48 3d1h s ASP 223 CO 0.37 -1.40 0.00 1.41 0.52 0.00 0.00 175.17 176.07 3d1h n HIS 224 N -0.75 0.00 -4.49 -5.34 8.25 -1.26 -4.97 115.22 106.66 3d1h n HIS 224 Ca 0.09 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.31 3d1h n HIS 224 Cb 0.44 -0.35 -0.11 0.00 1.12 0.00 0.00 29.99 31.09 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 -2.61 1.71 0.24 1.59 -7.23 -1.22 -4.81 120.40 108.07 3d1h s VAL 225 Ca 0.00 -2.09 -0.30 0.00 -1.81 0.00 0.00 61.98 57.78 3d1h s VAL 225 Cb 0.00 -2.66 -0.10 0.00 0.56 0.00 0.00 36.38 34.17 3d1h s VAL 225 CO 0.00 -0.16 1.51 0.86 -0.31 0.00 0.00 175.10 177.00 3d1h s TRP 226 N -2.95 2.96 0.34 2.82 -0.11 -1.26 -4.83 118.94 115.90 3d1h s TRP 226 Ca 0.33 0.87 -0.28 0.00 1.22 0.00 0.00 56.10 58.23 3d1h s TRP 226 Cb 0.06 -3.91 -0.12 0.00 -1.50 0.00 0.00 33.47 28.00 3d1h s TRP 226 CO 0.15 -3.08 1.37 -2.30 -4.62 0.00 0.00 176.95 168.46 3d1h n PRO 227 N 2.68 2.30 -1.01 5.86 -0.02 -1.26 -4.95 135.00 138.60 3d1h n PRO 227 Ca 0.09 0.81 -0.30 0.00 -2.02 0.00 0.00 63.50 62.08 3d1h n PRO 227 Cb 0.39 -2.45 0.16 0.00 -0.02 0.00 0.00 33.50 31.58 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 -0.93 2.50 0.38 3.45 -4.23 -1.26 -4.77 115.64 110.78 3d1h s THR 228 Ca 0.57 0.16 0.06 0.00 -1.18 0.00 0.00 61.69 61.30 3d1h s THR 228 Cb -0.55 -2.49 0.24 0.00 1.34 0.00 0.00 72.50 71.04 3d1h s THR 228 CO 0.61 -0.21 2.01 -0.65 -0.54 0.00 0.00 174.62 175.83 3d1h h PRO 229 N -1.75 0.58 -0.36 3.99 0.11 -1.93 -1.27 132.00 131.35 3d1h h PRO 229 Ca -0.50 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.53 3d1h h PRO 229 Cb 1.28 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 3d1h h PRO 229 CO 0.51 0.43 0.13 0.93 -0.21 0.00 0.00 178.00 179.80 3d1h h GLU 230 N 0.58 0.55 -0.53 1.05 3.07 -1.99 0.16 114.58 117.48 3d1h h GLU 230 Ca 0.15 -0.11 0.04 0.00 -0.50 0.00 0.00 59.36 58.94 3d1h h GLU 230 Cb 0.03 -0.09 -0.04 0.00 -0.84 0.00 0.00 28.75 27.82 3d1h h GLU 230 CO -0.02 0.55 0.30 -0.91 -1.40 0.00 0.00 179.01 177.52 3d1h h ASN 231 N 0.44 0.46 -0.19 1.42 -0.26 -1.64 -1.65 115.58 114.16 3d1h h ASN 231 Ca 0.12 0.02 -0.16 0.00 -0.56 0.00 0.00 56.30 55.71 3d1h h ASN 231 Cb 0.21 -0.08 0.00 0.00 -1.06 0.00 0.00 38.32 37.40 3d1h h ASN 231 CO -0.01 0.32 -0.52 0.40 -1.06 0.00 0.00 177.43 176.56 3d1h h ILE 232 N 0.58 1.31 -0.60 2.81 2.04 -1.08 -2.06 117.51 120.52 3d1h h ILE 232 Ca 0.22 -1.75 0.05 0.00 1.00 0.00 0.00 64.86 64.38 3d1h h ILE 232 Cb 0.08 1.90 -0.05 0.00 -0.74 0.00 0.00 36.82 38.01 3d1h h ILE 232 CO -0.13 0.55 0.33 0.44 0.00 0.00 0.00 178.15 179.34 3d1h h ASP 233 N 0.39 0.49 -0.88 1.72 5.19 -0.58 0.06 116.42 122.80 3d1h h ASP 233 Ca -0.01 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.40 3d1h h ASP 233 Cb 1.14 -0.07 -0.04 0.00 0.18 0.00 0.00 39.33 40.53 3d1h h ASP 233 CO 0.11 0.33 0.47 -0.09 -3.12 0.00 0.00 179.24 176.94 3d1h h ARG 234 N 0.62 1.23 -0.22 3.56 2.43 -1.24 -1.30 114.38 119.46 3d1h h ARG 234 Ca 0.26 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 59.24 3d1h h ARG 234 Cb 0.14 -0.24 -0.01 0.00 -0.42 0.00 0.00 29.97 29.44 3d1h h ARG 234 CO -0.16 0.91 -0.03 0.35 -1.51 0.00 0.00 179.97 179.53 3d1h h PHE 235 N 1.24 0.46 -0.39 2.20 3.57 -0.59 -2.04 116.94 121.39 3d1h h PHE 235 Ca 0.31 -0.09 -0.07 0.00 3.53 0.00 0.00 57.97 61.65 3d1h h PHE 235 Cb 0.04 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.65 3d1h h PHE 235 CO 0.01 0.63 -0.04 -0.07 -2.23 0.00 0.00 178.31 176.61 3d1h h LEU 236 N 0.16 0.62 -0.26 0.59 3.38 -0.90 0.37 115.31 119.27 3d1h h LEU 236 Ca 0.06 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 3d1h h LEU 236 Cb 0.47 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3d1h h LEU 236 CO 0.02 0.71 0.13 0.00 0.09 0.00 0.00 178.44 179.39 3d1h h ALA 237 N 1.36 0.33 -0.37 1.53 0.00 -1.16 -2.16 119.26 118.79 3d1h h ALA 237 Ca 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 3d1h h ALA 237 Cb 0.44 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 3d1h h ALA 237 CO 0.02 -0.12 0.21 0.35 0.00 0.00 0.00 179.25 179.71 3d1h h PHE 238 N 0.28 0.50 -0.91 0.00 3.04 -0.90 -2.94 116.94 116.02 3d1h h PHE 238 Ca 0.09 -0.01 0.09 0.00 3.98 0.00 0.00 57.97 62.12 3d1h h PHE 238 Cb 0.11 -0.16 -0.07 0.00 2.56 0.00 0.00 35.95 38.38 3d1h h PHE 238 CO -0.02 0.39 0.56 -0.92 -2.02 0.00 0.00 178.31 176.29 3d1h h TYR 239 N 0.47 1.02 0.00 0.41 3.20 -0.10 -1.10 116.97 120.87 3d1h h TYR 239 Ca 0.13 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.03 3d1h h TYR 239 Cb 0.05 -0.32 0.00 0.00 1.54 0.00 0.00 36.73 37.99 3d1h h TYR 239 CO -0.03 0.45 0.00 2.89 -1.64 0.00 0.00 178.16 179.83 3d1h n ARG 240 N -4.64 0.16 0.00 1.82 1.85 -0.83 -2.51 116.66 112.50 3d1h n ARG 240 Ca 0.15 0.30 0.13 0.00 -1.00 0.00 0.00 57.85 57.43 3d1h n ARG 240 Cb 0.26 -1.76 0.35 0.00 -1.05 0.00 0.00 32.46 30.27 3d1h n ARG 240 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 3d1h n THR 241 N -2.05 0.00 -2.28 8.89 -2.24 -0.42 -4.94 114.28 111.24 3d1h n THR 241 Ca 0.04 -0.02 -0.41 0.00 -2.27 0.00 0.00 64.05 61.39 3d1h n THR 241 Cb 0.28 0.12 -0.03 0.00 -2.10 0.00 0.00 70.33 68.60 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 -2.91 4.47 0.88 3.22 1.43 -1.05 -5.01 118.68 119.71 3d1h s LEU 242 Ca 0.14 2.44 -0.11 0.00 -1.03 0.00 0.00 54.13 55.56 3d1h s LEU 242 Cb 0.18 -3.63 0.12 0.00 0.03 0.00 0.00 46.19 42.89 3d1h s LEU 242 CO 0.64 -0.39 1.09 -2.16 0.23 0.00 0.00 176.35 175.76 3d1h s PRO 243 N -1.08 1.38 0.23 1.29 0.04 -1.26 -4.92 135.00 130.68 3d1h s PRO 243 Ca 0.50 0.92 -0.06 0.00 0.04 0.00 0.00 61.00 62.39 3d1h s PRO 243 Cb -0.36 -1.82 0.31 0.00 0.04 0.00 0.00 34.50 32.67 3d1h s PRO 243 CO 0.44 -2.18 1.84 0.37 0.04 0.00 0.00 177.00 177.50 3d1h h GLN 244 N -1.51 0.87 -0.63 4.56 4.15 -2.00 -2.23 115.11 118.33 3d1h h GLN 244 Ca -0.48 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 58.88 3d1h h GLN 244 Cb 1.27 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.77 3d1h h GLN 244 CO 0.53 0.58 0.00 -0.40 -1.93 0.00 0.00 178.83 177.61 3d1h n ASP 245 N -4.66 2.35 -4.76 -0.69 5.75 -1.26 -4.92 116.55 108.35 3d1h n ASP 245 Ca 0.11 -2.22 -0.41 0.00 -0.01 0.00 0.00 54.79 52.26 3d1h n ASP 245 Cb 0.17 -0.43 -0.02 0.00 -1.03 0.00 0.00 41.12 39.82 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 -1.66 3.54 -0.16 2.12 0.00 -0.84 -3.98 121.76 120.78 3d1h s ALA 246 Ca 0.21 1.29 -0.02 0.00 0.00 0.00 0.00 51.96 53.44 3d1h s ALA 246 Cb 0.14 -3.51 -0.02 0.00 0.00 0.00 0.00 23.12 19.73 3d1h s ALA 246 CO 0.09 -0.69 -0.08 -0.46 0.00 0.00 0.00 175.76 174.61 3d1h s TRP 247 N -0.79 2.91 -0.23 0.00 -0.11 -0.42 -4.88 118.94 115.42 3d1h s TRP 247 Ca 0.52 -0.59 -0.06 0.00 1.22 0.00 0.00 56.10 57.19 3d1h s TRP 247 Cb -0.41 -1.94 -0.02 0.00 -1.50 0.00 0.00 33.47 29.61 3d1h s TRP 247 CO 0.51 -0.23 0.02 -0.51 -4.62 0.00 0.00 176.95 172.12 3d1h s LEU 248 N 0.59 3.23 -0.46 5.86 1.43 -0.62 -1.21 118.68 127.50 3d1h s LEU 248 Ca -0.05 -0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 52.67 3d1h s LEU 248 Cb -0.15 -1.85 0.10 0.00 0.03 0.00 0.00 46.19 44.32 3d1h s LEU 248 CO 0.03 -0.02 0.34 -2.28 0.23 0.00 0.00 176.35 174.64 3d1h s HIS 249 N 1.52 3.34 0.24 0.29 5.65 -0.11 -1.04 115.29 125.17 3d1h s HIS 249 Ca 0.06 -1.51 -0.14 0.00 0.25 0.00 0.00 55.06 53.72 3d1h s HIS 249 Cb -0.15 -3.26 -0.08 0.00 -1.18 0.00 0.00 32.58 27.91 3d1h s HIS 249 CO 0.01 -0.91 0.63 -0.06 -0.65 0.00 0.00 174.74 173.76 3d1h s PHE 250 N 1.46 3.48 -0.03 3.88 0.08 -0.43 -0.41 117.98 126.01 3d1h s PHE 250 Ca 0.04 1.09 -0.30 0.00 0.12 0.00 0.00 56.93 57.88 3d1h s PHE 250 Cb -0.25 -2.42 0.08 0.00 -0.57 0.00 0.00 43.02 39.86 3d1h s PHE 250 CO 0.02 0.26 0.70 -3.38 -0.10 0.00 0.00 175.22 172.72 3d1h s HIS 251 N -1.75 -0.61 0.00 0.36 -3.43 -0.94 -1.75 115.29 107.17 3d1h s HIS 251 Ca 0.47 0.96 0.00 0.00 -0.80 0.00 0.00 55.06 55.69 3d1h s HIS 251 Cb -0.12 0.44 0.00 0.00 -1.43 0.00 0.00 32.58 31.46 3d1h s HIS 251 CO 0.19 -0.62 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 -1.91 -2.93 114.58 114.31 3d1h h GLU 253 Ca 0.00 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 57.97 3d1h h GLU 253 Cb 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 3d1h h GLU 253 CO 0.00 0.77 -1.64 0.00 -1.18 0.00 0.00 179.01 176.96 3d1h n ALA 254 N -3.34 1.85 -0.58 2.92 0.00 -1.26 -1.43 120.51 118.67 3d1h n ALA 254 Ca -0.24 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.51 3d1h n ALA 254 Cb 0.55 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.18 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 1.46 0.65 0.25 0.00 0.00 -1.25 -4.04 105.19 102.26 3d1h n GLY 255 Ca -0.14 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.58 0.00 0.00 1.61 0.31 -1.26 -4.59 118.33 111.81 3d1h n VAL 256 Ca 0.00 0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.44 3d1h n VAL 256 Cb 0.00 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 3d1h n VAL 256 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3d1h n GLY 257 N 2.95 -2.55 0.19 2.92 0.00 -1.26 -1.80 105.19 105.64 3d1h n GLY 257 Ca 0.00 0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.96 3d1h n GLY 257 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3d1h h ARG 258 N 0.00 0.57 -0.45 1.61 3.08 -1.93 -2.29 114.38 114.97 3d1h h ARG 258 Ca 0.00 -0.13 0.08 0.00 0.07 0.00 0.00 59.98 60.00 3d1h h ARG 258 Cb 0.00 -0.08 -0.07 0.00 0.08 0.00 0.00 29.97 29.90 3d1h h ARG 258 CO 0.00 0.61 0.04 1.15 -1.07 0.00 0.00 179.97 180.70 3d1h h THR 259 N 0.43 0.70 -0.10 2.04 2.02 -1.85 -1.84 112.91 114.31 3d1h h THR 259 Ca 0.11 -0.05 -0.14 0.00 0.77 0.00 0.00 66.41 67.10 3d1h h THR 259 Cb 0.29 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.21 3d1h h THR 259 CO -0.00 0.03 -0.54 0.74 0.37 0.00 0.00 175.52 176.12 3d1h h THR 260 N 0.16 1.36 -0.36 3.16 2.02 -1.31 -1.30 112.91 116.63 3d1h h THR 260 Ca 0.22 -1.83 0.03 0.00 0.77 0.00 0.00 66.41 65.60 3d1h h THR 260 Cb 0.31 1.88 -0.03 0.00 -1.74 0.00 0.00 68.15 68.57 3d1h h THR 260 CO -0.34 0.55 0.18 0.00 0.37 0.00 0.00 175.52 176.28 3d1h h ALA 261 N 1.21 0.44 0.00 6.16 0.00 -0.75 0.25 119.26 126.57 3d1h h ALA 261 Ca 0.00 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.79 3d1h h ALA 261 Cb 1.02 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 3d1h h ALA 261 CO 0.09 -0.19 -0.64 0.74 0.00 0.00 0.00 179.25 179.25 3d1h h PHE 262 N 0.37 0.00 -0.44 0.00 0.04 -1.34 -1.56 116.94 114.01 3d1h h PHE 262 Ca 0.15 0.00 -0.06 0.00 2.80 0.00 0.00 57.97 60.86 3d1h h PHE 262 Cb 0.06 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.19 3d1h h PHE 262 CO -0.10 0.64 0.04 0.52 -0.60 0.00 0.00 178.31 178.81 3d1h h MET 263 N 0.00 0.75 -0.27 1.51 2.86 -0.79 -1.33 114.93 117.66 3d1h h MET 263 Ca -0.01 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.41 3d1h h MET 263 Cb 1.30 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.86 3d1h h MET 263 CO 0.08 0.80 0.15 0.28 1.06 0.00 0.00 176.91 179.28 3d1h h VAL 264 N 0.61 1.13 -0.56 -2.22 2.07 -0.84 -0.31 116.25 116.13 3d1h h VAL 264 Ca 0.13 -0.34 0.05 0.00 0.82 0.00 0.00 66.70 67.36 3d1h h VAL 264 Cb 0.43 0.85 -0.05 0.00 -1.52 0.00 0.00 31.29 31.01 3d1h h VAL 264 CO 0.01 0.13 0.29 0.24 0.02 0.00 0.00 177.57 178.26 3d1h h MET 265 N 0.33 0.54 -0.64 1.57 2.07 -1.21 0.92 114.93 118.51 3d1h h MET 265 Ca 0.10 -0.03 -0.02 0.00 -2.07 0.00 0.00 59.70 57.68 3d1h h MET 265 Cb 0.07 -0.12 -0.03 0.00 -1.87 0.00 0.00 31.60 29.65 3d1h h MET 265 CO -0.02 0.35 0.33 1.15 1.07 0.00 0.00 176.91 179.80 3d1h h THR 266 N 0.55 1.21 -0.58 2.22 2.02 -0.95 -0.46 112.91 116.93 3d1h h THR 266 Ca 0.25 -0.55 -0.00 0.00 0.77 0.00 0.00 66.41 66.87 3d1h h THR 266 Cb 0.15 0.41 -0.03 0.00 -1.74 0.00 0.00 68.15 66.94 3d1h h THR 266 CO -0.17 0.23 0.34 -0.78 0.37 0.00 0.00 175.52 175.52 3d1h h ASP 267 N 0.87 0.70 -0.50 4.18 1.82 -0.18 -0.59 116.42 122.72 3d1h h ASP 267 Ca 0.22 -0.07 -0.10 0.00 -0.39 0.00 0.00 57.03 56.70 3d1h h ASP 267 Cb 0.07 -0.18 -0.02 0.00 0.68 0.00 0.00 39.33 39.89 3d1h h ASP 267 CO -0.03 0.56 -0.05 0.24 -1.61 0.00 0.00 179.24 178.34 3d1h h MET 268 N 0.78 0.96 -0.28 0.28 2.86 -0.55 0.25 114.93 119.23 3d1h h MET 268 Ca 0.21 -0.32 -0.11 0.00 -2.06 0.00 0.00 59.70 57.42 3d1h h MET 268 Cb -0.00 -0.08 -0.00 0.00 0.06 0.00 0.00 31.60 31.57 3d1h h MET 268 CO -0.04 0.98 -0.25 -0.07 1.06 0.00 0.00 176.91 178.60 3d1h h LEU 269 N 0.87 0.70 0.00 1.22 3.38 -0.79 -2.93 115.31 117.76 3d1h h LEU 269 Ca 0.15 -0.46 -0.23 0.00 0.09 0.00 0.00 57.88 57.42 3d1h h LEU 269 Cb 0.59 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 3d1h h LEU 269 CO 0.04 1.02 -1.18 0.50 0.09 0.00 0.00 178.44 178.90 3d1h h LYS 270 N 0.39 0.00 -2.18 1.13 3.64 -1.03 -3.37 116.57 115.14 3d1h h LYS 270 Ca 0.05 -0.00 -0.57 0.00 -1.27 0.00 0.00 60.65 58.85 3d1h h LYS 270 Cb 0.81 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 32.22 3d1h h LYS 270 CO 0.06 0.87 -0.77 0.09 -2.27 0.00 0.00 179.45 177.43 3d1h n ASN 271 N -3.27 3.22 0.03 4.20 3.02 0.86 -4.91 115.26 118.40 3d1h n ASN 271 Ca -0.04 -3.40 0.03 0.00 -0.03 0.00 0.00 54.58 51.13 3d1h n ASN 271 Cb 0.97 -0.61 0.13 0.00 -0.61 0.00 0.00 39.78 39.66 3d1h n ASN 271 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 3d1h n PRO 272 N 0.31 0.03 0.14 3.52 -0.04 -1.11 -1.98 135.00 135.88 3d1h n PRO 272 Ca 0.29 0.49 0.10 0.00 -0.04 0.00 0.00 63.50 64.34 3d1h n PRO 272 Cb 0.46 -1.58 0.06 0.00 -0.04 0.00 0.00 33.50 32.40 3d1h n PRO 272 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 3d1h h SER 273 N 0.00 0.00 -3.85 3.54 0.02 -1.91 -3.46 113.55 107.89 3d1h h SER 273 Ca 0.00 0.00 -0.51 0.00 -0.84 0.00 0.00 61.79 60.44 3d1h h SER 273 Cb 0.03 0.00 0.03 0.00 0.14 0.00 0.00 62.40 62.60 3d1h h SER 273 CO 0.00 0.11 0.50 -0.69 -1.14 0.00 0.00 176.83 175.61 3d1h s VAL 274 N -3.23 3.33 0.67 2.27 1.01 -0.84 -5.00 120.40 118.61 3d1h s VAL 274 Ca 0.02 1.28 -0.15 0.00 0.00 0.00 0.00 61.98 63.14 3d1h s VAL 274 Cb 0.08 -3.80 0.01 0.00 0.00 0.00 0.00 36.38 32.67 3d1h s VAL 274 CO 0.74 0.27 1.12 -0.94 0.00 0.00 0.00 175.10 176.29 3d1h s SER 275 N -0.89 4.95 0.23 3.32 1.04 -1.26 -4.84 113.70 116.26 3d1h s SER 275 Ca 0.48 2.04 -0.06 0.00 0.48 0.00 0.00 55.95 58.88 3d1h s SER 275 Cb -0.32 -2.56 0.34 0.00 0.10 0.00 0.00 66.02 63.58 3d1h s SER 275 CO 0.42 -1.74 1.81 0.25 0.98 0.00 0.00 173.24 174.96 3d1h h LEU 276 N -0.06 0.61 -0.63 2.42 5.85 -1.97 -1.40 115.31 120.12 3d1h h LEU 276 Ca -0.47 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.32 3d1h h LEU 276 Cb 1.25 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 42.17 3d1h h LEU 276 CO 0.53 0.36 0.40 0.50 -0.34 0.00 0.00 178.44 179.89 3d1h h LYS 277 N 0.73 0.77 -0.44 1.25 3.64 -1.99 -0.85 116.57 119.67 3d1h h LYS 277 Ca 0.36 -0.05 -0.09 0.00 -1.27 0.00 0.00 60.65 59.61 3d1h h LYS 277 Cb 0.31 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.94 3d1h h LYS 277 CO -0.23 0.51 -0.06 -0.44 -2.27 0.00 0.00 179.45 176.96 3d1h h ASP 278 N 0.79 0.81 -0.02 4.20 3.32 -1.78 0.01 116.42 123.76 3d1h h ASP 278 Ca 0.25 -0.34 0.01 0.00 0.02 0.00 0.00 57.03 56.97 3d1h h ASP 278 Cb -0.01 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.31 3d1h h ASP 278 CO -0.09 0.96 -0.07 0.40 -1.72 0.00 0.00 179.24 178.72 3d1h h ILE 279 N 0.65 0.82 -0.47 0.35 1.08 -0.81 0.70 117.51 119.82 3d1h h ILE 279 Ca 0.12 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.55 3d1h h ILE 279 Cb 0.58 0.82 -0.02 0.00 -3.07 0.00 0.00 36.82 35.13 3d1h h ILE 279 CO 0.03 0.00 0.17 -0.07 -0.69 0.00 0.00 178.15 177.59 3d1h h LEU 280 N -0.11 0.67 0.02 1.44 3.38 -1.08 -1.47 115.31 118.16 3d1h h LEU 280 Ca 0.03 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 3d1h h LEU 280 Cb 0.16 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3d1h h LEU 280 CO -0.08 0.68 -0.01 1.88 0.09 0.00 0.00 178.44 181.00 3d1h h TYR 281 N 0.63 -0.03 -0.31 1.13 0.05 -0.85 -2.51 116.97 115.08 3d1h h TYR 281 Ca 0.16 -0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.85 3d1h h TYR 281 Cb 0.24 0.01 -0.02 0.00 1.01 0.00 0.00 36.73 37.97 3d1h h TYR 281 CO 0.01 0.17 -0.18 0.07 -1.05 0.00 0.00 178.16 177.18 3d1h h ARG 282 N -0.23 0.56 0.00 4.88 0.11 -0.80 0.17 114.38 119.07 3d1h h ARG 282 Ca -0.00 -0.19 -0.08 0.00 0.10 0.00 0.00 59.98 59.81 3d1h h ARG 282 Cb 0.21 -0.04 -0.01 0.00 1.11 0.00 0.00 29.97 31.24 3d1h h ARG 282 CO 0.01 0.71 -0.39 1.96 0.10 0.00 0.00 179.97 182.36 3d1h h GLN 283 N 0.50 0.00 -0.01 0.08 1.08 -1.27 -1.97 115.11 113.53 3d1h h GLN 283 Ca 0.08 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 57.20 3d1h h GLN 283 Cb 0.60 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.03 3d1h h GLN 283 CO 0.04 0.39 -0.33 1.25 -0.95 0.00 0.00 178.83 179.22 3d1h h HIS 284 N 0.00 0.35 0.00 2.96 2.76 -0.92 -1.04 115.15 119.26 3d1h h HIS 284 Ca -0.00 -0.19 0.00 0.00 -2.20 0.00 0.00 60.37 57.98 3d1h h HIS 284 Cb 0.82 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.74 3d1h h HIS 284 CO 0.00 0.98 0.00 0.93 -1.30 0.00 0.00 177.93 178.54 3d1h h GLU 285 N -0.38 0.00 -0.02 5.26 5.08 -0.59 0.31 114.58 124.24 3d1h h GLU 285 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3d1h h GLU 285 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 3d1h h GLU 285 CO 0.07 0.00 0.00 0.44 -1.00 0.00 0.00 179.01 178.52 3d1h n ILE 286 N -2.52 0.01 0.00 3.13 -5.35 -0.75 -0.93 119.36 112.95 3d1h n ILE 286 Ca 0.01 -0.18 0.00 0.00 -0.27 0.00 0.00 62.75 62.31 3d1h n ILE 286 Cb 0.23 0.19 0.00 0.00 -1.74 0.00 0.00 39.64 38.32 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 1.11 1.09 0.09 3.28 0.00 0.05 -4.75 105.19 106.06 3d1h n GLY 287 Ca 0.20 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 1.92 3.80 -0.02 0.00 -0.39 -5.01 105.19 105.50 3d1h n GLY 288 Ca 0.00 -2.13 -0.33 0.00 0.00 0.00 0.00 46.02 43.56 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 0.91 3.00 -0.41 1.61 2.19 -1.26 -4.42 117.98 119.61 3d1h s PHE 289 Ca 0.01 1.51 -0.17 0.00 0.33 0.00 0.00 56.93 58.61 3d1h s PHE 289 Cb -0.00 -3.00 0.02 0.00 -1.31 0.00 0.00 43.02 38.72 3d1h s PHE 289 CO 0.01 -1.10 0.45 -0.47 1.83 0.00 0.00 175.22 175.94 3d1h s TYR 290 N -2.47 3.17 -0.60 10.12 6.14 -1.26 -3.92 117.35 128.52 3d1h s TYR 290 Ca 0.63 -0.26 0.08 0.00 0.64 0.00 0.00 57.07 58.16 3d1h s TYR 290 Cb -0.16 -2.91 0.47 0.00 0.42 0.00 0.00 41.96 39.79 3d1h s TYR 290 CO 0.37 -0.67 1.23 0.66 0.64 0.00 0.00 175.55 177.78 3d1h n TYR 291 N 5.64 1.20 -3.26 4.97 4.02 -1.26 -4.90 117.16 123.56 3d1h n TYR 291 Ca -0.07 -0.42 -0.18 0.00 -0.01 0.00 0.00 57.90 57.23 3d1h n TYR 291 Cb 0.48 -0.33 0.04 0.00 -0.02 0.00 0.00 39.34 39.51 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 0.38 2.20 3.77 2.72 0.00 -1.26 -4.62 105.19 108.38 3d1h n GLY 292 Ca 0.16 -2.23 -0.40 0.00 0.00 0.00 0.00 46.02 43.55 3d1h n GLY 292 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3d1h s GLU 293 N -4.13 4.19 -0.05 1.61 2.56 -1.26 -4.94 118.70 116.69 3d1h s GLU 293 Ca 0.44 2.23 -0.29 0.00 0.00 0.00 0.00 54.97 57.35 3d1h s GLU 293 Cb -0.04 -2.95 0.11 0.00 2.00 0.00 0.00 34.13 33.26 3d1h s GLU 293 CO 0.28 -0.33 0.90 -0.59 -0.56 0.00 0.00 175.26 174.96 3d1h s PHE 294 N -1.18 -0.38 -0.55 5.30 -0.12 -1.26 -5.02 117.98 114.77 3d1h s PHE 294 Ca 0.52 0.39 -0.27 0.00 -0.05 0.00 0.00 56.93 57.52 3d1h s PHE 294 Cb -0.40 0.51 -0.03 0.00 -0.63 0.00 0.00 43.02 42.47 3d1h s PHE 294 CO 0.52 -0.50 1.92 -1.25 -0.05 0.00 0.00 175.22 175.86 3d1h s PRO 295 N -2.47 2.68 -0.05 1.99 0.04 -1.26 -4.94 135.00 130.99 3d1h s PRO 295 Ca 0.02 0.86 -0.30 0.00 0.04 0.00 0.00 61.00 61.62 3d1h s PRO 295 Cb -0.01 -4.38 -0.04 0.00 0.04 0.00 0.00 34.50 30.11 3d1h s PRO 295 CO -0.05 -2.65 1.34 0.42 0.04 0.00 0.00 177.00 176.10 3d1h s ILE 296 N 9.11 3.95 -0.13 0.56 1.01 -1.26 -4.95 121.20 129.49 3d1h s ILE 296 Ca 0.73 1.28 -0.03 0.00 0.00 0.00 0.00 60.65 62.63 3d1h s ILE 296 Cb -0.15 -3.82 0.05 0.00 0.01 0.00 0.00 42.46 38.55 3d1h s ILE 296 CO 0.24 -0.03 0.06 -0.75 0.00 0.00 0.00 174.94 174.45 3d1h s LYS 297 N 2.68 0.25 0.30 2.79 2.20 -1.26 -5.12 119.74 121.58 3d1h s LYS 297 Ca 0.61 -0.01 0.10 0.00 -0.36 0.00 0.00 55.97 56.30 3d1h s LYS 297 Cb -0.28 -1.43 -0.05 0.00 -1.51 0.00 0.00 37.83 34.56 3d1h s LYS 297 CO 0.23 -0.52 -0.07 0.95 -0.36 0.00 0.00 175.35 175.59 3d1h s THR 298 N 2.06 2.84 0.48 3.43 -4.23 -1.26 -5.11 115.64 113.85 3d1h s THR 298 Ca 0.03 -2.10 -0.22 0.00 -1.18 0.00 0.00 61.69 58.21 3d1h s THR 298 Cb -0.15 -2.65 -0.07 0.00 1.34 0.00 0.00 72.50 70.98 3d1h s THR 298 CO -0.07 -0.32 1.18 -0.54 -0.54 0.00 0.00 174.62 174.33 3d1h s LYS 299 N -3.63 3.62 0.28 3.99 1.02 -1.26 -4.81 119.74 118.95 3d1h s LYS 299 Ca 0.32 1.80 -0.03 0.00 0.02 0.00 0.00 55.97 58.08 3d1h s LYS 299 Cb -0.04 -2.32 0.60 0.00 -0.52 0.00 0.00 37.83 35.55 3d1h s LYS 299 CO 0.18 -0.67 1.59 -0.44 -0.92 0.00 0.00 175.35 175.09 3d1h h ASP 300 N 1.84 -0.52 0.40 2.83 3.45 -2.01 1.28 116.42 123.70 3d1h h ASP 300 Ca -0.50 0.26 0.00 0.00 0.43 0.00 0.00 57.03 57.22 3d1h h ASP 300 Cb 1.26 0.47 0.00 0.00 -0.56 0.00 0.00 39.33 40.49 3d1h h ASP 300 CO 0.59 -0.29 0.00 2.29 -1.57 0.00 0.00 179.24 180.26 3d1h n LYS 301 N -5.47 0.11 -0.29 3.56 2.85 -1.26 -2.14 118.16 115.51 3d1h n LYS 301 Ca 0.19 0.44 0.07 0.00 -1.05 0.00 0.00 58.31 57.97 3d1h n LYS 301 Cb 0.62 -1.75 0.20 0.00 -0.65 0.00 0.00 35.03 33.45 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 -1.96 3.29 0.31 -5.58 9.92 0.44 -4.70 116.55 118.27 3d1h n ASP 302 Ca 0.01 -2.71 0.19 0.00 -0.53 0.00 0.00 54.79 51.75 3d1h n ASP 302 Cb 0.14 -0.41 1.05 0.00 -0.64 0.00 0.00 41.12 41.25 3d1h n ASP 302 CO 0.00 0.00 0.00 0.77 0.13 0.00 0.00 177.20 178.10 3d1h h SER 303 N 1.45 0.00 0.55 -2.24 4.64 -1.05 -1.10 113.55 115.80 3d1h h SER 303 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d1h h SER 303 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 3d1h h SER 303 CO 0.12 0.00 0.00 4.11 -0.87 0.00 0.00 176.83 180.19 3d1h h TRP 304 N 0.00 0.00 0.00 4.77 5.08 -1.85 -2.74 115.95 121.22 3d1h h TRP 304 Ca 0.00 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 59.85 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 0.00 -0.57 0.87 -1.28 0.00 0.00 178.44 177.46 3d1h h LYS 305 N 0.00 0.00 -0.48 0.12 1.57 -1.58 -3.38 116.57 112.82 3d1h h LYS 305 Ca 0.00 0.00 0.07 0.00 -1.87 0.00 0.00 60.65 58.85 3d1h h LYS 305 Cb 0.28 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 32.49 3d1h h LYS 305 CO 0.00 0.57 -0.49 1.15 -0.57 0.00 0.00 179.45 180.11 3d1h h THR 306 N 0.00 0.05 0.00 -0.16 2.02 -1.64 0.28 112.91 113.46 3d1h h THR 306 Ca -0.01 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.14 3d1h h THR 306 Cb 1.27 0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.72 3d1h h THR 306 CO 0.07 0.00 -0.15 0.07 0.37 0.00 0.00 175.52 175.89 3d1h h LYS 307 N -0.32 0.00 -0.02 6.66 2.10 -1.80 -2.08 116.57 121.11 3d1h h LYS 307 Ca 0.12 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.61 3d1h h LYS 307 Cb 0.58 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.90 3d1h h LYS 307 CO -0.63 0.15 -0.73 1.88 -2.00 0.00 0.00 179.45 178.12 3d1h h TYR 308 N 0.00 0.20 -0.20 0.07 -1.99 -1.21 -0.65 116.97 113.19 3d1h h TYR 308 Ca -0.00 -0.09 -0.09 0.00 2.00 0.00 0.00 58.73 60.55 3d1h h TYR 308 Cb 0.41 -0.03 -0.00 0.00 2.00 0.00 0.00 36.73 39.11 3d1h h TYR 308 CO 0.00 0.82 -0.21 1.88 -0.00 0.00 0.00 178.16 180.64 3d1h h TYR 309 N 0.10 0.60 -0.62 4.88 0.99 -0.58 -1.77 116.97 120.56 3d1h h TYR 309 Ca -0.02 -0.18 0.02 0.00 2.00 0.00 0.00 58.73 60.54 3d1h h TYR 309 Cb 1.28 -0.12 -0.04 0.00 1.00 0.00 0.00 36.73 38.85 3d1h h TYR 309 CO 0.02 0.86 0.40 0.00 -0.00 0.00 0.00 178.16 179.44 3d1h h ARG 310 N 0.16 0.78 -0.66 4.88 3.08 -1.35 -2.06 114.38 119.22 3d1h h ARG 310 Ca 0.03 -0.05 0.01 0.00 0.07 0.00 0.00 59.98 60.04 3d1h h ARG 310 Cb 0.77 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 3d1h h ARG 310 CO 0.05 0.51 0.43 1.49 -1.07 0.00 0.00 179.97 181.39 3d1h h GLU 311 N 0.80 0.86 -0.85 0.04 4.81 -1.06 -2.52 114.58 116.66 3d1h h GLU 311 Ca 0.24 -0.05 0.04 0.00 -0.13 0.00 0.00 59.36 59.46 3d1h h GLU 311 Cb -0.04 -0.19 -0.05 0.00 0.63 0.00 0.00 28.75 29.10 3d1h h GLU 311 CO -0.08 0.57 0.54 0.87 -0.73 0.00 0.00 179.01 180.18 3d1h h LYS 312 N 0.89 1.00 -0.54 1.92 1.57 -0.68 -1.04 116.57 119.70 3d1h h LYS 312 Ca 0.24 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3d1h h LYS 312 Cb -0.09 -0.23 -0.03 0.00 0.08 0.00 0.00 32.23 31.97 3d1h h LYS 312 CO -0.06 0.66 0.34 0.82 -0.57 0.00 0.00 179.45 180.65 3d1h h ILE 313 N 1.03 1.15 -0.19 1.86 2.04 -0.98 -0.46 117.51 121.97 3d1h h ILE 313 Ca 0.35 -0.31 -0.17 0.00 1.00 0.00 0.00 64.86 65.73 3d1h h ILE 313 Cb 0.05 0.39 -0.00 0.00 -0.74 0.00 0.00 36.82 36.51 3d1h h ILE 313 CO -0.13 0.15 -0.58 0.58 0.00 0.00 0.00 178.15 178.18 3d1h h VAL 314 N 0.73 1.32 -0.20 1.67 2.07 -1.15 -3.09 116.25 117.60 3d1h h VAL 314 Ca 0.19 -1.83 -0.15 0.00 0.82 0.00 0.00 66.70 65.74 3d1h h VAL 314 Cb -0.05 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 3d1h h VAL 314 CO -0.04 0.57 -0.50 0.24 0.02 0.00 0.00 177.57 177.86 3d1h h MET 315 N 0.45 0.54 -0.66 1.57 2.86 -0.93 -1.63 114.93 117.12 3d1h h MET 315 Ca 0.00 -0.32 0.05 0.00 -2.06 0.00 0.00 59.70 57.38 3d1h h MET 315 Cb 1.13 0.03 -0.05 0.00 0.06 0.00 0.00 31.60 32.77 3d1h h MET 315 CO 0.11 0.92 0.38 0.82 1.06 0.00 0.00 176.91 180.19 3d1h h ILE 316 N 0.42 1.00 -0.47 -1.22 1.08 -1.08 0.36 117.51 117.60 3d1h h ILE 316 Ca 0.02 -0.24 -0.11 0.00 -0.39 0.00 0.00 64.86 64.13 3d1h h ILE 316 Cb 1.03 0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 34.98 3d1h h ILE 316 CO 0.09 0.13 -0.16 -0.33 -0.69 0.00 0.00 178.15 177.19 3d1h h GLU 317 N 0.71 0.90 -0.55 2.37 5.08 -1.44 -2.01 114.58 119.63 3d1h h GLU 317 Ca 0.29 -0.34 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 3d1h h GLU 317 Cb 0.15 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 3d1h h GLU 317 CO -0.16 0.99 -0.01 0.37 -1.00 0.00 0.00 179.01 179.19 3d1h h GLN 318 N 0.79 0.96 -0.46 2.33 5.75 -0.32 -1.19 115.11 122.97 3d1h h GLN 318 Ca 0.12 -0.29 -0.09 0.00 -0.15 0.00 0.00 58.65 58.23 3d1h h GLN 318 Cb 0.70 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.13 3d1h h GLN 318 CO 0.05 0.96 -0.08 0.35 -2.65 0.00 0.00 178.83 177.46 3d1h h PHE 319 N 0.88 0.90 -0.56 3.99 3.57 -0.10 -1.15 116.94 124.48 3d1h h PHE 319 Ca 0.16 -0.16 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3d1h h PHE 319 Cb 0.53 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 3d1h h PHE 319 CO 0.03 0.87 0.35 -0.92 -2.23 0.00 0.00 178.31 176.41 3d1h h TYR 320 N 0.75 0.72 -0.47 0.41 5.03 -1.05 -1.58 116.97 120.78 3d1h h TYR 320 Ca 0.13 0.01 0.03 0.00 2.58 0.00 0.00 58.73 61.47 3d1h h TYR 320 Cb 0.57 -0.24 -0.03 0.00 1.55 0.00 0.00 36.73 38.58 3d1h h TYR 320 CO 0.03 0.48 0.27 0.00 -1.32 0.00 0.00 178.16 177.62 3d1h h ARG 321 N 0.75 0.52 -0.36 1.82 3.08 -0.80 -1.31 114.38 118.07 3d1h h ARG 321 Ca 0.20 -0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.27 3d1h h ARG 321 Cb -0.04 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 29.84 3d1h h ARG 321 CO -0.04 0.34 0.08 -0.92 -1.07 0.00 0.00 179.97 178.36 3d1h h TYR 322 N 0.53 0.13 -0.27 3.04 3.20 -0.72 0.12 116.97 123.00 3d1h h TYR 322 Ca 0.19 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.08 3d1h h TYR 322 Cb 0.04 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.30 3d1h h TYR 322 CO -0.08 0.02 0.17 0.28 -1.64 0.00 0.00 178.16 176.91 3d1h h VAL 323 N 0.20 1.09 -0.69 1.81 2.07 -1.01 -0.77 116.25 118.94 3d1h h VAL 323 Ca 0.17 -0.19 -0.04 0.00 0.82 0.00 0.00 66.70 67.46 3d1h h VAL 323 Cb 0.20 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 3d1h h VAL 323 CO -0.22 0.08 0.26 1.56 0.02 0.00 0.00 177.57 179.27 3d1h h GLN 324 N 0.34 1.04 0.00 1.57 1.08 -0.70 -1.31 115.11 117.13 3d1h h GLN 324 Ca 0.10 -0.19 0.00 0.00 -1.45 0.00 0.00 58.65 57.11 3d1h h GLN 324 Cb -0.01 -0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.25 3d1h h GLN 324 CO -0.02 0.86 -0.22 0.93 -0.95 0.00 0.00 178.83 179.43 3d1h h GLU 325 N 1.01 0.00 0.00 1.46 5.08 -0.50 -3.38 114.58 118.25 3d1h h GLU 325 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 3d1h h GLU 325 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3d1h h GLU 325 CO -0.02 0.00 0.00 0.09 -1.00 0.00 0.00 179.01 178.08 3d1h n ASN 326 N -2.51 0.59 -0.08 1.42 3.02 -0.32 -4.71 115.26 112.67 3d1h n ASN 326 Ca 0.04 -0.80 -0.10 0.00 -0.03 0.00 0.00 54.58 53.69 3d1h n ASN 326 Cb 0.47 0.40 -0.03 0.00 -0.61 0.00 0.00 39.78 40.00 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 0.38 -0.97 3.52 0.11 -1.42 -1.11 114.38 114.90 3d1h h ARG 327 Ca 0.00 -0.07 0.22 0.00 0.10 0.00 0.00 59.98 60.22 3d1h h ARG 327 Cb 0.00 -0.06 -0.12 0.00 1.11 0.00 0.00 29.97 30.91 3d1h h ARG 327 CO 0.00 0.43 0.54 0.00 0.10 0.00 0.00 179.97 181.04 3d1h h ALA 328 N 0.93 1.63 -0.60 0.08 0.00 -1.84 0.76 119.26 120.23 3d1h h ALA 328 Ca 0.08 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3d1h h ALA 328 Cb 0.20 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.00 3d1h h ALA 328 CO -0.01 -0.21 0.00 -0.40 0.00 0.00 0.00 179.25 178.63 3d1h n ASP 329 N -4.89 3.26 -0.01 0.00 3.85 -1.19 -4.91 116.55 112.65 3d1h n ASP 329 Ca 0.24 -2.02 -0.00 0.00 -0.71 0.00 0.00 54.79 52.30 3d1h n ASP 329 Cb 0.65 -0.41 -0.00 0.00 -1.35 0.00 0.00 41.12 40.01 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 1.42 0.37 3.40 6.12 0.00 0.26 -4.06 105.19 112.70 3d1h n GLY 330 Ca 0.20 -0.96 -0.17 0.00 0.00 0.00 0.00 46.02 45.09 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 -3.65 -2.24 0.19 1.61 4.01 -0.43 -4.88 117.16 111.77 3d1h n TYR 331 Ca -0.00 0.92 0.06 0.00 -0.16 0.00 0.00 57.90 58.71 3d1h n TYR 331 Cb 0.33 -4.85 0.53 0.00 -0.31 0.00 0.00 39.34 35.03 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 -1.72 0.12 -5.29 -0.72 1.08 -1.81 -3.40 115.11 103.37 3d1h h GLN 332 Ca -0.60 -0.01 -0.66 0.00 -1.45 0.00 0.00 58.65 55.94 3d1h h GLN 332 Cb 1.33 -0.02 -0.27 0.00 -0.05 0.00 0.00 27.48 28.47 3d1h h GLN 332 CO 0.49 0.16 -0.76 0.99 -0.95 0.00 0.00 178.83 178.76 3d1h s THR 333 N -4.96 3.10 0.80 -0.54 2.01 -1.26 -5.12 115.64 109.66 3d1h s THR 333 Ca -0.05 -0.64 -0.11 0.00 0.31 0.00 0.00 61.69 61.19 3d1h s THR 333 Cb 0.16 -2.31 0.07 0.00 0.01 0.00 0.00 72.50 70.43 3d1h s THR 333 CO 0.70 0.52 1.09 -2.16 -0.69 0.00 0.00 174.62 174.07 3d1h s PRO 334 N 0.44 2.08 0.18 4.92 0.04 -1.26 -4.83 135.00 136.56 3d1h s PRO 334 Ca -0.09 0.74 -0.14 0.00 0.04 0.00 0.00 61.00 61.54 3d1h s PRO 334 Cb -0.16 -1.91 0.16 0.00 0.04 0.00 0.00 34.50 32.63 3d1h s PRO 334 CO 0.05 -1.65 1.70 2.35 0.04 0.00 0.00 177.00 179.49 3d1h h TRP 335 N -1.11 0.06 -0.46 0.56 2.91 -1.94 -1.67 115.95 114.29 3d1h h TRP 335 Ca -0.47 0.03 0.06 0.00 1.13 0.00 0.00 58.89 59.64 3d1h h TRP 335 Cb 1.26 0.04 -0.05 0.00 -0.51 0.00 0.00 29.16 29.90 3d1h h TRP 335 CO 0.48 -0.05 0.17 0.66 -1.03 0.00 0.00 178.44 178.68 3d1h h SER 336 N 0.16 0.19 -0.18 2.65 4.64 -1.94 0.15 113.55 119.23 3d1h h SER 336 Ca 0.23 0.05 -0.02 0.00 -0.47 0.00 0.00 61.79 61.58 3d1h h SER 336 Cb 0.32 0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 62.43 3d1h h SER 336 CO -0.34 0.14 0.03 0.58 -0.87 0.00 0.00 176.83 176.37 3d1h h VAL 337 N 0.35 1.22 -0.67 0.95 2.07 -1.88 -2.18 116.25 116.12 3d1h h VAL 337 Ca 0.22 -0.73 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 3d1h h VAL 337 Cb 0.21 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 3d1h h VAL 337 CO -0.21 0.22 0.34 -0.25 0.02 0.00 0.00 177.57 177.68 3d1h h TRP 338 N 0.08 0.94 -0.49 1.57 7.01 -1.03 -2.69 115.95 121.34 3d1h h TRP 338 Ca 0.05 -0.04 -0.03 0.00 2.11 0.00 0.00 58.89 60.98 3d1h h TRP 338 Cb 0.31 -0.30 -0.02 0.00 -2.10 0.00 0.00 29.16 27.05 3d1h h TRP 338 CO 0.02 0.69 0.16 1.25 -2.79 0.00 0.00 178.44 177.77 3d1h h LEU 339 N 0.92 0.66 -0.88 0.65 5.85 -0.62 0.10 115.31 121.98 3d1h h LEU 339 Ca 0.23 -0.09 -0.11 0.00 0.84 0.00 0.00 57.88 58.75 3d1h h LEU 339 Cb 0.09 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 3d1h h LEU 339 CO -0.03 0.62 -0.33 0.11 -0.34 0.00 0.00 178.44 178.47 3d1h h LYS 340 N 0.71 0.43 0.00 1.25 1.57 -1.08 -0.86 116.57 118.58 3d1h h LYS 340 Ca 0.17 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3d1h h LYS 340 Cb 0.20 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.49 3d1h h LYS 340 CO -0.01 0.71 -0.43 -1.13 -0.57 0.00 0.00 179.45 178.02 3d1h n SER 341 N -4.07 0.45 -3.12 0.86 3.41 -0.91 -4.18 113.62 106.05 3d1h n SER 341 Ca -0.01 -0.05 -0.21 0.00 -0.26 0.00 0.00 58.87 58.34 3d1h n SER 341 Cb 0.45 0.09 -0.04 0.00 -0.26 0.00 0.00 64.21 64.46 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 -1.60 1.45 -1.68 7.33 8.25 -0.03 -5.10 115.22 123.84 3d1h n HIS 342 Ca 0.05 -3.87 -0.40 0.00 -0.26 0.00 0.00 57.72 53.24 3d1h n HIS 342 Cb 0.35 -0.44 0.02 0.00 1.12 0.00 0.00 29.99 31.04 3d1h n HIS 342 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 3d1h n PRO 343 N 0.17 1.66 -2.31 -0.41 -0.04 -0.37 -4.70 135.00 129.00 3d1h n PRO 343 Ca 0.27 0.60 -0.32 0.00 -0.04 0.00 0.00 63.50 64.01 3d1h n PRO 343 Cb 0.57 -2.32 -0.03 0.00 -0.04 0.00 0.00 33.50 31.68 3d1h n PRO 343 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d1h s ALA 344 N -1.27 3.05 0.04 0.55 0.00 -1.26 -5.08 121.76 117.79 3d1h s ALA 344 Ca 0.65 0.16 0.08 0.00 0.00 0.00 0.00 51.96 52.84 3d1h s ALA 344 Cb -0.49 -3.12 -0.03 0.00 0.00 0.00 0.00 23.12 19.48 3d1h s ALA 344 CO 0.55 -0.32 -0.23 -1.59 0.00 0.00 0.00 175.76 174.17 3d1h s LYS 345 N -4.21 1.57 0.00 0.00 -2.85 -1.26 -4.44 119.74 108.55 3d1h s LYS 345 Ca 0.59 -0.98 0.00 0.00 -1.00 0.00 0.00 55.97 54.58 3d1h s LYS 345 Cb -0.10 -1.68 0.00 0.00 -2.06 0.00 0.00 37.83 33.98 3d1h s LYS 345 CO 0.34 0.44 0.46 0.00 0.10 0.00 0.00 175.35 176.69