#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m1u h SER 43 N 0.00 0.00 -2.55 2.55 0.02 -2.00 -3.50 113.55 108.06 3m1u h SER 43 Ca 0.00 -0.45 -0.54 0.00 -0.84 0.00 0.00 61.79 59.96 3m1u h SER 43 Cb 0.00 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 62.40 3m1u h SER 43 CO 0.00 1.31 -0.65 0.00 -1.14 0.00 0.00 176.83 176.36 3m1u s ARG 44 N -2.31 1.70 0.23 3.45 1.70 -1.26 -5.10 118.95 117.36 3m1u s ARG 44 Ca -0.25 -1.91 -0.31 0.00 -0.47 0.00 0.00 55.73 52.79 3m1u s ARG 44 Cb 0.04 -1.30 -0.11 0.00 -0.57 0.00 0.00 34.95 33.02 3m1u s ARG 44 CO 0.53 -0.01 1.62 -1.21 -1.08 0.00 0.00 175.30 175.15 3m1u s GLU 45 N -3.74 4.15 -0.02 3.89 2.02 -1.26 -2.41 118.70 121.34 3m1u s GLU 45 Ca 0.33 2.52 0.00 0.00 0.02 0.00 0.00 54.97 57.84 3m1u s GLU 45 Cb 0.06 -3.08 0.00 0.00 0.10 0.00 0.00 34.13 31.21 3m1u s GLU 45 CO 0.15 -0.65 0.00 0.41 0.02 0.00 0.00 175.26 175.18 3m1u n GLY 46 N 3.17 0.45 3.64 -1.39 0.00 -1.25 -5.02 105.19 104.79 3m1u n GLY 46 Ca 0.12 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 3m1u n GLY 46 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3m1u s HIS 47 N -1.90 3.04 0.14 1.61 5.04 -1.01 -4.74 115.29 117.47 3m1u s HIS 47 Ca 0.00 0.09 0.03 0.00 -1.54 0.00 0.00 55.06 53.64 3m1u s HIS 47 Cb 0.00 -1.71 -0.04 0.00 0.04 0.00 0.00 32.58 30.86 3m1u s HIS 47 CO 0.00 0.42 -0.08 0.14 -2.34 0.00 0.00 174.74 172.88 3m1u s VAL 48 N -0.93 0.97 0.44 0.89 -7.23 -1.26 -4.62 120.40 108.66 3m1u s VAL 48 Ca 0.15 -2.01 0.13 0.00 -1.81 0.00 0.00 61.98 58.44 3m1u s VAL 48 Cb -0.11 -1.84 0.31 0.00 0.56 0.00 0.00 36.38 35.29 3m1u s VAL 48 CO 0.05 -0.74 2.02 0.00 -0.31 0.00 0.00 175.10 176.12 3m1u h ALA 49 N 2.82 1.96 -0.44 1.32 0.00 -1.99 -1.58 119.26 121.34 3m1u h ALA 49 Ca -0.36 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 54.66 3m1u h ALA 49 Cb 1.19 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 3m1u h ALA 49 CO 0.64 -0.05 0.35 -0.44 0.00 0.00 0.00 179.25 179.75 3m1u h ASP 50 N 0.38 0.00 1.21 0.00 5.19 -1.95 -1.05 116.42 120.20 3m1u h ASP 50 Ca 0.21 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 3m1u h ASP 50 Cb 0.34 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.85 3m1u h ASP 50 CO -0.05 0.00 0.00 -0.07 -3.12 0.00 0.00 179.24 176.00 3m1u h LEU 51 N 0.00 0.00 0.03 1.55 3.38 -1.53 -0.02 115.31 118.72 3m1u h LEU 51 Ca 0.21 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.86 3m1u h LEU 51 Cb 0.91 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.61 3m1u h LEU 51 CO -0.00 0.00 -1.91 0.47 0.09 0.00 0.00 178.44 177.09 3m1u n ASP 52 N -2.33 1.12 0.08 -0.43 8.00 -0.49 -4.46 116.55 118.04 3m1u n ASP 52 Ca 0.04 0.28 -0.07 0.00 0.71 0.00 0.00 54.79 55.75 3m1u n ASP 52 Cb 0.36 -0.14 0.05 0.00 -0.02 0.00 0.00 41.12 41.37 3m1u n ASP 52 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 3m1u h ARG 53 N 0.02 0.23 -5.11 -1.24 2.43 -0.94 -3.43 114.38 106.33 3m1u h ARG 53 Ca -0.37 -0.20 -0.66 0.00 -0.81 0.00 0.00 59.98 57.95 3m1u h ARG 53 Cb 2.04 0.05 -0.27 0.00 -0.42 0.00 0.00 29.97 31.37 3m1u h ARG 53 CO 0.07 0.87 -0.73 -0.06 -1.51 0.00 0.00 179.97 178.60 3m1u s PHE 54 N -3.49 2.93 0.29 2.20 0.40 -0.05 -5.04 117.98 115.21 3m1u s PHE 54 Ca -0.04 -0.81 -0.30 0.00 -0.60 0.00 0.00 56.93 55.19 3m1u s PHE 54 Cb 0.11 -2.02 -0.11 0.00 0.51 0.00 0.00 43.02 41.51 3m1u s PHE 54 CO 0.81 -0.41 1.51 -1.25 0.70 0.00 0.00 175.22 176.58 3m1u s PRO 55 N 1.07 4.19 -1.38 0.24 0.04 -1.26 -4.61 135.00 133.28 3m1u s PRO 55 Ca 0.01 2.45 -0.08 0.00 0.04 0.00 0.00 61.00 63.42 3m1u s PRO 55 Cb -0.15 -3.05 0.08 0.00 0.04 0.00 0.00 34.50 31.43 3m1u s PRO 55 CO -0.01 -0.51 2.39 1.04 0.04 0.00 0.00 177.00 179.95 3m1u n GLN 56 N 1.95 4.12 -3.15 4.56 1.13 -1.26 -4.70 117.38 120.02 3m1u n GLN 56 Ca 0.06 -3.18 0.04 0.00 -1.94 0.00 0.00 57.00 51.98 3m1u n GLN 56 Cb 0.39 -2.76 -0.01 0.00 0.11 0.00 0.00 30.24 27.97 3m1u n GLN 56 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3m1u s ASP 57 N 0.99 -1.49 0.59 1.08 2.15 -1.26 -5.03 116.67 113.70 3m1u s ASP 57 Ca 0.54 0.47 0.38 0.00 0.43 0.00 0.00 52.55 54.36 3m1u s ASP 57 Cb 0.16 2.07 1.79 0.00 -0.30 0.00 0.00 42.92 46.65 3m1u s ASP 57 CO -0.07 -0.28 2.13 -0.07 -0.17 0.00 0.00 175.17 176.71 3m1u h LEU 58 N 8.00 0.00 -1.32 -1.34 3.38 -1.84 -2.92 115.31 119.27 3m1u h LEU 58 Ca -0.10 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.88 3m1u h LEU 58 Cb 1.18 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.89 3m1u h LEU 58 CO 0.20 0.00 0.47 0.03 0.09 0.00 0.00 178.44 179.22 3m1u h ARG 59 N 0.00 0.90 -0.47 1.13 3.08 -1.93 -1.34 114.38 115.76 3m1u h ARG 59 Ca 0.00 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.02 3m1u h ARG 59 Cb 0.30 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.11 3m1u h ARG 59 CO 0.00 0.60 0.28 0.28 -1.07 0.00 0.00 179.97 180.06 3m1u h VAL 60 N 0.93 1.05 -0.11 2.04 2.07 -1.91 -2.61 116.25 117.71 3m1u h VAL 60 Ca 0.26 -0.19 -0.16 0.00 0.82 0.00 0.00 66.70 67.43 3m1u h VAL 60 Cb -0.08 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.12 3m1u h VAL 60 CO -0.06 0.10 -0.61 1.88 0.02 0.00 0.00 177.57 178.90 3m1u h TYR 61 N 0.56 0.51 0.00 1.57 0.05 -1.68 -3.11 116.97 114.87 3m1u h TYR 61 Ca 0.19 -0.19 0.00 0.00 0.05 0.00 0.00 58.73 58.77 3m1u h TYR 61 Cb 0.01 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 37.66 3m1u h TYR 61 CO -0.07 0.90 0.00 0.00 -1.05 0.00 0.00 178.16 177.94 3m1u n ALA 62 N -2.50 2.03 0.00 3.88 0.00 -0.53 -1.56 120.51 121.83 3m1u n ALA 62 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 3m1u n ALA 62 Cb 0.63 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.87 3m1u n ALA 62 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3m1u n LYS 64 N 1.15 0.00 0.24 0.00 4.81 -1.18 -1.15 118.16 122.04 3m1u n LYS 64 Ca 0.00 0.00 0.15 0.00 -0.87 0.00 0.00 58.31 57.59 3m1u n LYS 64 Cb 0.18 0.00 0.53 0.00 0.02 0.00 0.00 35.03 35.76 3m1u n LYS 64 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 3m1u h ALA 65 N 0.00 1.00 0.00 3.14 0.00 -1.59 -3.47 119.26 118.33 3m1u h ALA 65 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3m1u h ALA 65 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 3m1u h ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 3m1u n GLY 66 N 0.34 0.08 0.36 0.00 0.00 -0.30 -4.88 105.19 100.79 3m1u n GLY 66 Ca 0.02 -0.72 0.09 0.00 0.00 0.00 0.00 46.02 45.41 3m1u n GLY 66 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1u h ALA 67 N 0.00 1.76 -0.47 4.61 0.00 -1.65 -1.59 119.26 121.92 3m1u h ALA 67 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3m1u h ALA 67 Cb 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3m1u h ALA 67 CO 0.00 0.08 0.00 -0.25 0.00 0.00 0.00 179.25 179.08 3m1u n ASP 68 N -4.50 4.26 -4.72 0.00 8.00 -1.26 -0.23 116.55 118.09 3m1u n ASP 68 Ca 0.13 -2.58 -0.42 0.00 0.71 0.00 0.00 54.79 52.64 3m1u n ASP 68 Cb 0.32 -0.51 -0.03 0.00 -0.02 0.00 0.00 41.12 40.88 3m1u n ASP 68 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 3m1u s ARG 69 N -2.06 4.51 -0.13 -1.24 3.52 -0.60 -4.99 118.95 117.96 3m1u s ARG 69 Ca 0.43 1.63 -0.29 0.00 -0.13 0.00 0.00 55.73 57.37 3m1u s ARG 69 Cb 0.30 -3.38 -0.04 0.00 -1.56 0.00 0.00 34.95 30.27 3m1u s ARG 69 CO 0.17 -0.13 1.55 -0.65 -0.81 0.00 0.00 175.30 175.43 3m1u s GLN 70 N 0.85 4.08 0.31 5.12 1.11 -1.26 -4.12 119.66 125.75 3m1u s GLN 70 Ca 0.55 1.91 0.25 0.00 0.01 0.00 0.00 55.36 58.08 3m1u s GLN 70 Cb -0.26 -3.95 0.66 0.00 -1.01 0.00 0.00 33.01 28.45 3m1u s GLN 70 CO 0.29 -0.94 1.72 -0.07 0.01 0.00 0.00 175.29 176.30 3m1u h LEU 71 N 10.52 0.00 -7.71 2.90 3.38 -1.51 -3.44 115.31 119.45 3m1u h LEU 71 Ca -0.34 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.45 3m1u h LEU 71 Cb 1.15 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.66 3m1u h LEU 71 CO 0.97 0.00 -0.57 -0.76 0.09 0.00 0.00 178.44 178.17 3m1u s LEU 72 N -5.23 1.65 0.70 1.67 1.43 -1.26 -5.03 118.68 112.62 3m1u s LEU 72 Ca 0.09 -0.03 -0.16 0.00 -1.03 0.00 0.00 54.13 53.00 3m1u s LEU 72 Cb 0.09 0.45 0.02 0.00 0.03 0.00 0.00 46.19 46.79 3m1u s LEU 72 CO 0.61 -0.19 1.23 -2.84 0.23 0.00 0.00 176.35 175.39 3m1u s PRO 73 N -0.66 2.31 0.20 1.29 0.02 -1.26 -4.75 135.00 132.15 3m1u s PRO 73 Ca -0.07 1.84 -0.13 0.00 0.02 0.00 0.00 61.00 62.66 3m1u s PRO 73 Cb -0.05 -1.84 0.23 0.00 0.02 0.00 0.00 34.50 32.86 3m1u s PRO 73 CO 0.00 -1.73 1.66 0.35 -0.33 0.00 0.00 177.00 176.95 3m1u h PHE 74 N 0.01 -0.15 -0.67 6.54 3.57 -1.99 0.07 116.94 124.33 3m1u h PHE 74 Ca -0.49 0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.02 3m1u h PHE 74 Cb 1.31 0.15 -0.03 0.00 2.79 0.00 0.00 35.95 40.17 3m1u h PHE 74 CO 0.46 -0.19 0.28 1.79 -2.23 0.00 0.00 178.31 178.41 3m1u h THR 75 N 0.06 1.24 -0.50 4.41 1.35 -1.99 0.44 112.91 117.92 3m1u h THR 75 Ca 0.28 -0.74 -0.10 0.00 -0.55 0.00 0.00 66.41 65.31 3m1u h THR 75 Cb 0.44 0.47 -0.02 0.00 -1.73 0.00 0.00 68.15 67.32 3m1u h THR 75 CO -0.52 0.30 -0.06 -0.08 -0.25 0.00 0.00 175.52 174.91 3m1u h GLU 76 N 0.95 0.93 -0.50 4.72 4.81 -1.69 -1.19 114.58 122.60 3m1u h GLU 76 Ca 0.23 -0.33 -0.08 0.00 -0.13 0.00 0.00 59.36 59.05 3m1u h GLU 76 Cb 0.20 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 3m1u h GLU 76 CO -0.02 0.98 -0.02 0.37 -0.73 0.00 0.00 179.01 179.59 3m1u h GLN 77 N 0.79 0.86 -0.84 1.92 4.15 -0.60 -1.24 115.11 120.16 3m1u h GLN 77 Ca 0.14 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 59.30 3m1u h GLN 77 Cb 0.60 -0.09 -0.04 0.00 0.21 0.00 0.00 27.48 28.16 3m1u h GLN 77 CO 0.04 0.88 0.53 0.00 -1.93 0.00 0.00 178.83 178.35 3m1u h ALA 78 N 1.17 1.07 -0.37 3.38 0.00 -0.63 -0.12 119.26 123.75 3m1u h ALA 78 Ca 0.15 -0.08 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3m1u h ALA 78 Cb 0.51 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3m1u h ALA 78 CO 0.03 0.50 0.09 0.00 0.00 0.00 0.00 179.25 179.87 3m1u h ALA 79 N 1.29 0.49 -0.61 0.00 0.00 -0.66 -1.35 119.26 118.42 3m1u h ALA 79 Ca 0.30 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 55.09 3m1u h ALA 79 Cb -0.09 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.50 3m1u h ALA 79 CO -0.06 0.17 0.31 1.96 0.00 0.00 0.00 179.25 181.63 3m1u h GLN 80 N 0.46 0.56 -0.57 0.00 1.08 -0.93 -1.91 115.11 113.80 3m1u h GLN 80 Ca 0.12 -0.03 -0.06 0.00 -1.45 0.00 0.00 58.65 57.23 3m1u h GLN 80 Cb 0.30 -0.13 -0.02 0.00 -0.05 0.00 0.00 27.48 27.58 3m1u h GLN 80 CO 0.00 0.37 0.13 0.22 -0.95 0.00 0.00 178.83 178.60 3m1u h ASP 81 N 0.58 0.87 -0.79 1.46 3.58 -0.73 -0.81 116.42 120.58 3m1u h ASP 81 Ca 0.28 -0.24 0.08 0.00 0.42 0.00 0.00 57.03 57.57 3m1u h ASP 81 Cb 0.21 -0.23 -0.06 0.00 1.72 0.00 0.00 39.33 40.97 3m1u h ASP 81 CO -0.20 0.89 0.46 0.00 -2.88 0.00 0.00 179.24 177.51 3m1u h ALA 82 N 1.02 1.10 -0.29 -0.78 0.00 -1.01 -1.67 119.26 117.63 3m1u h ALA 82 Ca 0.18 0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 3m1u h ALA 82 Cb 0.36 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3m1u h ALA 82 CO 0.00 0.14 -0.37 0.00 0.00 0.00 0.00 179.25 179.02 3m1u h ARG 83 N 0.82 0.67 -0.26 0.00 3.08 -0.86 -1.88 114.38 115.95 3m1u h ARG 83 Ca 0.36 -0.33 0.04 0.00 0.07 0.00 0.00 59.98 60.13 3m1u h ARG 83 Cb 0.26 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.27 3m1u h ARG 83 CO -0.21 0.93 -0.00 2.35 -1.07 0.00 0.00 179.97 181.97 3m1u h TRP 84 N 0.55 -0.02 -0.36 3.04 7.01 -0.63 -0.22 115.95 125.32 3m1u h TRP 84 Ca 0.05 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 60.98 3m1u h TRP 84 Cb 0.89 0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 27.98 3m1u h TRP 84 CO 0.04 -0.04 -0.15 -0.91 -2.79 0.00 0.00 178.44 174.59 3m1u h ASN 85 N 0.08 0.64 -0.42 2.65 2.35 -1.09 -1.13 115.58 118.66 3m1u h ASN 85 Ca 0.12 -0.19 -0.05 0.00 -0.55 0.00 0.00 56.30 55.63 3m1u h ASN 85 Cb 0.16 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 3m1u h ASN 85 CO -0.21 0.81 0.08 0.03 -1.65 0.00 0.00 177.43 176.49 3m1u h ARG 86 N 0.59 0.69 -0.20 0.81 2.47 -0.93 -2.60 114.38 115.21 3m1u h ARG 86 Ca 0.10 -0.18 -0.01 0.00 -1.26 0.00 0.00 59.98 58.63 3m1u h ARG 86 Cb 0.59 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.82 3m1u h ARG 86 CO 0.04 0.72 0.09 0.00 0.56 0.00 0.00 179.97 181.38 3m1u h ARG 87 N 0.55 0.29 -0.76 0.04 2.47 -0.77 -2.54 114.38 113.66 3m1u h ARG 87 Ca 0.13 -0.05 0.06 0.00 -1.26 0.00 0.00 59.98 58.86 3m1u h ARG 87 Cb 0.35 -0.05 -0.06 0.00 -1.65 0.00 0.00 29.97 28.57 3m1u h ARG 87 CO 0.01 0.33 0.45 0.35 0.56 0.00 0.00 179.97 181.67 3m1u h PHE 88 N 0.19 0.84 -0.18 3.04 3.57 -1.09 -2.35 116.94 120.95 3m1u h PHE 88 Ca 0.07 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.59 3m1u h PHE 88 Cb 0.14 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.61 3m1u h PHE 88 CO -0.02 0.42 0.00 1.19 -2.23 0.00 0.00 178.31 177.67 3m1u n PHE 89 N -4.69 0.23 -0.28 0.41 3.72 -0.99 -4.45 117.46 111.40 3m1u n PHE 89 Ca 0.10 -0.11 0.05 0.00 -0.05 0.00 0.00 57.45 57.44 3m1u n PHE 89 Cb 0.16 0.00 0.27 0.00 -0.94 0.00 0.00 39.48 38.98 3m1u n PHE 89 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3m1u h ALA 90 N 4.24 1.57 -0.58 4.37 0.00 -0.97 -1.62 119.26 126.27 3m1u h ALA 90 Ca 0.00 -0.02 0.13 0.00 0.00 0.00 0.00 54.91 55.02 3m1u h ALA 90 Cb 0.63 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 3m1u h ALA 90 CO 0.00 0.28 0.40 -1.35 0.00 0.00 0.00 179.25 178.58 3m1u h PRO 91 N 0.95 0.19 0.00 0.00 0.11 -1.80 0.06 132.00 131.51 3m1u h PRO 91 Ca 0.38 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.48 3m1u h PRO 91 Cb 0.26 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.32 3m1u h PRO 91 CO -0.15 0.13 0.00 0.91 -0.21 0.00 0.00 178.00 178.68 3m1u n TRP 92 N -4.43 0.00 -3.16 0.65 7.02 -0.61 -4.53 117.44 112.38 3m1u n TRP 92 Ca 0.10 0.00 -0.37 0.00 -1.02 0.00 0.00 57.50 56.21 3m1u n TRP 92 Cb 0.51 -0.33 -0.02 0.00 -2.42 0.00 0.00 31.31 29.04 3m1u n TRP 92 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 3m1u n ARG 93 N -1.33 3.75 0.00 -0.99 1.74 0.00 -5.09 116.66 114.74 3m1u n ARG 93 Ca 0.06 -4.60 0.00 0.00 -0.77 0.00 0.00 57.85 52.53 3m1u n ARG 93 Cb 0.12 -2.42 0.00 0.00 -1.02 0.00 0.00 32.46 29.15 3m1u n ARG 93 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3m1u n THR 95 N 1.13 0.00 -3.63 0.55 -2.24 -1.26 -5.14 114.28 103.69 3m1u n THR 95 Ca 0.27 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.94 3m1u n THR 95 Cb 0.36 0.27 -0.05 0.00 -2.10 0.00 0.00 70.33 68.81 3m1u n THR 95 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3m1u s ARG 96 N 0.00 1.04 0.49 -0.78 1.70 -1.26 -4.94 118.95 115.20 3m1u s ARG 96 Ca 0.00 -0.60 -0.21 0.00 -0.47 0.00 0.00 55.73 54.44 3m1u s ARG 96 Cb 0.00 0.46 -0.07 0.00 -0.57 0.00 0.00 34.95 34.77 3m1u s ARG 96 CO 0.00 -0.40 1.14 -1.50 -1.08 0.00 0.00 175.30 173.46 3m1u s ILE 97 N -3.45 3.20 -0.92 4.99 2.07 -1.26 -4.96 121.20 120.88 3m1u s ILE 97 Ca 0.01 0.83 0.23 0.00 -1.41 0.00 0.00 60.65 60.30 3m1u s ILE 97 Cb 0.01 -3.38 -0.14 0.00 0.13 0.00 0.00 42.46 39.08 3m1u s ILE 97 CO -0.09 -0.08 1.07 -1.54 -1.91 0.00 0.00 174.94 172.38 3m1u n SER 98 N -0.83 0.76 -4.68 4.50 3.41 -1.26 -4.92 113.62 110.59 3m1u n SER 98 Ca 0.09 -0.62 -0.40 0.00 -0.26 0.00 0.00 58.87 57.68 3m1u n SER 98 Cb 0.50 0.76 -0.05 0.00 -0.26 0.00 0.00 64.21 65.16 3m1u n SER 98 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3m1u s VAL 99 N -3.04 4.99 0.53 -3.33 1.01 -1.26 -5.03 120.40 114.27 3m1u s VAL 99 Ca 0.08 1.41 -0.19 0.00 0.00 0.00 0.00 61.98 63.27 3m1u s VAL 99 Cb 0.16 -4.03 -0.06 0.00 0.00 0.00 0.00 36.38 32.45 3m1u s VAL 99 CO 0.81 0.13 1.09 -2.16 0.00 0.00 0.00 175.10 174.97 3m1u s PRO 100 N 1.62 3.47 0.50 2.72 0.04 -1.26 -4.90 135.00 137.19 3m1u s PRO 100 Ca 0.34 1.49 0.15 0.00 0.04 0.00 0.00 61.00 63.02 3m1u s PRO 100 Cb -0.17 -2.03 1.21 0.00 0.04 0.00 0.00 34.50 33.55 3m1u s PRO 100 CO 0.13 -0.73 2.13 -0.24 0.04 0.00 0.00 177.00 178.34 3m1u h VAL 101 N 1.20 1.02 -0.91 -0.36 3.04 -1.96 -1.13 116.25 117.15 3m1u h VAL 101 Ca -0.49 -0.04 0.05 0.00 -1.01 0.00 0.00 66.70 65.20 3m1u h VAL 101 Cb 1.24 0.96 -0.06 0.00 -2.01 0.00 0.00 31.29 31.42 3m1u h VAL 101 CO 0.57 0.02 0.59 0.50 -1.01 0.00 0.00 177.57 178.25 3m1u h LYS 102 N 0.06 1.05 -0.01 4.17 3.64 -1.98 0.21 116.57 123.71 3m1u h LYS 102 Ca 0.02 -0.06 -0.18 0.00 -1.27 0.00 0.00 60.65 59.16 3m1u h LYS 102 Cb 0.00 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.57 3m1u h LYS 102 CO -0.00 0.69 -0.81 -0.44 -2.27 0.00 0.00 179.45 176.62 3m1u h ASP 103 N 1.08 0.17 -0.40 4.20 3.32 -1.58 -1.14 116.42 122.07 3m1u h ASP 103 Ca 0.38 -0.13 -0.13 0.00 0.02 0.00 0.00 57.03 57.17 3m1u h ASP 103 Cb 0.12 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 3m1u h ASP 103 CO -0.13 0.90 -0.24 0.58 -1.72 0.00 0.00 179.24 178.63 3m1u h VAL 104 N 0.08 1.28 -0.04 -1.35 2.07 -1.10 -3.24 116.25 113.95 3m1u h VAL 104 Ca -0.03 -1.40 -0.12 0.00 0.82 0.00 0.00 66.70 65.98 3m1u h VAL 104 Cb 1.41 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 3m1u h VAL 104 CO 0.12 0.47 -0.51 0.00 0.02 0.00 0.00 177.57 177.67 3m1u h ALA 105 N 0.80 1.08 -0.49 1.67 0.00 -0.45 -3.36 119.26 118.51 3m1u h ALA 105 Ca 0.08 -0.47 0.09 0.00 0.00 0.00 0.00 54.91 54.61 3m1u h ALA 105 Cb 0.81 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 3m1u h ALA 105 CO 0.07 0.65 0.08 0.00 0.00 0.00 0.00 179.25 180.05 3m1u h ALA 106 N 1.40 0.53 0.00 0.00 0.00 -1.23 -1.59 119.26 118.37 3m1u h ALA 106 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3m1u h ALA 106 Cb 0.93 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3m1u h ALA 106 CO 0.07 -0.33 0.00 -2.30 0.00 0.00 0.00 179.25 176.70 3m1u n PRO 107 N -5.13 0.14 0.00 0.00 -0.02 -1.26 -1.63 135.00 127.10 3m1u n PRO 107 Ca 0.05 0.47 0.11 0.00 -2.02 0.00 0.00 63.50 62.11 3m1u n PRO 107 Cb 0.24 -1.82 0.56 0.00 -0.02 0.00 0.00 33.50 32.47 3m1u n PRO 107 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3m1u n PHE 108 N -2.10 0.00 0.00 6.00 3.01 -0.60 -4.93 117.46 118.85 3m1u n PHE 108 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 3m1u n PHE 108 Cb 0.15 -0.30 0.00 0.00 -0.01 0.00 0.00 39.48 39.32 3m1u n PHE 108 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3m1u n GLY 109 N 0.64 2.89 3.61 1.37 0.00 -0.64 -4.06 105.19 109.00 3m1u n GLY 109 Ca 0.10 -1.83 -0.43 0.00 0.00 0.00 0.00 46.02 43.87 3m1u n GLY 109 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m1u s THR 110 N -2.40 3.11 -1.48 2.61 2.01 -1.26 -0.73 115.64 117.50 3m1u s THR 110 Ca 0.00 0.12 -0.06 0.00 0.31 0.00 0.00 61.69 62.06 3m1u s THR 110 Cb 0.00 -3.13 0.02 0.00 0.01 0.00 0.00 72.50 69.40 3m1u s THR 110 CO 0.00 -0.07 0.53 -0.90 -0.69 0.00 0.00 174.62 173.50 3m1u n ASP 111 N 10.53 -5.44 -1.22 3.53 3.85 -1.26 -2.09 116.55 124.45 3m1u n ASP 111 Ca 0.26 -0.28 -0.16 0.00 -0.71 0.00 0.00 54.79 53.90 3m1u n ASP 111 Cb 0.44 -4.43 -0.07 0.00 -1.35 0.00 0.00 41.12 35.72 3m1u n ASP 111 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3m1u n GLY 112 N -1.39 1.49 3.84 6.12 0.00 0.10 -4.98 105.19 110.36 3m1u n GLY 112 Ca -0.10 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.60 3m1u n GLY 112 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3m1u s ARG 113 N -3.31 4.00 0.56 1.61 0.52 -0.89 -4.75 118.95 116.69 3m1u s ARG 113 Ca 0.00 0.93 -0.21 0.00 -0.52 0.00 0.00 55.73 55.93 3m1u s ARG 113 Cb 0.00 -2.19 -0.04 0.00 0.52 0.00 0.00 34.95 33.24 3m1u s ARG 113 CO 0.00 -0.17 1.31 -2.14 0.02 0.00 0.00 175.30 174.32 3m1u s PRO 114 N -3.79 3.09 -0.16 3.54 0.02 -1.26 -4.41 135.00 132.02 3m1u s PRO 114 Ca 0.59 2.12 -0.03 0.00 0.02 0.00 0.00 61.00 63.70 3m1u s PRO 114 Cb -0.10 -2.17 -0.02 0.00 0.02 0.00 0.00 34.50 32.23 3m1u s PRO 114 CO 0.26 -1.20 -0.07 1.03 -0.33 0.00 0.00 177.00 176.70 3m1u s ARG 115 N -3.01 3.54 3.39 5.54 0.52 -1.26 -5.00 118.95 122.67 3m1u s ARG 115 Ca 0.73 -0.59 0.00 0.00 -0.52 0.00 0.00 55.73 55.35 3m1u s ARG 115 Cb -0.38 -2.84 0.00 0.00 0.52 0.00 0.00 34.95 32.25 3m1u s ARG 115 CO 0.44 0.17 0.00 0.41 0.02 0.00 0.00 175.30 176.33 3m1u n GLY 116 N 3.72 1.00 3.35 -3.53 0.00 -1.26 -4.54 105.19 103.93 3m1u n GLY 116 Ca -0.18 -0.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.91 3m1u n GLY 116 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3m1u s TYR 117 N 0.00 2.32 0.00 1.61 1.51 0.38 -1.12 117.35 122.06 3m1u s TYR 117 Ca 0.00 -0.41 0.00 0.00 -1.01 0.00 0.00 57.07 55.65 3m1u s TYR 117 Cb 0.00 -1.39 0.00 0.00 -0.11 0.00 0.00 41.96 40.46 3m1u s TYR 117 CO 0.00 0.13 0.00 0.00 -1.11 0.00 0.00 175.55 174.57 3m1u n ALA 118 N 1.75 0.00 0.38 3.71 0.00 -0.04 -0.72 120.51 125.59 3m1u n ALA 118 Ca -0.17 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.35 3m1u n ALA 118 Cb 0.52 0.00 0.33 0.00 0.00 0.00 0.00 19.45 20.30 3m1u n ALA 118 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 3m1u n GLU 119 N -0.53 0.06 -0.37 0.00 0.00 -1.26 -1.04 120.64 117.49 3m1u n GLU 119 Ca 0.00 0.35 0.10 0.00 0.00 0.00 0.00 57.16 57.61 3m1u n GLU 119 Cb 0.00 -1.62 0.28 0.00 0.00 0.00 0.00 31.44 30.10 3m1u n GLU 119 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.13 177.40 3m1u n ASN 120 N -1.74 3.52 -2.11 -1.84 6.94 -1.26 -4.95 115.26 113.83 3m1u n ASN 120 Ca 0.02 -2.09 -0.20 0.00 -0.02 0.00 0.00 54.58 52.30 3m1u n ASN 120 Cb 0.15 -0.44 -0.04 0.00 -2.36 0.00 0.00 39.78 37.09 3m1u n ASN 120 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3m1u n LEU 121 N 1.24 -1.72 -4.44 -4.53 4.77 -0.21 -4.98 117.00 107.12 3m1u n LEU 121 Ca 0.21 0.18 -0.24 0.00 -0.03 0.00 0.00 56.01 56.14 3m1u n LEU 121 Cb 0.58 -2.84 -0.10 0.00 -2.33 0.00 0.00 43.42 38.73 3m1u n LEU 121 CO 0.16 -0.52 -0.49 -0.76 -1.33 0.00 0.00 177.39 174.46 3m1u s LEU 122 N -5.51 2.55 0.27 2.23 1.43 -1.26 -4.89 118.68 113.49 3m1u s LEU 122 Ca 0.00 -0.99 -0.30 0.00 -1.03 0.00 0.00 54.13 51.81 3m1u s LEU 122 Cb 0.00 -1.05 -0.14 0.00 0.03 0.00 0.00 46.19 45.03 3m1u s LEU 122 CO 0.00 0.03 1.18 -2.65 0.23 0.00 0.00 176.35 175.13 3m1u n PRO 123 N -0.38 1.61 -1.60 1.29 -0.02 -1.26 -0.86 135.00 133.78 3m1u n PRO 123 Ca -0.07 0.57 -0.49 0.00 -2.02 0.00 0.00 63.50 61.49 3m1u n PRO 123 Cb 0.59 -2.06 -0.04 0.00 -0.02 0.00 0.00 33.50 31.97 3m1u n PRO 123 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3m1u n TRP 124 N 0.84 1.48 -1.94 6.00 7.02 -0.27 -4.68 117.44 125.88 3m1u n TRP 124 Ca 0.10 0.62 -0.42 0.00 -1.02 0.00 0.00 57.50 56.78 3m1u n TRP 124 Cb 0.31 -2.32 -0.03 0.00 -2.42 0.00 0.00 31.31 26.85 3m1u n TRP 124 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 3m1u s ASP 125 N 0.16 6.59 0.16 -0.99 2.15 -1.26 -4.88 116.67 118.61 3m1u s ASP 125 Ca 0.75 2.60 -0.14 0.00 0.43 0.00 0.00 52.55 56.18 3m1u s ASP 125 Cb -0.84 -2.59 0.05 0.00 -0.30 0.00 0.00 42.92 39.24 3m1u s ASP 125 CO 0.50 -0.82 1.79 0.58 -0.17 0.00 0.00 175.17 177.05 3m1u h VAL 126 N 4.07 1.16 0.01 1.11 2.07 -1.99 0.87 116.25 123.55 3m1u h VAL 126 Ca -0.43 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 66.72 3m1u h VAL 126 Cb 1.20 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.48 3m1u h VAL 126 CO 0.91 0.17 -0.00 0.74 0.02 0.00 0.00 177.57 179.41 3m1u h THR 127 N 0.67 1.24 -0.51 2.57 2.02 -1.99 -0.74 112.91 116.17 3m1u h THR 127 Ca 0.18 -0.75 -0.03 0.00 0.77 0.00 0.00 66.41 66.57 3m1u h THR 127 Cb 0.01 1.75 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 3m1u h THR 127 CO -0.03 0.19 0.17 0.03 0.37 0.00 0.00 175.52 176.26 3m1u h ARG 128 N -0.34 0.74 -0.03 6.66 3.08 -1.95 -1.18 114.38 121.37 3m1u h ARG 128 Ca -0.00 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 59.93 3m1u h ARG 128 Cb 0.33 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 30.25 3m1u h ARG 128 CO 0.00 0.64 0.01 2.35 -1.07 0.00 0.00 179.97 181.90 3m1u h TRP 129 N 0.73 0.05 -0.98 3.04 2.91 -0.71 -2.26 115.95 118.73 3m1u h TRP 129 Ca 0.17 -0.01 0.13 0.00 1.13 0.00 0.00 58.89 60.32 3m1u h TRP 129 Cb 0.19 -0.01 -0.08 0.00 -0.51 0.00 0.00 29.16 28.75 3m1u h TRP 129 CO 0.01 0.24 0.62 0.78 -1.03 0.00 0.00 178.44 179.06 3m1u h GLY 130 N -0.16 1.55 1.96 2.65 0.00 -0.95 -1.77 103.07 106.36 3m1u h GLY 130 Ca 0.01 -0.39 -0.09 0.00 0.00 0.00 0.00 47.33 46.86 3m1u h GLY 130 CO -0.00 0.13 -0.39 0.00 0.00 0.00 0.00 176.54 176.28 3m1u h ALA 131 N 1.56 1.32 -0.32 3.60 0.00 -0.95 -0.17 119.26 124.30 3m1u h ALA 131 Ca 0.49 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3m1u h ALA 131 Cb 0.57 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3m1u h ALA 131 CO -0.26 0.50 0.12 -0.07 0.00 0.00 0.00 179.25 179.55 3m1u h LEU 132 N 0.04 0.45 -0.47 0.00 3.38 -0.74 -1.62 115.31 116.36 3m1u h LEU 132 Ca 0.00 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.73 3m1u h LEU 132 Cb 0.70 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 3m1u h LEU 132 CO 0.05 0.50 0.04 0.00 0.09 0.00 0.00 178.44 179.12 3m1u h ALA 133 N 0.97 0.63 -0.18 1.53 0.00 -1.18 -2.34 119.26 118.70 3m1u h ALA 133 Ca 0.11 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 3m1u h ALA 133 Cb 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3m1u h ALA 133 CO -0.01 0.40 0.07 0.77 0.00 0.00 0.00 179.25 180.47 3m1u h SER 134 N 0.67 0.25 0.63 0.00 0.02 -0.98 -2.74 113.55 111.40 3m1u h SER 134 Ca 0.14 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 3m1u h SER 134 Cb 0.45 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.93 3m1u h SER 134 CO 0.02 0.36 0.00 1.23 -1.14 0.00 0.00 176.83 177.29 3m1u h GLY 135 N 0.12 0.00 2.00 -3.77 0.00 -1.27 -2.59 103.07 97.56 3m1u h GLY 135 Ca 0.06 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 3m1u h GLY 135 CO -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 176.54 176.44 3m1u h ALA 136 N 2.02 1.12 -6.12 3.60 0.00 -1.09 0.67 119.26 119.46 3m1u h ALA 136 Ca 0.00 -0.09 -0.43 0.00 0.00 0.00 0.00 54.91 54.39 3m1u h ALA 136 Cb 0.32 -0.02 0.04 0.00 0.00 0.00 0.00 17.79 18.13 3m1u h ALA 136 CO 0.00 0.12 -0.81 0.00 0.00 0.00 0.00 179.25 178.56 3m1u n ALA 137 N -2.19 -1.84 0.32 0.00 0.00 -0.98 -4.60 120.51 111.22 3m1u n ALA 137 Ca -0.01 -0.07 0.16 0.00 0.00 0.00 0.00 53.44 53.52 3m1u n ALA 137 Cb 0.27 -2.60 0.60 0.00 0.00 0.00 0.00 19.45 17.72 3m1u n ALA 137 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3m1u h LEU 138 N -1.94 0.00 -1.80 0.00 3.38 -1.86 -1.36 115.31 111.73 3m1u h LEU 138 Ca -0.60 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.37 3m1u h LEU 138 Cb 1.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.11 3m1u h LEU 138 CO 0.59 0.00 0.00 -2.24 0.09 0.00 0.00 178.44 176.88 3m1u h ASP 139 N 0.00 0.00 -0.19 -0.43 2.03 -1.97 -1.86 116.42 114.00 3m1u h ASP 139 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3m1u h ASP 139 Cb 0.50 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.00 3m1u h ASP 139 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 179.24 178.39 3m1u n LEU 140 N -2.64 2.67 -4.74 0.15 4.77 -0.51 -5.01 117.00 111.69 3m1u n LEU 140 Ca -0.01 -1.36 -0.41 0.00 -0.03 0.00 0.00 56.01 54.20 3m1u n LEU 140 Cb 0.12 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 3m1u n LEU 140 CO 0.17 0.56 0.79 -0.47 -1.33 0.00 0.00 177.39 177.12 3m1u s TYR 141 N -1.19 3.59 -0.04 -1.77 6.14 -0.70 -2.37 117.35 121.01 3m1u s TYR 141 Ca 0.24 1.60 -0.24 0.00 0.64 0.00 0.00 57.07 59.30 3m1u s TYR 141 Cb 0.14 -3.28 -0.04 0.00 0.42 0.00 0.00 41.96 39.21 3m1u s TYR 141 CO 0.21 -0.61 0.74 -1.25 0.64 0.00 0.00 175.55 175.27 3m1u s PRO 142 N -0.35 4.46 0.00 4.97 0.04 -1.26 -4.95 135.00 137.90 3m1u s PRO 142 Ca 0.49 0.97 0.20 0.00 0.04 0.00 0.00 61.00 62.70 3m1u s PRO 142 Cb -0.29 -3.43 -0.14 0.00 0.04 0.00 0.00 34.50 30.68 3m1u s PRO 142 CO 0.35 0.11 0.91 -1.13 0.04 0.00 0.00 177.00 177.27 3m1u n SER 143 N 3.56 1.31 -4.27 6.66 3.41 -0.60 -4.96 113.62 118.72 3m1u n SER 143 Ca -0.01 -1.15 -0.19 0.00 -0.26 0.00 0.00 58.87 57.26 3m1u n SER 143 Cb 0.51 0.80 -0.11 0.00 -0.26 0.00 0.00 64.21 65.15 3m1u n SER 143 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 3m1u s GLN 144 N -2.65 1.10 -0.48 4.33 -1.52 -0.65 -4.93 119.66 114.86 3m1u s GLN 144 Ca 0.11 -1.32 0.06 0.00 -1.95 0.00 0.00 55.36 52.27 3m1u s GLN 144 Cb 0.16 -1.00 0.19 0.00 -0.22 0.00 0.00 33.01 32.14 3m1u s GLN 144 CO 0.70 0.19 0.62 0.00 -0.25 0.00 0.00 175.29 176.55 3m1u n ALA 145 N 0.37 -0.30 -2.39 6.09 0.00 -1.15 -4.13 120.51 119.00 3m1u n ALA 145 Ca -0.14 -1.75 -0.09 0.00 0.00 0.00 0.00 53.44 51.46 3m1u n ALA 145 Cb 0.57 -1.24 -0.08 0.00 0.00 0.00 0.00 19.45 18.70 3m1u n ALA 145 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 3m1u s TRP 146 N 0.54 0.45 -0.07 0.00 1.48 -0.92 -4.98 118.94 115.44 3m1u s TRP 146 Ca 0.31 -0.89 -0.01 0.00 -1.06 0.00 0.00 56.10 54.46 3m1u s TRP 146 Cb 0.04 -0.23 -0.03 0.00 -1.16 0.00 0.00 33.47 32.08 3m1u s TRP 146 CO -0.11 -0.54 -0.00 0.15 -4.06 0.00 0.00 176.95 172.38 3m1u s LYS 147 N -3.94 2.93 0.12 3.25 1.02 -1.26 0.11 119.74 121.96 3m1u s LYS 147 Ca 0.13 -0.45 0.01 0.00 0.02 0.00 0.00 55.97 55.67 3m1u s LYS 147 Cb 0.06 -2.76 -0.00 0.00 -0.52 0.00 0.00 37.83 34.61 3m1u s LYS 147 CO -0.05 0.69 0.14 0.41 -0.92 0.00 0.00 175.35 175.61 3m1u n GLY 148 N 2.00 3.14 3.02 -3.33 0.00 -0.22 -1.26 105.19 108.54 3m1u n GLY 148 Ca -0.18 -1.58 -0.12 0.00 0.00 0.00 0.00 46.02 44.14 3m1u n GLY 148 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3m1u s ILE 149 N -2.53 0.00 -0.08 -0.61 2.07 -0.22 -1.49 121.20 118.35 3m1u s ILE 149 Ca 0.12 -0.01 -0.30 0.00 -1.41 0.00 0.00 60.65 59.05 3m1u s ILE 149 Cb 0.00 -0.20 -0.02 0.00 0.13 0.00 0.00 42.46 42.36 3m1u s ILE 149 CO 0.08 -0.01 1.15 -0.69 -1.91 0.00 0.00 174.94 173.57 3m1u s VAL 150 N 0.05 4.40 -0.72 4.00 1.01 -0.57 -1.06 120.40 127.51 3m1u s VAL 150 Ca -0.00 1.71 0.20 0.00 0.00 0.00 0.00 61.98 63.89 3m1u s VAL 150 Cb -0.01 -4.10 -0.25 0.00 0.00 0.00 0.00 36.38 32.03 3m1u s VAL 150 CO 0.00 -0.02 0.76 1.33 0.00 0.00 0.00 175.10 177.17 3m1u n VAL 151 N 4.69 0.00 -3.79 2.92 0.24 -0.30 -0.24 118.33 121.85 3m1u n VAL 151 Ca 0.11 -0.14 -0.12 0.00 -2.04 0.00 0.00 64.34 62.14 3m1u n VAL 151 Cb 0.47 0.75 -0.09 0.00 -1.47 0.00 0.00 33.84 33.50 3m1u n VAL 151 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3m1u s SER 152 N -3.29 -0.11 0.23 -1.34 1.04 -1.26 -4.82 113.70 104.15 3m1u s SER 152 Ca 0.04 -0.07 -0.32 0.00 0.48 0.00 0.00 55.95 56.09 3m1u s SER 152 Cb 0.15 0.30 -0.14 0.00 0.10 0.00 0.00 66.02 66.43 3m1u s SER 152 CO 0.84 -0.47 1.36 0.59 0.98 0.00 0.00 173.24 176.54 3m1u n ASN 153 N 1.13 2.49 -0.05 7.02 3.02 -1.26 -4.91 115.26 122.69 3m1u n ASN 153 Ca -0.21 1.14 0.00 0.00 -0.03 0.00 0.00 54.58 55.48 3m1u n ASN 153 Cb 0.57 -1.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.35 3m1u n ASN 153 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 3m1u n SER 154 N 2.14 0.00 -3.79 6.41 2.88 0.04 -4.99 113.62 116.31 3m1u n SER 154 Ca 0.12 -0.05 -0.12 0.00 -1.33 0.00 0.00 58.87 57.50 3m1u n SER 154 Cb 0.30 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.68 3m1u n SER 154 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3m1u s ALA 155 N -1.66 -0.60 -0.22 -1.46 0.00 -1.26 -0.57 121.76 115.98 3m1u s ALA 155 Ca 0.00 -0.00 -0.10 0.00 0.00 0.00 0.00 51.96 51.86 3m1u s ALA 155 Cb 0.00 0.24 -0.05 0.00 0.00 0.00 0.00 23.12 23.32 3m1u s ALA 155 CO 0.00 -0.35 0.13 -0.51 0.00 0.00 0.00 175.76 175.03 3m1u s LEU 156 N -1.87 4.05 0.14 0.00 1.43 0.19 -4.60 118.68 118.03 3m1u s LEU 156 Ca -0.07 0.12 0.08 0.00 -1.03 0.00 0.00 54.13 53.22 3m1u s LEU 156 Cb -0.02 -2.07 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 3m1u s LEU 156 CO -0.01 0.10 -0.08 -0.13 0.23 0.00 0.00 176.35 176.46 3m1u s ARG 157 N 0.81 2.16 0.36 1.70 1.81 0.51 -1.51 118.95 124.79 3m1u s ARG 157 Ca 0.07 -1.13 0.17 0.00 -1.72 0.00 0.00 55.73 53.12 3m1u s ARG 157 Cb -0.13 -2.26 0.66 0.00 -0.45 0.00 0.00 34.95 32.76 3m1u s ARG 157 CO 0.02 0.47 1.73 0.93 -0.68 0.00 0.00 175.30 177.77 3m1u h GLU 158 N 3.18 0.00 -4.08 3.54 4.39 -1.46 -0.96 114.58 119.20 3m1u h GLU 158 Ca -0.48 0.00 -0.11 0.00 0.34 0.00 0.00 59.36 59.11 3m1u h GLU 158 Cb 1.19 0.00 -0.15 0.00 -0.10 0.00 0.00 28.75 29.69 3m1u h GLU 158 CO 0.54 0.40 -0.57 0.14 -1.16 0.00 0.00 179.01 178.37 3m1u s VAL 159 N -3.66 0.19 -1.34 3.13 -7.23 -1.26 -4.73 120.40 105.50 3m1u s VAL 159 Ca -0.00 -1.56 -0.14 0.00 -1.81 0.00 0.00 61.98 58.46 3m1u s VAL 159 Cb 0.11 -1.43 0.10 0.00 0.56 0.00 0.00 36.38 35.72 3m1u s VAL 159 CO 0.70 -0.86 1.91 -0.81 -0.31 0.00 0.00 175.10 175.72 3m1u n PRO 160 N 0.07 3.20 -3.64 4.82 -0.04 -1.26 -4.81 135.00 133.34 3m1u n PRO 160 Ca -0.15 -3.18 -0.15 0.00 -0.04 0.00 0.00 63.50 59.98 3m1u n PRO 160 Cb 0.61 -3.22 -0.07 0.00 -0.04 0.00 0.00 33.50 30.78 3m1u n PRO 160 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 3m1u s THR 161 N 2.52 0.02 -1.92 0.52 -1.32 -1.26 -5.03 115.64 109.17 3m1u s THR 161 Ca 0.46 -0.15 0.26 0.00 -1.21 0.00 0.00 61.69 61.05 3m1u s THR 161 Cb 0.08 -0.82 0.26 0.00 -1.51 0.00 0.00 72.50 70.50 3m1u s THR 161 CO -0.01 -0.08 1.51 0.18 -2.21 0.00 0.00 174.62 174.00 3m1u n LEU 162 N 1.50 1.29 -4.77 9.08 4.77 -1.26 -4.89 117.00 122.71 3m1u n LEU 162 Ca -0.18 -0.39 -0.36 0.00 -0.03 0.00 0.00 56.01 55.04 3m1u n LEU 162 Cb 0.56 -0.08 -0.01 0.00 -2.33 0.00 0.00 43.42 41.56 3m1u n LEU 162 CO 0.19 0.24 0.81 -0.13 -1.33 0.00 0.00 177.39 177.17 3m1u s ARG 163 N -2.42 3.66 0.00 3.23 0.52 -1.26 -5.13 118.95 117.54 3m1u s ARG 163 Ca 0.25 1.71 0.00 0.00 -0.52 0.00 0.00 55.73 57.17 3m1u s ARG 163 Cb 0.19 -2.29 0.00 0.00 0.52 0.00 0.00 34.95 33.37 3m1u s ARG 163 CO 0.50 -0.62 0.00 -0.35 0.02 0.00 0.00 175.30 174.85 3m1u n PRO 164 N -0.71 3.47 -3.65 3.54 -0.04 -1.26 -4.92 135.00 131.43 3m1u n PRO 164 Ca 0.08 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.52 3m1u n PRO 164 Cb 0.49 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.88 3m1u n PRO 164 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3m1u s PHE 166 N 1.56 -0.26 0.20 0.54 0.08 0.10 -4.34 117.98 115.87 3m1u s PHE 166 Ca 0.00 0.56 0.00 0.00 0.12 0.00 0.00 56.93 57.62 3m1u s PHE 166 Cb 0.00 0.29 0.14 0.00 -0.57 0.00 0.00 43.02 42.88 3m1u s PHE 166 CO 0.00 -0.13 1.50 1.79 -0.10 0.00 0.00 175.22 178.28 3m1u h THR 167 N 4.25 1.37 -0.85 0.64 1.35 -1.79 0.11 112.91 117.99 3m1u h THR 167 Ca -0.27 -2.00 -0.01 0.00 -0.55 0.00 0.00 66.41 63.57 3m1u h THR 167 Cb 1.18 1.99 -0.19 0.00 -1.73 0.00 0.00 68.15 69.40 3m1u h THR 167 CO 0.19 0.60 -0.37 0.00 -0.25 0.00 0.00 175.52 175.69 3m1u s ALA 168 N -3.76 -2.78 0.54 6.62 0.00 -0.57 -4.68 121.76 117.13 3m1u s ALA 168 Ca -0.05 0.52 0.24 0.00 0.00 0.00 0.00 51.96 52.66 3m1u s ALA 168 Cb 0.11 -2.77 1.40 0.00 0.00 0.00 0.00 23.12 21.86 3m1u s ALA 168 CO 0.82 -2.22 2.04 -1.35 0.00 0.00 0.00 175.76 175.05 3m1u h PRO 169 N 6.84 0.00 -0.00 0.00 0.11 -1.83 -1.33 132.00 135.78 3m1u h PRO 169 Ca 0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.14 3m1u h PRO 169 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3m1u h PRO 169 CO 0.07 0.00 -0.23 0.25 -0.21 0.00 0.00 178.00 177.88 3m1u n THR 170 N -4.34 0.00 -3.91 -1.15 -2.24 -1.26 -4.40 114.28 96.98 3m1u n THR 170 Ca 0.06 -0.06 -0.36 0.00 -2.27 0.00 0.00 64.05 61.42 3m1u n THR 170 Cb 0.46 0.10 -0.08 0.00 -2.10 0.00 0.00 70.33 68.71 3m1u n THR 170 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3m1u s ARG 171 N -2.65 3.75 0.21 -0.78 0.52 -0.51 -5.06 118.95 114.44 3m1u s ARG 171 Ca 0.22 -0.24 -0.32 0.00 -0.52 0.00 0.00 55.73 54.87 3m1u s ARG 171 Cb 0.19 -3.23 -0.14 0.00 0.52 0.00 0.00 34.95 32.29 3m1u s ARG 171 CO 0.54 0.51 1.36 0.00 0.02 0.00 0.00 175.30 177.73 3m1u n ALA 172 N 2.84 0.58 -0.80 2.13 0.00 -1.26 -1.30 120.51 122.69 3m1u n ALA 172 Ca -0.18 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.69 3m1u n ALA 172 Cb 0.53 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.77 3m1u n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1u n GLY 173 N 2.27 1.13 0.00 0.00 0.00 -1.26 -4.83 105.19 102.51 3m1u n GLY 173 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3m1u n GLY 173 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3m1u n GLN 174 N -2.00 0.55 -0.10 1.61 6.02 -0.42 -4.91 117.38 118.14 3m1u n GLN 174 Ca 0.00 -0.78 0.00 0.00 -0.01 0.00 0.00 57.00 56.21 3m1u n GLN 174 Cb 0.00 -0.90 0.00 0.00 1.02 0.00 0.00 30.24 30.36 3m1u n GLN 174 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3m1u n GLY 175 N -0.17 3.82 3.68 1.08 0.00 -1.22 -1.51 105.19 110.87 3m1u n GLY 175 Ca 0.00 -2.05 -0.44 0.00 0.00 0.00 0.00 46.02 43.54 3m1u n GLY 175 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3m1u n TYR 176 N -0.05 2.15 -1.20 1.61 9.36 -1.26 -0.64 117.16 127.13 3m1u n TYR 176 Ca 0.00 0.50 -0.19 0.00 3.32 0.00 0.00 57.90 61.54 3m1u n TYR 176 Cb 0.00 -2.43 0.21 0.00 -0.63 0.00 0.00 39.34 36.50 3m1u n TYR 176 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3m1u n PRO 177 N 1.31 2.60 -2.65 2.98 -0.04 -1.26 -4.99 135.00 132.95 3m1u n PRO 177 Ca 0.09 -3.04 -0.43 0.00 -0.04 0.00 0.00 63.50 60.07 3m1u n PRO 177 Cb 0.33 -2.18 0.00 0.00 -0.04 0.00 0.00 33.50 31.62 3m1u n PRO 177 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3m1u n PHE 178 N -0.91 4.13 -1.65 0.54 3.72 0.19 -4.63 117.46 118.85 3m1u n PHE 178 Ca 0.54 -3.10 -0.29 0.00 -0.05 0.00 0.00 57.45 54.55 3m1u n PHE 178 Cb 1.59 -2.14 0.16 0.00 -0.94 0.00 0.00 39.48 38.15 3m1u n PHE 178 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 3m1u s ASP 179 N 2.19 3.06 0.00 4.37 2.15 -1.26 -4.51 116.67 122.66 3m1u s ASP 179 Ca 0.43 0.63 0.00 0.00 0.43 0.00 0.00 52.55 54.04 3m1u s ASP 179 Cb 0.03 -0.95 0.00 0.00 -0.30 0.00 0.00 42.92 41.70 3m1u s ASP 179 CO 0.01 -2.80 0.00 0.49 -0.17 0.00 0.00 175.17 172.70 3m1u n PHE 181 N -3.88 0.00 -2.88 -5.34 3.72 -1.26 -4.80 117.46 103.02 3m1u n PHE 181 Ca 0.11 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 57.08 3m1u n PHE 181 Cb 0.60 -0.20 -0.04 0.00 -0.94 0.00 0.00 39.48 38.89 3m1u n PHE 181 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 3m1u s GLN 182 N 0.00 3.36 -0.15 -1.08 2.00 -1.26 -1.18 119.66 121.35 3m1u s GLN 182 Ca 0.00 -0.22 -0.26 0.00 -2.00 0.00 0.00 55.36 52.87 3m1u s GLN 182 Cb 0.00 -4.02 -0.24 0.00 0.80 0.00 0.00 33.01 29.55 3m1u s GLN 182 CO 0.00 -1.37 0.65 -0.09 -0.50 0.00 0.00 175.29 173.98 3m1u h ARG 183 N 9.20 0.00 -1.62 1.67 2.43 -1.56 -3.42 114.38 121.08 3m1u h ARG 183 Ca -0.26 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 58.97 3m1u h ARG 183 Cb 1.08 0.00 -0.24 0.00 -0.42 0.00 0.00 29.97 30.39 3m1u h ARG 183 CO 1.05 0.94 0.47 -0.08 -1.51 0.00 0.00 179.97 180.84 3m1u s THR 184 N -2.20 0.00 0.64 0.20 -1.32 -1.08 -4.70 115.64 107.18 3m1u s THR 184 Ca -0.19 0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 60.12 3m1u s THR 184 Cb -0.02 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.97 3m1u s THR 184 CO 0.64 0.00 1.18 0.00 -2.21 0.00 0.00 174.62 174.23 3m1u s ALA 185 N -0.57 2.42 -0.08 11.08 0.00 0.18 -0.63 121.76 134.16 3m1u s ALA 185 Ca -0.01 0.85 0.01 0.00 0.00 0.00 0.00 51.96 52.82 3m1u s ALA 185 Cb -0.02 -3.42 0.02 0.00 0.00 0.00 0.00 23.12 19.70 3m1u s ALA 185 CO -0.01 -1.35 -0.10 0.08 0.00 0.00 0.00 175.76 174.38 3m1u s VAL 186 N -1.89 1.05 0.00 0.00 1.01 0.26 -4.80 120.40 116.04 3m1u s VAL 186 Ca 0.74 -0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.34 3m1u s VAL 186 Cb -0.27 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.10 3m1u s VAL 186 CO 0.38 0.35 0.00 0.79 0.00 0.00 0.00 175.10 176.62 3m1u n TRP 187 N 4.29 0.00 -0.26 5.22 5.03 -1.26 -0.78 117.44 129.68 3m1u n TRP 187 Ca -0.19 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.34 3m1u n TRP 187 Cb 0.51 0.00 0.00 0.00 -1.03 0.00 0.00 31.31 30.79 3m1u n TRP 187 CO 0.00 0.00 0.00 0.41 -0.03 0.00 0.00 177.69 178.07 3m1u n GLY 189 N 5.00 0.00 3.65 6.99 0.00 0.67 -4.85 105.19 116.65 3m1u n GLY 189 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3m1u n GLY 189 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m1u s THR 190 N -0.51 4.91 0.35 2.61 2.01 -1.26 -4.82 115.64 118.94 3m1u s THR 190 Ca 0.00 1.41 -0.28 0.00 0.31 0.00 0.00 61.69 63.13 3m1u s THR 190 Cb 0.00 -4.05 -0.11 0.00 0.01 0.00 0.00 72.50 68.35 3m1u s THR 190 CO 0.00 -0.00 1.43 -2.84 -0.69 0.00 0.00 174.62 172.51 3m1u s PRO 191 N 2.50 4.20 0.08 4.92 0.02 -1.26 -1.51 135.00 143.95 3m1u s PRO 191 Ca 0.32 2.44 0.04 0.00 0.02 0.00 0.00 61.00 63.83 3m1u s PRO 191 Cb -0.16 -3.01 -0.03 0.00 0.02 0.00 0.00 34.50 31.32 3m1u s PRO 191 CO 0.09 -0.42 -0.11 0.14 -0.33 0.00 0.00 177.00 176.37 3m1u s VAL 192 N -1.05 0.92 -0.16 3.83 -7.23 -0.56 -4.39 120.40 111.77 3m1u s VAL 192 Ca 0.52 -1.42 -0.04 0.00 -1.81 0.00 0.00 61.98 59.22 3m1u s VAL 192 Cb -0.44 -1.12 -0.03 0.00 0.56 0.00 0.00 36.38 35.35 3m1u s VAL 192 CO 0.59 -0.42 -0.02 0.12 -0.31 0.00 0.00 175.10 175.06 3m1u s PHE 193 N -1.86 3.06 -0.26 2.82 2.19 -0.36 -1.06 117.98 122.53 3m1u s PHE 193 Ca 0.00 -0.24 -0.10 0.00 0.33 0.00 0.00 56.93 56.93 3m1u s PHE 193 Cb -0.07 -1.98 -0.04 0.00 -1.31 0.00 0.00 43.02 39.62 3m1u s PHE 193 CO 0.01 -0.00 0.15 0.08 1.83 0.00 0.00 175.22 177.28 3m1u s VAL 194 N 0.36 5.05 -0.26 3.12 1.01 0.12 -0.36 120.40 129.44 3m1u s VAL 194 Ca -0.03 0.08 0.07 0.00 0.00 0.00 0.00 61.98 62.10 3m1u s VAL 194 Cb -0.14 -3.38 -0.09 0.00 0.00 0.00 0.00 36.38 32.78 3m1u s VAL 194 CO 0.02 0.31 0.27 0.61 0.00 0.00 0.00 175.10 176.31 3m1u n GLY 195 N 4.74 0.17 3.48 4.51 0.00 -0.35 -2.17 105.19 115.57 3m1u n GLY 195 Ca -0.15 -0.20 -0.10 0.00 0.00 0.00 0.00 46.02 45.57 3m1u n GLY 195 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3m1u s HIS 196 N -1.88 -0.43 0.03 1.61 2.46 -1.15 -1.56 115.29 114.39 3m1u s HIS 196 Ca 0.01 0.31 0.00 0.00 0.47 0.00 0.00 55.06 55.86 3m1u s HIS 196 Cb 0.05 0.54 -0.02 0.00 -0.13 0.00 0.00 32.58 33.01 3m1u s HIS 196 CO 0.30 -0.64 -0.04 0.00 -2.47 0.00 0.00 174.74 171.89 3m1u s ALA 197 N -3.14 0.32 0.90 1.58 0.00 -1.26 -1.24 121.76 118.92 3m1u s ALA 197 Ca 0.03 -0.75 -0.11 0.00 0.00 0.00 0.00 51.96 51.13 3m1u s ALA 197 Cb -0.01 0.14 0.14 0.00 0.00 0.00 0.00 23.12 23.39 3m1u s ALA 197 CO -0.09 -0.16 1.12 0.95 0.00 0.00 0.00 175.76 177.58 3m1u s THR 198 N -1.88 2.42 0.36 0.00 -4.23 -0.35 -4.80 115.64 107.16 3m1u s THR 198 Ca -0.10 0.14 0.05 0.00 -1.18 0.00 0.00 61.69 60.60 3m1u s THR 198 Cb -0.07 -2.31 0.29 0.00 1.34 0.00 0.00 72.50 71.75 3m1u s THR 198 CO -0.02 -0.18 1.96 0.00 -0.54 0.00 0.00 174.62 175.84 3m1u h ALA 199 N -1.74 1.68 -0.01 3.99 0.00 -1.13 -0.95 119.26 121.11 3m1u h ALA 199 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3m1u h ALA 199 Cb 1.27 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3m1u h ALA 199 CO 0.46 0.21 -0.07 -0.40 0.00 0.00 0.00 179.25 179.44 3m1u n ASP 200 N -4.48 0.81 0.00 0.00 5.68 -1.26 -4.93 116.55 112.37 3m1u n ASP 200 Ca 0.10 -1.01 0.00 0.00 -0.50 0.00 0.00 54.79 53.38 3m1u n ASP 200 Cb 0.21 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.19 3m1u n ASP 200 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 3m1u n ARG 201 N -0.54 -0.60 0.20 0.11 1.74 -0.36 -4.89 116.66 112.33 3m1u n ARG 201 Ca 0.18 0.15 0.10 0.00 -0.77 0.00 0.00 57.85 57.50 3m1u n ARG 201 Cb 0.28 -3.68 0.16 0.00 -1.02 0.00 0.00 32.46 28.20 3m1u n ARG 201 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3m1u h ALA 202 N 0.00 0.93 -3.68 7.54 0.00 -1.92 -3.44 119.26 118.70 3m1u h ALA 202 Ca 0.00 -0.11 -0.43 0.00 0.00 0.00 0.00 54.91 54.37 3m1u h ALA 202 Cb 0.30 -0.02 -0.24 0.00 0.00 0.00 0.00 17.79 17.83 3m1u h ALA 202 CO 0.00 0.15 -0.79 -1.58 0.00 0.00 0.00 179.25 177.03 3m1u s TRP 203 N -3.18 1.18 0.16 0.00 0.52 -1.26 -0.97 118.94 115.40 3m1u s TRP 203 Ca 0.06 -0.37 0.10 0.00 0.02 0.00 0.00 56.10 55.91 3m1u s TRP 203 Cb 0.06 -0.70 -0.04 0.00 -1.15 0.00 0.00 33.47 31.64 3m1u s TRP 203 CO 0.68 0.03 -0.17 -0.51 0.02 0.00 0.00 176.95 177.00 3m1u s LEU 204 N -1.22 2.71 -0.26 2.99 1.43 -1.26 -1.21 118.68 121.85 3m1u s LEU 204 Ca 0.01 -0.66 -0.08 0.00 -1.03 0.00 0.00 54.13 52.37 3m1u s LEU 204 Cb -0.08 -1.47 -0.03 0.00 0.03 0.00 0.00 46.19 44.64 3m1u s LEU 204 CO 0.01 0.14 0.10 -0.47 0.23 0.00 0.00 176.35 176.36 3m1u s TYR 205 N -1.48 3.12 0.15 0.29 5.04 -0.38 -4.19 117.35 119.90 3m1u s TYR 205 Ca 0.21 -0.38 0.04 0.00 -2.44 0.00 0.00 57.07 54.50 3m1u s TYR 205 Cb -0.09 -2.28 -0.05 0.00 0.35 0.00 0.00 41.96 39.90 3m1u s TYR 205 CO 0.12 -0.35 -0.08 0.14 -1.34 0.00 0.00 175.55 174.04 3m1u s VAL 206 N 1.63 1.08 -0.13 3.14 -7.23 -0.19 -1.21 120.40 117.49 3m1u s VAL 206 Ca 0.06 -2.04 0.02 0.00 -1.81 0.00 0.00 61.98 58.21 3m1u s VAL 206 Cb -0.16 -1.91 0.01 0.00 0.56 0.00 0.00 36.38 34.89 3m1u s VAL 206 CO 0.05 -0.69 -0.19 -0.70 -0.31 0.00 0.00 175.10 173.26 3m1u s GLU 207 N -3.78 2.68 0.69 4.82 2.12 0.51 -1.62 118.70 124.12 3m1u s GLU 207 Ca 0.18 -0.73 0.02 0.00 0.36 0.00 0.00 54.97 54.80 3m1u s GLU 207 Cb 0.03 -2.22 0.12 0.00 0.26 0.00 0.00 34.13 32.33 3m1u s GLU 207 CO 0.01 -0.05 0.95 0.95 -0.54 0.00 0.00 175.26 176.58 3m1u s THR 208 N 0.94 2.10 0.62 -1.70 -4.23 0.59 -1.22 115.64 112.74 3m1u s THR 208 Ca -0.06 -0.70 0.35 0.00 -1.18 0.00 0.00 61.69 60.11 3m1u s THR 208 Cb -0.15 -2.41 0.39 0.00 1.34 0.00 0.00 72.50 71.67 3m1u s THR 208 CO -0.03 0.00 2.30 0.00 -0.54 0.00 0.00 174.62 176.35 3m1u h ALA 209 N -0.38 1.34 0.00 3.99 0.00 -1.80 -3.30 119.26 119.11 3m1u h ALA 209 Ca -0.34 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3m1u h ALA 209 Cb 1.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3m1u h ALA 209 CO 0.39 0.00 0.00 1.97 0.00 0.00 0.00 179.25 181.62 3m1u n PHE 210 N -3.57 0.00 -3.61 0.00 1.16 -1.26 -5.01 117.46 105.17 3m1u n PHE 210 Ca -0.03 0.00 -0.00 0.00 -1.87 0.00 0.00 57.45 55.55 3m1u n PHE 210 Cb 0.08 0.00 -0.01 0.00 -1.61 0.00 0.00 39.48 37.94 3m1u n PHE 210 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 3m1u s ALA 211 N -0.65 -2.19 0.09 1.98 0.00 -1.24 -4.54 121.76 115.21 3m1u s ALA 211 Ca 0.00 0.96 0.02 0.00 0.00 0.00 0.00 51.96 52.93 3m1u s ALA 211 Cb 0.00 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.30 3m1u s ALA 211 CO 0.00 -0.92 -0.07 0.00 0.00 0.00 0.00 175.76 174.77 3m1u s ALA 212 N -2.42 0.91 0.00 0.00 0.00 -1.26 -0.30 121.76 118.69 3m1u s ALA 212 Ca 0.13 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.81 3m1u s ALA 212 Cb 0.03 0.15 0.00 0.00 0.00 0.00 0.00 23.12 23.30 3m1u s ALA 212 CO -0.04 -0.22 0.00 0.41 0.00 0.00 0.00 175.76 175.91 3m1u n GLY 213 N 0.12 -1.72 3.95 0.00 0.00 -0.64 -4.89 105.19 102.02 3m1u n GLY 213 Ca -0.13 -1.14 -0.24 0.00 0.00 0.00 0.00 46.02 44.51 3m1u n GLY 213 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3m1u s TRP 214 N -2.63 2.69 -0.13 1.61 0.52 -0.36 -1.02 118.94 119.61 3m1u s TRP 214 Ca 0.00 0.18 -0.11 0.00 0.02 0.00 0.00 56.10 56.19 3m1u s TRP 214 Cb 0.00 -3.04 -0.05 0.00 -1.15 0.00 0.00 33.47 29.23 3m1u s TRP 214 CO 0.00 -1.29 0.22 -2.14 0.02 0.00 0.00 176.95 173.75 3m1u s PRO 216 N -5.08 3.90 0.41 4.98 0.02 -1.26 -0.37 135.00 137.61 3m1u s PRO 216 Ca 0.60 -0.02 0.08 0.00 0.02 0.00 0.00 61.00 61.69 3m1u s PRO 216 Cb -0.10 -3.31 0.86 0.00 0.02 0.00 0.00 34.50 31.97 3m1u s PRO 216 CO 0.43 0.51 2.02 0.00 -0.33 0.00 0.00 177.00 179.62 3m1u h ALA 217 N 5.80 1.66 0.00 -1.55 0.00 -1.33 -2.29 119.26 121.54 3m1u h ALA 217 Ca -0.47 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3m1u h ALA 217 Cb 1.19 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.85 3m1u h ALA 217 CO 0.68 0.28 0.00 0.00 0.00 0.00 0.00 179.25 180.20 3m1u n ALA 218 N -2.49 1.60 1.57 0.00 0.00 -1.26 -1.93 120.51 118.00 3m1u n ALA 218 Ca 0.01 0.04 0.14 0.00 0.00 0.00 0.00 53.44 53.64 3m1u n ALA 218 Cb 0.12 -1.32 0.61 0.00 0.00 0.00 0.00 19.45 18.86 3m1u n ALA 218 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3m1u n ASP 219 N -1.97 1.07 -4.19 0.00 8.00 -0.86 -4.84 116.55 113.76 3m1u n ASP 219 Ca 0.02 -1.27 -0.31 0.00 0.71 0.00 0.00 54.79 53.94 3m1u n ASP 219 Cb 0.19 0.01 -0.17 0.00 -0.02 0.00 0.00 41.12 41.13 3m1u n ASP 219 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3m1u s VAL 220 N -2.08 1.97 -0.11 2.53 1.01 -0.82 -1.15 120.40 121.75 3m1u s VAL 220 Ca 0.38 -0.96 -0.05 0.00 0.00 0.00 0.00 61.98 61.35 3m1u s VAL 220 Cb 0.21 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 3m1u s VAL 220 CO 0.37 0.54 0.07 0.00 0.00 0.00 0.00 175.10 176.08 3m1u s ALA 221 N 0.46 3.57 0.20 5.51 0.00 -0.22 -4.92 121.76 126.35 3m1u s ALA 221 Ca -0.16 -0.72 -0.30 0.00 0.00 0.00 0.00 51.96 50.77 3m1u s ALA 221 Cb -0.17 -1.76 -0.08 0.00 0.00 0.00 0.00 23.12 21.11 3m1u s ALA 221 CO 0.06 0.55 1.07 0.50 0.00 0.00 0.00 175.76 177.94 3m1u s ARG 222 N -0.79 4.64 0.09 0.00 3.52 -0.34 -1.05 118.95 125.02 3m1u s ARG 222 Ca 0.13 1.68 0.08 0.00 -0.13 0.00 0.00 55.73 57.48 3m1u s ARG 222 Cb -0.12 -3.27 -0.04 0.00 -1.56 0.00 0.00 34.95 29.96 3m1u s ARG 222 CO 0.03 0.17 -0.15 0.14 -0.81 0.00 0.00 175.30 174.67 3m1u s VAL 223 N -0.48 3.02 0.51 7.11 -7.23 -0.38 -1.02 120.40 121.92 3m1u s VAL 223 Ca 0.47 -1.33 0.06 0.00 -1.81 0.00 0.00 61.98 59.37 3m1u s VAL 223 Cb -0.29 -2.36 0.01 0.00 0.56 0.00 0.00 36.38 34.30 3m1u s VAL 223 CO 0.35 0.17 0.33 1.51 -0.31 0.00 0.00 175.10 177.15 3m1u s ASP 224 N -1.96 4.59 0.18 4.85 1.47 -1.26 -4.64 116.67 119.89 3m1u s ASP 224 Ca 0.18 -1.21 -0.14 0.00 1.18 0.00 0.00 52.55 52.56 3m1u s ASP 224 Cb -0.11 0.19 0.13 0.00 -0.34 0.00 0.00 42.92 42.79 3m1u s ASP 224 CO 0.10 -0.95 1.77 0.44 0.68 0.00 0.00 175.17 177.21 3m1u h ASP 225 N 0.94 0.28 -0.18 2.11 3.32 -2.01 -2.31 116.42 118.58 3m1u h ASP 225 Ca -0.39 0.04 0.05 0.00 0.02 0.00 0.00 57.03 56.75 3m1u h ASP 225 Cb 1.29 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.79 3m1u h ASP 225 CO 0.61 0.20 -0.13 0.00 -1.72 0.00 0.00 179.24 178.19 3m1u h ALA 226 N 1.28 0.01 0.00 3.45 0.00 -2.05 -0.84 119.26 121.10 3m1u h ALA 226 Ca 0.22 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3m1u h ALA 226 Cb 0.16 0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3m1u h ALA 226 CO -0.18 -0.56 0.00 0.34 0.00 0.00 0.00 179.25 178.85 3m1u n PHE 227 N -5.28 0.00 0.00 0.00 -0.00 -0.87 -2.09 117.46 109.22 3m1u n PHE 227 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.43 3m1u n PHE 227 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.68 3m1u n PHE 227 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.76 179.17 3m1u n THR 229 N 0.29 0.00 -0.09 -2.13 -1.04 -0.32 -0.53 114.28 110.46 3m1u n THR 229 Ca 0.00 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.91 3m1u n THR 229 Cb 0.00 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.48 3m1u n THR 229 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 3m1u h ARG 230 N 0.00 0.44 -0.91 -2.82 3.08 -1.66 -2.44 114.38 110.07 3m1u h ARG 230 Ca 0.00 -0.09 0.05 0.00 0.07 0.00 0.00 59.98 60.01 3m1u h ARG 230 Cb 0.00 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 29.92 3m1u h ARG 230 CO 0.00 0.49 0.58 -0.92 -1.07 0.00 0.00 179.97 179.05 3m1u h TYR 231 N 0.31 1.08 -0.00 3.04 3.20 -1.06 -2.27 116.97 121.27 3m1u h TYR 231 Ca 0.09 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.99 3m1u h TYR 231 Cb 0.23 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 38.15 3m1u h TYR 231 CO 0.00 0.58 -0.15 0.39 -1.64 0.00 0.00 178.16 177.34 3m1u n GLU 232 N -4.55 0.25 -2.37 1.82 1.02 -1.20 -4.73 120.64 110.87 3m1u n GLU 232 Ca 0.13 -0.07 -0.31 0.00 -0.02 0.00 0.00 57.16 56.89 3m1u n GLU 232 Cb 0.15 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.05 3m1u n GLU 232 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 3m1u s SER 233 N -2.80 6.45 0.26 1.62 1.04 -0.86 -4.91 113.70 114.50 3m1u s SER 233 Ca 0.19 1.36 0.00 0.00 0.48 0.00 0.00 55.95 57.98 3m1u s SER 233 Cb 0.19 -2.43 0.00 0.00 0.10 0.00 0.00 66.02 63.88 3m1u s SER 233 CO 0.55 -0.63 0.00 0.61 0.98 0.00 0.00 173.24 174.75 3m1u n GLY 234 N -1.94 -1.87 3.87 7.32 0.00 -1.26 -4.91 105.19 106.40 3m1u n GLY 234 Ca 0.05 -1.33 -0.31 0.00 0.00 0.00 0.00 46.02 44.43 3m1u n GLY 234 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3m1u s SER 235 N -3.92 6.41 0.13 1.61 0.01 -1.26 -4.95 113.70 111.72 3m1u s SER 235 Ca 0.00 1.38 0.05 0.00 1.31 0.00 0.00 55.95 58.69 3m1u s SER 235 Cb 0.00 -2.44 -0.04 0.00 0.21 0.00 0.00 66.02 63.75 3m1u s SER 235 CO 0.00 -0.68 0.04 -0.76 0.41 0.00 0.00 173.24 172.26 3m1u s LEU 236 N -4.57 3.55 0.05 2.44 1.43 -1.26 -1.28 118.68 119.04 3m1u s LEU 236 Ca 0.55 -0.20 0.04 0.00 -1.03 0.00 0.00 54.13 53.48 3m1u s LEU 236 Cb -0.10 -2.22 -0.04 0.00 0.03 0.00 0.00 46.19 43.86 3m1u s LEU 236 CO 0.42 0.13 -0.02 0.00 0.23 0.00 0.00 176.35 177.10 3m1u s ALA 237 N -1.54 3.20 -0.17 4.21 0.00 0.19 -0.68 121.76 126.97 3m1u s ALA 237 Ca 0.28 -1.07 -0.07 0.00 0.00 0.00 0.00 51.96 51.10 3m1u s ALA 237 Cb -0.11 -1.19 -0.04 0.00 0.00 0.00 0.00 23.12 21.78 3m1u s ALA 237 CO 0.20 0.66 0.06 0.00 0.00 0.00 0.00 175.76 176.69 3m1u s ALA 238 N -1.18 3.44 0.18 0.00 0.00 0.11 -1.72 121.76 122.58 3m1u s ALA 238 Ca 0.22 -0.74 -0.30 0.00 0.00 0.00 0.00 51.96 51.14 3m1u s ALA 238 Cb -0.11 -1.89 -0.08 0.00 0.00 0.00 0.00 23.12 21.04 3m1u s ALA 238 CO 0.14 0.25 1.15 0.42 0.00 0.00 0.00 175.76 177.71 3m1u s ILE 239 N 0.16 3.73 -0.46 0.00 -1.09 -0.60 -2.06 121.20 120.88 3m1u s ILE 239 Ca 0.05 1.46 0.07 0.00 -2.23 0.00 0.00 60.65 60.00 3m1u s ILE 239 Cb -0.12 -3.94 -0.05 0.00 -1.58 0.00 0.00 42.46 36.77 3m1u s ILE 239 CO 0.00 0.24 0.38 0.18 -1.23 0.00 0.00 174.94 174.52 3m1u n LEU 240 N 2.49 0.58 -4.08 2.97 4.77 0.10 -4.17 117.00 119.66 3m1u n LEU 240 Ca 0.04 -0.59 -0.19 0.00 -0.03 0.00 0.00 56.01 55.24 3m1u n LEU 240 Cb 0.45 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.40 3m1u n LEU 240 CO 0.55 0.13 -0.45 -0.13 -1.33 0.00 0.00 177.39 176.16 3m1u s ARG 241 N -1.49 0.83 0.65 3.23 0.52 -1.26 -4.87 118.95 116.57 3m1u s ARG 241 Ca 0.04 -0.53 -0.15 0.00 -0.52 0.00 0.00 55.73 54.57 3m1u s ARG 241 Cb 0.06 -0.80 -0.00 0.00 0.52 0.00 0.00 34.95 34.72 3m1u s ARG 241 CO 0.26 0.21 1.11 -0.51 0.02 0.00 0.00 175.30 176.38 3m1u s ASP 242 N -0.65 5.16 -1.45 0.23 1.01 -1.26 -3.78 116.67 115.93 3m1u s ASP 242 Ca 0.02 1.99 -0.09 0.00 0.71 0.00 0.00 52.55 55.19 3m1u s ASP 242 Cb -0.06 -2.55 0.03 0.00 1.01 0.00 0.00 42.92 41.35 3m1u s ASP 242 CO 0.00 -1.60 0.95 0.47 0.21 0.00 0.00 175.17 175.20 3m1u n ASP 243 N -2.37 -5.89 -4.59 0.27 8.00 -1.15 -4.93 116.55 105.89 3m1u n ASP 243 Ca 0.10 -0.50 -0.43 0.00 0.71 0.00 0.00 54.79 54.67 3m1u n ASP 243 Cb 0.52 -4.69 -0.03 0.00 -0.02 0.00 0.00 41.12 36.91 3m1u n ASP 243 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3m1u s THR 244 N -3.25 4.24 0.04 -3.53 2.01 0.25 -4.88 115.64 110.52 3m1u s THR 244 Ca 0.51 1.04 -0.30 0.00 0.31 0.00 0.00 61.69 63.25 3m1u s THR 244 Cb -0.24 -4.58 -0.05 0.00 0.01 0.00 0.00 72.50 67.64 3m1u s THR 244 CO 0.63 -1.02 1.22 -0.55 -0.69 0.00 0.00 174.62 174.21 3m1u s SER 245 N 2.50 7.04 -0.36 3.53 0.15 -1.26 -0.29 113.70 125.01 3m1u s SER 245 Ca 0.44 2.00 -0.10 0.00 0.70 0.00 0.00 55.95 59.00 3m1u s SER 245 Cb -0.08 -2.57 0.03 0.00 -1.71 0.00 0.00 66.02 61.68 3m1u s SER 245 CO 0.29 -0.52 0.18 -0.76 1.20 0.00 0.00 173.24 173.63 3m1u s LEU 246 N 1.37 4.57 -0.02 3.45 1.43 0.67 -4.96 118.68 125.19 3m1u s LEU 246 Ca 0.59 -1.00 0.07 0.00 -1.03 0.00 0.00 54.13 52.76 3m1u s LEU 246 Cb -0.29 -1.98 -0.02 0.00 0.03 0.00 0.00 46.19 43.93 3m1u s LEU 246 CO 0.28 -0.36 -0.24 0.20 0.23 0.00 0.00 176.35 176.46 3m1u s ASN 247 N 1.52 2.84 0.94 2.29 0.01 -1.26 -0.81 114.94 120.46 3m1u s ASN 247 Ca 0.01 -0.44 -0.11 0.00 -0.71 0.00 0.00 52.86 51.61 3m1u s ASN 247 Cb -0.19 -0.39 0.15 0.00 0.41 0.00 0.00 41.25 41.24 3m1u s ASN 247 CO 0.06 0.29 1.09 -0.83 -1.51 0.00 0.00 177.10 176.19 3m1u s GLY 248 N -0.50 1.62 0.56 0.66 0.00 0.08 -4.44 107.32 105.30 3m1u s GLY 248 Ca 0.07 0.08 0.28 0.00 0.00 0.00 0.00 44.72 45.15 3m1u s GLY 248 CO -0.00 0.58 2.17 0.00 0.00 0.00 0.00 173.10 175.85 3m1u h ALA 249 N -1.76 1.44 0.00 3.20 0.00 -1.90 -1.04 119.26 119.19 3m1u h ALA 249 Ca -0.50 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.36 3m1u h ALA 249 Cb 1.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.07 3m1u h ALA 249 CO 0.51 0.07 0.00 -0.40 0.00 0.00 0.00 179.25 179.43 3m1u n ASP 250 N -3.79 0.00 0.00 0.00 5.75 -1.26 -4.89 116.55 112.36 3m1u n ASP 250 Ca -0.02 -0.89 0.00 0.00 -0.01 0.00 0.00 54.79 53.87 3m1u n ASP 250 Cb 0.15 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 3m1u n ASP 250 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3m1u n GLY 251 N 0.66 1.03 3.69 6.12 0.00 -0.40 -5.04 105.19 111.25 3m1u n GLY 251 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3m1u n GLY 251 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m1u s THR 252 N -3.12 3.64 0.07 2.61 2.01 -1.26 -4.76 115.64 114.83 3m1u s THR 252 Ca 0.00 1.05 -0.30 0.00 0.31 0.00 0.00 61.69 62.75 3m1u s THR 252 Cb 0.00 -3.67 -0.06 0.00 0.01 0.00 0.00 72.50 68.78 3m1u s THR 252 CO 0.00 0.01 1.13 -2.28 -0.69 0.00 0.00 174.62 172.79 3m1u s HIS 253 N 2.27 3.52 -0.16 4.92 2.46 -1.26 -0.74 115.29 126.30 3m1u s HIS 253 Ca 0.64 1.46 -0.12 0.00 0.47 0.00 0.00 55.06 57.51 3m1u s HIS 253 Cb -0.32 -3.32 -0.07 0.00 -0.13 0.00 0.00 32.58 28.74 3m1u s HIS 253 CO 0.27 -0.85 -0.26 1.28 -2.47 0.00 0.00 174.74 172.71 3m1u n LEU 254 N 3.57 1.59 -3.78 8.88 4.77 0.01 -4.96 117.00 127.08 3m1u n LEU 254 Ca 0.07 0.27 -0.01 0.00 -0.03 0.00 0.00 56.01 56.30 3m1u n LEU 254 Cb 0.47 -0.62 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 3m1u n LEU 254 CO 0.54 0.03 0.88 0.00 -1.33 0.00 0.00 177.39 177.52 3m1u s ALA 255 N -2.52 -1.89 -0.06 -1.18 0.00 -1.15 -4.97 121.76 109.99 3m1u s ALA 255 Ca -0.25 0.13 0.04 0.00 0.00 0.00 0.00 51.96 51.88 3m1u s ALA 255 Cb 0.07 0.63 -0.02 0.00 0.00 0.00 0.00 23.12 23.80 3m1u s ALA 255 CO 0.34 -1.07 -0.19 0.99 0.00 0.00 0.00 175.76 175.84 3m1u s THR 256 N -2.59 2.64 0.07 0.00 2.01 -1.26 -0.24 115.64 116.27 3m1u s THR 256 Ca 0.17 -0.86 0.09 0.00 0.31 0.00 0.00 61.69 61.40 3m1u s THR 256 Cb 0.00 -2.02 -0.03 0.00 0.01 0.00 0.00 72.50 70.46 3m1u s THR 256 CO 0.01 0.57 -0.23 0.00 -0.69 0.00 0.00 174.62 174.28 3m1u s ALA 257 N -0.33 2.42 0.36 7.40 0.00 0.60 -4.63 121.76 127.58 3m1u s ALA 257 Ca 0.02 -1.30 0.08 0.00 0.00 0.00 0.00 51.96 50.76 3m1u s ALA 257 Cb -0.13 -0.55 -0.07 0.00 0.00 0.00 0.00 23.12 22.38 3m1u s ALA 257 CO 0.02 0.55 -0.04 -1.01 0.00 0.00 0.00 175.76 175.29 3m1u s HIS 258 N -0.92 2.36 0.20 0.00 3.76 -1.26 -0.58 115.29 118.85 3m1u s HIS 258 Ca 0.14 -0.63 -0.32 0.00 -0.15 0.00 0.00 55.06 54.09 3m1u s HIS 258 Cb -0.10 -1.50 -0.14 0.00 1.11 0.00 0.00 32.58 31.96 3m1u s HIS 258 CO 0.05 0.45 1.49 -0.89 -0.85 0.00 0.00 174.74 174.98 3m1u n ILE 259 N -0.83 0.51 0.00 0.60 5.41 -1.25 -1.38 119.36 122.43 3m1u n ILE 259 Ca -0.05 -0.13 0.00 0.00 1.00 0.00 0.00 62.75 63.57 3m1u n ILE 259 Cb 0.65 -1.52 0.00 0.00 -0.71 0.00 0.00 39.64 38.06 3m1u n ILE 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3m1u n GLY 260 N 2.73 2.06 3.76 7.39 0.00 -1.25 -4.85 105.19 115.03 3m1u n GLY 260 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 3m1u n GLY 260 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3m1u s THR 261 N -2.38 4.26 0.01 2.61 2.01 -0.48 -4.97 115.64 116.71 3m1u s THR 261 Ca 0.00 1.91 0.04 0.00 0.31 0.00 0.00 61.69 63.96 3m1u s THR 261 Cb 0.00 -4.24 -0.01 0.00 0.01 0.00 0.00 72.50 68.25 3m1u s THR 261 CO 0.00 0.49 -0.14 0.68 -0.69 0.00 0.00 174.62 174.96 3m1u s VAL 262 N -1.01 1.09 0.03 3.82 -7.23 -1.26 -1.56 120.40 114.27 3m1u s VAL 262 Ca 0.39 -0.75 -0.03 0.00 -1.81 0.00 0.00 61.98 59.78 3m1u s VAL 262 Cb -0.24 -0.94 -0.02 0.00 0.56 0.00 0.00 36.38 35.74 3m1u s VAL 262 CO 0.29 0.18 0.04 -0.76 -0.31 0.00 0.00 175.10 174.55 3m1u s LEU 263 N -0.65 2.02 0.39 1.32 1.43 -0.70 -4.77 118.68 117.72 3m1u s LEU 263 Ca 0.04 -0.56 -0.27 0.00 -1.03 0.00 0.00 54.13 52.30 3m1u s LEU 263 Cb -0.06 0.39 -0.11 0.00 0.03 0.00 0.00 46.19 46.45 3m1u s LEU 263 CO 0.00 -0.45 1.41 -2.65 0.23 0.00 0.00 176.35 174.90 3m1u n PRO 264 N 0.99 2.39 -3.71 1.29 -0.02 -1.26 0.55 135.00 135.23 3m1u n PRO 264 Ca -0.20 0.84 -0.37 0.00 -2.02 0.00 0.00 63.50 61.75 3m1u n PRO 264 Cb 0.57 -2.56 -0.12 0.00 -0.02 0.00 0.00 33.50 31.37 3m1u n PRO 264 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3m1u s LEU 265 N -1.93 3.79 -0.00 2.45 2.96 -0.40 -1.00 118.68 124.54 3m1u s LEU 265 Ca 0.56 -0.38 0.15 0.00 -0.22 0.00 0.00 54.13 54.23 3m1u s LEU 265 Cb -0.49 -1.96 -0.17 0.00 0.50 0.00 0.00 46.19 44.07 3m1u s LEU 265 CO 0.62 -0.12 0.57 -1.54 -1.32 0.00 0.00 176.35 174.56 3m1u n SER 266 N 4.95 0.84 -3.53 3.68 3.41 0.94 -4.37 113.62 119.53 3m1u n SER 266 Ca -0.15 -0.70 -0.09 0.00 -0.26 0.00 0.00 58.87 57.67 3m1u n SER 266 Cb 0.50 1.12 -0.03 0.00 -0.26 0.00 0.00 64.21 65.54 3m1u n SER 266 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 3m1u s GLY 267 N -2.61 -0.41 -0.15 5.00 0.00 -1.06 -4.96 107.32 103.13 3m1u s GLY 267 Ca 0.04 1.35 -0.09 0.00 0.00 0.00 0.00 44.72 46.02 3m1u s GLY 267 CO 0.61 0.58 0.37 0.00 0.00 0.00 0.00 173.10 174.66 3m1u s ALA 268 N -2.41 -0.93 0.00 3.20 0.00 -1.26 -0.46 121.76 119.90 3m1u s ALA 268 Ca 0.02 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.36 3m1u s ALA 268 Cb -0.01 -0.84 0.00 0.00 0.00 0.00 0.00 23.12 22.27 3m1u s ALA 268 CO -0.05 -0.24 0.00 -1.13 0.00 0.00 0.00 175.76 174.34 3m1u n SER 269 N 4.15 1.65 -0.10 0.00 3.41 0.51 -4.99 113.62 118.25 3m1u n SER 269 Ca -0.23 -0.46 -0.10 0.00 -0.26 0.00 0.00 58.87 57.82 3m1u n SER 269 Cb 0.55 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.47 3m1u n SER 269 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 3m1u h GLN 270 N 0.00 0.45 -0.00 4.33 -0.00 -2.03 -3.31 115.11 114.55 3m1u h GLN 270 Ca 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 58.65 58.56 3m1u h GLN 270 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 27.48 27.41 3m1u h GLN 270 CO 0.00 0.48 -0.06 1.33 0.00 0.00 0.00 178.83 180.58 3m1u n VAL 271 N -4.72 0.00 -4.32 2.39 0.24 -1.26 -4.89 118.33 105.77 3m1u n VAL 271 Ca -0.02 -0.47 -0.28 0.00 -2.04 0.00 0.00 64.34 61.53 3m1u n VAL 271 Cb 0.15 1.06 -0.11 0.00 -1.47 0.00 0.00 33.84 33.47 3m1u n VAL 271 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3m1u s GLY 272 N -0.70 1.71 -0.03 7.63 0.00 -1.25 -0.26 107.32 114.43 3m1u s GLY 272 Ca 0.04 -1.44 -0.00 0.00 0.00 0.00 0.00 44.72 43.32 3m1u s GLY 272 CO 0.09 -1.44 0.02 0.50 0.00 0.00 0.00 173.10 172.28 3m1u s ARG 273 N -2.45 0.12 -0.21 2.90 1.81 0.18 -0.36 118.95 120.94 3m1u s ARG 273 Ca 0.21 0.17 -0.08 0.00 -1.72 0.00 0.00 55.73 54.30 3m1u s ARG 273 Cb -0.10 -0.41 -0.04 0.00 -0.45 0.00 0.00 34.95 33.95 3m1u s ARG 273 CO 0.12 -0.18 0.09 0.99 -0.68 0.00 0.00 175.30 175.63 3m1u s THR 274 N 1.24 4.88 0.23 0.02 2.01 0.40 0.05 115.64 124.46 3m1u s THR 274 Ca -0.07 0.00 0.10 0.00 0.31 0.00 0.00 61.69 62.04 3m1u s THR 274 Cb -0.13 -3.23 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 3m1u s THR 274 CO -0.03 0.42 -0.13 0.68 -0.69 0.00 0.00 174.62 174.87 3m1u s VAL 275 N 0.70 2.92 -0.26 3.82 -7.23 -0.17 -0.04 120.40 120.14 3m1u s VAL 275 Ca 0.05 -1.98 -0.10 0.00 -1.81 0.00 0.00 61.98 58.14 3m1u s VAL 275 Cb -0.13 -2.49 -0.05 0.00 0.56 0.00 0.00 36.38 34.28 3m1u s VAL 275 CO 0.02 -0.25 0.15 -0.76 -0.31 0.00 0.00 175.10 173.96 3m1u s LEU 276 N -3.17 3.92 -0.24 1.32 1.43 -0.17 -0.40 118.68 121.38 3m1u s LEU 276 Ca 0.27 -0.02 -0.07 0.00 -1.03 0.00 0.00 54.13 53.28 3m1u s LEU 276 Cb -0.07 -2.07 -0.03 0.00 0.03 0.00 0.00 46.19 44.05 3m1u s LEU 276 CO 0.15 -0.01 0.06 -0.69 0.23 0.00 0.00 176.35 176.09 3m1u s VAL 277 N 1.51 4.29 0.19 -1.59 1.01 -0.43 -4.20 120.40 121.18 3m1u s VAL 277 Ca 0.07 -0.18 -0.30 0.00 0.00 0.00 0.00 61.98 61.56 3m1u s VAL 277 Cb -0.15 -2.99 -0.08 0.00 0.00 0.00 0.00 36.38 33.16 3m1u s VAL 277 CO 0.08 0.36 1.22 -2.16 0.00 0.00 0.00 175.10 174.60 3m1u s PRO 278 N 1.42 4.47 0.01 2.72 0.04 -1.26 -0.85 135.00 141.55 3m1u s PRO 278 Ca 0.05 1.91 0.04 0.00 0.04 0.00 0.00 61.00 63.05 3m1u s PRO 278 Cb -0.15 -3.23 -0.01 0.00 0.04 0.00 0.00 34.50 31.15 3m1u s PRO 278 CO 0.03 -0.12 -0.13 0.08 0.04 0.00 0.00 177.00 176.90 3m1u s VAL 279 N -0.02 1.04 -0.25 -0.36 1.01 0.90 -4.75 120.40 117.97 3m1u s VAL 279 Ca 0.54 -0.73 -0.21 0.00 0.00 0.00 0.00 61.98 61.57 3m1u s VAL 279 Cb -0.33 -0.90 -0.02 0.00 0.00 0.00 0.00 36.38 35.13 3m1u s VAL 279 CO 0.37 0.16 0.68 -0.60 0.00 0.00 0.00 175.10 175.72 3m1u s ARG 280 N -0.65 4.13 0.81 2.72 3.52 -1.26 -1.09 118.95 127.12 3m1u s ARG 280 Ca 0.03 0.65 -0.11 0.00 -0.13 0.00 0.00 55.73 56.17 3m1u s ARG 280 Cb -0.06 -3.65 0.07 0.00 -1.56 0.00 0.00 34.95 29.76 3m1u s ARG 280 CO 0.00 -0.43 1.09 0.00 -0.81 0.00 0.00 175.30 175.15 3m1u s ALA 281 N 2.57 2.15 0.54 6.12 0.00 -0.14 -4.90 121.76 128.11 3m1u s ALA 281 Ca 0.28 -0.12 0.23 0.00 0.00 0.00 0.00 51.96 52.35 3m1u s ALA 281 Cb -0.15 -3.14 1.43 0.00 0.00 0.00 0.00 23.12 21.26 3m1u s ALA 281 CO 0.08 -1.80 2.10 -1.35 0.00 0.00 0.00 175.76 174.79 3m1u h PRO 282 N -1.14 0.00 -0.08 0.00 0.11 -1.97 -0.19 132.00 128.73 3m1u h PRO 282 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3m1u h PRO 282 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3m1u h PRO 282 CO 0.58 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.76 3m1u n GLU 283 N -4.29 1.44 0.00 1.05 4.71 -1.26 -4.93 120.64 117.37 3m1u n GLU 283 Ca 0.02 -0.66 0.00 0.00 -0.01 0.00 0.00 57.16 56.51 3m1u n GLU 283 Cb 0.30 -1.39 0.00 0.00 -1.01 0.00 0.00 31.44 29.35 3m1u n GLU 283 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3m1u n GLY 284 N 1.02 1.27 3.90 0.62 0.00 -0.08 -5.05 105.19 106.88 3m1u n GLY 284 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.90 3m1u n GLY 284 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 3m1u s HIS 285 N -2.33 3.56 0.14 1.61 -3.43 -1.26 -1.19 115.29 112.38 3m1u s HIS 285 Ca 0.00 0.89 -0.29 0.00 -0.80 0.00 0.00 55.06 54.86 3m1u s HIS 285 Cb 0.00 -2.36 -0.07 0.00 -1.43 0.00 0.00 32.58 28.72 3m1u s HIS 285 CO 0.00 -0.30 0.92 0.00 -2.00 0.00 0.00 174.74 173.36 3m1u s ALA 286 N -2.74 3.30 0.30 -1.38 0.00 -0.19 -0.97 121.76 120.09 3m1u s ALA 286 Ca 0.49 0.53 0.08 0.00 0.00 0.00 0.00 51.96 53.06 3m1u s ALA 286 Cb -0.10 -3.20 -0.06 0.00 0.00 0.00 0.00 23.12 19.76 3m1u s ALA 286 CO 0.44 0.07 -0.09 0.14 0.00 0.00 0.00 175.76 176.32 3m1u s VAL 287 N -0.41 1.95 -0.08 0.00 -7.23 -0.25 -4.94 120.40 109.45 3m1u s VAL 287 Ca 0.43 -2.18 0.01 0.00 -1.81 0.00 0.00 61.98 58.43 3m1u s VAL 287 Cb -0.24 -2.50 -0.03 0.00 0.56 0.00 0.00 36.38 34.18 3m1u s VAL 287 CO 0.29 -0.28 -0.08 0.68 -0.31 0.00 0.00 175.10 175.40 3m1u s VAL 288 N -2.81 3.57 -0.16 1.32 -7.23 -1.26 -0.07 120.40 113.76 3m1u s VAL 288 Ca 0.30 -0.52 0.01 0.00 -1.81 0.00 0.00 61.98 59.96 3m1u s VAL 288 Cb 0.02 -2.46 0.01 0.00 0.56 0.00 0.00 36.38 34.51 3m1u s VAL 288 CO 0.14 0.58 -0.18 -0.69 -0.31 0.00 0.00 175.10 174.64 3m1u s VAL 289 N -0.59 2.37 0.22 1.32 1.01 -0.03 -4.90 120.40 119.80 3m1u s VAL 289 Ca 0.09 -0.86 -0.30 0.00 0.00 0.00 0.00 61.98 60.91 3m1u s VAL 289 Cb -0.12 -1.99 -0.09 0.00 0.00 0.00 0.00 36.38 34.19 3m1u s VAL 289 CO 0.02 0.53 1.20 -2.84 0.00 0.00 0.00 175.10 174.00 3m1u s PRO 290 N 0.94 4.50 -0.06 2.72 0.02 -1.26 -1.31 135.00 140.55 3m1u s PRO 290 Ca -0.03 1.91 0.02 0.00 0.02 0.00 0.00 61.00 62.92 3m1u s PRO 290 Cb -0.15 -3.21 0.01 0.00 0.02 0.00 0.00 34.50 31.17 3m1u s PRO 290 CO -0.03 -0.05 -0.11 0.08 -0.33 0.00 0.00 177.00 176.55 3m1u s VAL 291 N -0.36 1.06 -0.22 3.83 1.01 0.46 -4.27 120.40 121.91 3m1u s VAL 291 Ca 0.51 -0.44 -0.19 0.00 0.00 0.00 0.00 61.98 61.86 3m1u s VAL 291 Cb -0.34 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 3m1u s VAL 291 CO 0.39 0.34 0.57 -0.22 0.00 0.00 0.00 175.10 176.17 3m1u s LEU 292 N 0.63 4.12 0.41 3.92 2.96 -1.26 -1.00 118.68 128.46 3m1u s LEU 292 Ca -0.13 0.70 0.07 0.00 -0.22 0.00 0.00 54.13 54.55 3m1u s LEU 292 Cb -0.15 -2.77 -0.07 0.00 0.50 0.00 0.00 46.19 43.70 3m1u s LEU 292 CO 0.03 -0.25 0.06 -0.76 -1.32 0.00 0.00 176.35 174.11 3m1u s LEU 293 N 1.97 2.95 0.62 -0.68 1.43 0.11 -4.92 118.68 120.15 3m1u s LEU 293 Ca 0.25 -1.28 -0.06 0.00 -1.03 0.00 0.00 54.13 52.01 3m1u s LEU 293 Cb -0.16 -1.07 0.02 0.00 0.03 0.00 0.00 46.19 45.02 3m1u s LEU 293 CO 0.09 -0.49 0.93 0.42 0.23 0.00 0.00 176.35 177.54 3m1u s THR 294 N -2.68 3.35 -0.48 5.49 -4.23 -1.26 -0.65 115.64 115.18 3m1u s THR 294 Ca 0.37 -0.04 0.25 0.00 -1.18 0.00 0.00 61.69 61.08 3m1u s THR 294 Cb 0.08 -3.35 0.27 0.00 1.34 0.00 0.00 72.50 70.83 3m1u s THR 294 CO 0.19 -0.37 1.74 0.77 -0.54 0.00 0.00 174.62 176.41 3m1u h SER 295 N -0.28 0.00 1.33 3.99 4.64 -0.84 -1.41 113.55 120.98 3m1u h SER 295 Ca -0.45 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.85 3m1u h SER 295 Cb 1.27 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.36 3m1u h SER 295 CO 0.61 0.00 -0.09 1.23 -0.87 0.00 0.00 176.83 177.70 3m1u h GLY 296 N 2.65 0.00 0.00 -0.77 0.00 -1.93 -3.35 103.07 99.67 3m1u h GLY 296 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 3m1u h GLY 296 CO 0.00 0.00 -1.95 1.18 0.00 0.00 0.00 176.54 175.77 3m1u n GLU 297 N -3.17 0.64 -3.72 4.80 1.02 -0.57 -4.54 120.64 115.10 3m1u n GLU 297 Ca 0.02 -0.16 -0.14 0.00 -0.02 0.00 0.00 57.16 56.86 3m1u n GLU 297 Cb 0.44 -1.47 -0.09 0.00 -0.02 0.00 0.00 31.44 30.29 3m1u n GLU 297 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3m1u s ALA 298 N -3.27 -1.06 0.06 0.62 0.00 -0.96 -0.72 121.76 116.42 3m1u s ALA 298 Ca -0.07 1.06 0.01 0.00 0.00 0.00 0.00 51.96 52.95 3m1u s ALA 298 Cb 0.12 -0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.69 3m1u s ALA 298 CO 0.82 -0.23 -0.06 0.00 0.00 0.00 0.00 175.76 176.29 3m1u s ALA 299 N -0.16 0.60 0.28 0.00 0.00 -0.87 -4.44 121.76 117.17 3m1u s ALA 299 Ca -0.03 -0.97 -0.30 0.00 0.00 0.00 0.00 51.96 50.65 3m1u s ALA 299 Cb -0.03 0.13 -0.11 0.00 0.00 0.00 0.00 23.12 23.10 3m1u s ALA 299 CO 0.02 -0.16 1.60 -1.14 0.00 0.00 0.00 175.76 176.08 3m1u s GLN 300 N -2.57 4.12 0.09 0.00 0.74 -1.26 -0.71 119.66 120.07 3m1u s GLN 300 Ca -0.02 2.57 -0.23 0.00 0.05 0.00 0.00 55.36 57.74 3m1u s GLN 300 Cb -0.03 -3.03 -0.07 0.00 1.10 0.00 0.00 33.01 30.99 3m1u s GLN 300 CO -0.03 -0.64 0.68 0.21 -0.55 0.00 0.00 175.29 174.97 3m1u s LYS 301 N -0.36 4.40 0.18 1.67 2.20 0.14 -3.75 119.74 124.23 3m1u s LYS 301 Ca 0.64 0.95 -0.11 0.00 -0.36 0.00 0.00 55.97 57.08 3m1u s LYS 301 Cb -0.48 -3.29 -0.07 0.00 -1.51 0.00 0.00 37.83 32.48 3m1u s LYS 301 CO 0.47 0.50 0.53 -1.25 -0.36 0.00 0.00 175.35 175.24 3m1u s PRO 302 N -0.75 3.86 0.32 4.03 0.04 -1.26 -4.73 135.00 136.50 3m1u s PRO 302 Ca 0.34 0.34 -0.29 0.00 0.04 0.00 0.00 61.00 61.43 3m1u s PRO 302 Cb -0.21 -2.79 -0.10 0.00 0.04 0.00 0.00 34.50 31.45 3m1u s PRO 302 CO 0.22 0.40 1.19 0.08 0.04 0.00 0.00 177.00 178.93 3m1u s VAL 303 N -1.64 3.13 0.36 -0.36 1.01 -0.22 -4.98 120.40 117.70 3m1u s VAL 303 Ca 0.42 1.12 -0.28 0.00 0.00 0.00 0.00 61.98 63.24 3m1u s VAL 303 Cb -0.13 -3.70 -0.11 0.00 0.00 0.00 0.00 36.38 32.44 3m1u s VAL 303 CO 0.20 0.25 1.51 -2.65 0.00 0.00 0.00 175.10 174.41 3m1u n PRO 304 N 0.90 2.69 -2.84 2.72 -0.02 -1.26 -4.46 135.00 132.72 3m1u n PRO 304 Ca -0.00 0.95 -0.43 0.00 -2.02 0.00 0.00 63.50 62.00 3m1u n PRO 304 Cb 0.44 -2.69 -0.04 0.00 -0.02 0.00 0.00 33.50 31.19 3m1u n PRO 304 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3m1u s LEU 305 N -1.81 4.37 0.11 2.45 2.96 -1.26 -4.77 118.68 120.73 3m1u s LEU 305 Ca 0.55 -1.06 0.03 0.00 -0.22 0.00 0.00 54.13 53.43 3m1u s LEU 305 Cb -0.48 -2.43 -0.04 0.00 0.50 0.00 0.00 46.19 43.75 3m1u s LEU 305 CO 0.61 -1.43 -0.08 0.42 -1.32 0.00 0.00 176.35 174.55 3m1u s THR 306 N 4.05 0.85 0.30 3.68 -4.23 -1.26 -1.13 115.64 117.90 3m1u s THR 306 Ca 0.24 -1.85 -0.01 0.00 -1.18 0.00 0.00 61.69 58.89 3m1u s THR 306 Cb -0.15 -1.59 0.23 0.00 1.34 0.00 0.00 72.50 72.33 3m1u s THR 306 CO 0.08 -0.75 1.93 -0.65 -0.54 0.00 0.00 174.62 174.70 3m1u h PRO 307 N 3.14 0.94 -0.50 3.99 0.11 -1.71 -2.91 132.00 135.07 3m1u h PRO 307 Ca -0.36 -0.10 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 3m1u h PRO 307 Cb 1.18 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.08 3m1u h PRO 307 CO 0.60 0.69 0.24 0.78 -0.21 0.00 0.00 178.00 180.11 3m1u h GLY 308 N 1.00 0.77 -1.66 -0.55 0.00 -0.87 0.10 103.07 101.86 3m1u h GLY 308 Ca 0.24 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 47.20 3m1u h GLY 308 CO -0.04 0.36 0.00 0.70 0.00 0.00 0.00 176.54 177.56 3m1u n ASN 309 N -4.61 0.72 0.00 0.19 3.02 -1.10 -2.07 115.26 111.41 3m1u n ASN 309 Ca 0.02 -0.62 0.00 0.00 -0.03 0.00 0.00 54.58 53.95 3m1u n ASN 309 Cb 0.11 -0.16 0.00 0.00 -0.61 0.00 0.00 39.78 39.13 3m1u n ASN 309 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3m1u n ALA 311 N 0.67 0.00 -0.23 5.41 0.00 0.35 -2.81 120.51 123.90 3m1u n ALA 311 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 3m1u n ALA 311 Cb 0.13 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.61 3m1u n ALA 311 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3m1u h GLU 312 N 0.00 1.10 -0.02 0.00 4.81 -1.68 0.71 114.58 119.51 3m1u h GLU 312 Ca 0.00 -0.33 -0.02 0.00 -0.13 0.00 0.00 59.36 58.89 3m1u h GLU 312 Cb 0.00 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.27 3m1u h GLU 312 CO 0.00 1.04 -0.05 -0.07 -0.73 0.00 0.00 179.01 179.20 3m1u h LEU 313 N 1.02 0.07 -1.14 1.64 3.38 -1.81 -3.25 115.31 115.22 3m1u h LEU 313 Ca 0.19 -0.61 0.07 0.00 0.09 0.00 0.00 57.88 57.62 3m1u h LEU 313 Cb 0.51 -0.02 -0.06 0.00 0.09 0.00 0.00 40.66 41.18 3m1u h LEU 313 CO 0.02 0.67 0.59 1.23 0.09 0.00 0.00 178.44 181.05 3m1u h GLY 314 N -0.52 1.34 2.00 0.83 0.00 -1.83 -1.64 103.07 103.24 3m1u h GLY 314 Ca -0.00 -0.42 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 3m1u h GLY 314 CO 0.01 0.29 -0.01 3.43 0.00 0.00 0.00 176.54 180.26 3m1u h ASN 315 N 1.03 0.00 0.00 0.19 2.35 -0.93 -3.48 115.58 114.74 3m1u h ASN 315 Ca 0.40 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 56.06 3m1u h ASN 315 Cb 0.22 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.57 3m1u h ASN 315 CO -0.15 0.01 0.54 0.54 -1.65 0.00 0.00 177.43 176.72 3m1u n ARG 316 N -4.41 0.70 -0.21 0.81 1.74 -0.62 -5.06 116.66 109.62 3m1u n ARG 316 Ca -0.03 -0.43 0.00 0.00 -0.77 0.00 0.00 57.85 56.62 3m1u n ARG 316 Cb 0.10 -1.76 0.00 0.00 -1.02 0.00 0.00 32.46 29.78 3m1u n ARG 316 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3m1u n GLY 319 N 3.04 0.00 3.75 -0.13 0.00 0.03 -4.89 105.19 106.98 3m1u n GLY 319 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 3m1u n GLY 319 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3m1u s GLN 320 N -0.42 4.32 0.46 1.61 -2.07 -1.26 -4.54 119.66 117.75 3m1u s GLN 320 Ca 0.00 2.23 -0.24 0.00 -1.82 0.00 0.00 55.36 55.53 3m1u s GLN 320 Cb 0.00 -3.12 -0.08 0.00 -1.09 0.00 0.00 33.01 28.72 3m1u s GLN 320 CO 0.00 -0.33 1.27 -2.30 -1.32 0.00 0.00 175.29 172.61 3m1u n PRO 321 N 2.01 1.82 -2.25 9.60 -0.02 -1.26 -1.71 135.00 143.18 3m1u n PRO 321 Ca 0.05 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.76 3m1u n PRO 321 Cb 0.41 -2.41 -0.03 0.00 -0.02 0.00 0.00 33.50 31.45 3m1u n PRO 321 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3m1u s TYR 322 N -1.24 3.30 -0.13 6.00 6.14 0.35 -3.82 117.35 127.95 3m1u s TYR 322 Ca 0.64 1.15 -0.01 0.00 0.64 0.00 0.00 57.07 59.49 3m1u s TYR 322 Cb -0.48 -3.58 0.04 0.00 0.42 0.00 0.00 41.96 38.35 3m1u s TYR 322 CO 0.56 -1.90 -0.03 0.20 0.64 0.00 0.00 175.55 175.02 3m1u s GLY 323 N 0.73 0.76 0.01 8.97 0.00 -0.16 -4.86 107.32 112.77 3m1u s GLY 323 Ca 0.60 -0.55 -0.33 0.00 0.00 0.00 0.00 44.72 44.43 3m1u s GLY 323 CO 0.33 1.03 1.82 1.87 0.00 0.00 0.00 173.10 178.15 3m1u n TRP 324 N 4.99 2.38 -2.26 1.90 -0.00 -1.26 -1.13 117.44 122.06 3m1u n TRP 324 Ca -0.10 -0.00 -0.15 0.00 -0.00 0.00 0.00 57.50 57.24 3m1u n TRP 324 Cb 0.49 -2.66 -0.02 0.00 -0.00 0.00 0.00 31.31 29.12 3m1u n TRP 324 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 3m1u n GLY 325 N 4.17 -0.17 2.09 5.87 0.00 -1.26 -1.80 105.19 114.09 3m1u n GLY 325 Ca 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.20 3m1u n GLY 325 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m1u n GLY 326 N -0.77 0.59 3.58 -0.02 0.00 -0.28 -0.64 105.19 107.64 3m1u n GLY 326 Ca -0.18 -0.87 -0.43 0.00 0.00 0.00 0.00 46.02 44.55 3m1u n GLY 326 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3m1u n LEU 327 N -0.30 1.84 -0.56 0.99 7.94 -0.74 -1.69 117.00 124.49 3m1u n LEU 327 Ca -0.03 1.09 -0.07 0.00 -1.11 0.00 0.00 56.01 55.89 3m1u n LEU 327 Cb 0.09 -1.29 -0.03 0.00 0.53 0.00 0.00 43.42 42.72 3m1u n LEU 327 CO 0.04 -1.64 -0.07 -1.22 -1.11 0.00 0.00 177.39 173.39 3m1u n TYR 328 N -0.19 0.00 -1.64 1.96 4.01 -1.26 -1.32 117.16 118.71 3m1u n TYR 328 Ca 0.10 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 57.67 3m1u n TYR 328 Cb 0.36 -2.05 -0.06 0.00 -0.31 0.00 0.00 39.34 37.28 3m1u n TYR 328 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 3m1u n GLU 329 N -1.24 -1.20 -0.00 -0.72 1.02 -0.68 -5.02 120.64 112.79 3m1u n GLU 329 Ca -0.07 1.04 0.00 0.00 -0.02 0.00 0.00 57.16 58.11 3m1u n GLU 329 Cb 0.43 -5.30 0.00 0.00 -0.02 0.00 0.00 31.44 26.56 3m1u n GLU 329 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3m1u n ASP 330 N -0.81 0.00 -4.11 1.62 8.00 -0.44 -5.06 116.55 115.74 3m1u n ASP 330 Ca -0.17 -0.26 -0.09 0.00 0.71 0.00 0.00 54.79 54.97 3m1u n ASP 330 Cb 0.57 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.57 3m1u n ASP 330 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3m1u s ARG 331 N -0.74 0.68 0.00 -1.24 0.52 -1.25 -4.38 118.95 112.54 3m1u s ARG 331 Ca 0.00 -1.18 0.00 0.00 -0.52 0.00 0.00 55.73 54.03 3m1u s ARG 331 Cb 0.00 -0.02 0.00 0.00 0.52 0.00 0.00 34.95 35.45 3m1u s ARG 331 CO 0.00 -0.05 0.00 -0.40 0.02 0.00 0.00 175.30 174.87 3m1u n ASP 332 N 0.28 1.53 -0.14 0.23 5.68 -1.21 -0.99 116.55 121.93 3m1u n ASP 332 Ca -0.15 -0.87 -0.08 0.00 -0.50 0.00 0.00 54.79 53.19 3m1u n ASP 332 Cb 0.60 0.00 0.01 0.00 -1.14 0.00 0.00 41.12 40.59 3m1u n ASP 332 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3m1u h SER 334 N 0.58 0.36 0.71 0.00 4.64 -1.85 -3.20 113.55 114.80 3m1u h SER 334 Ca 0.16 -0.46 -0.08 0.00 -0.47 0.00 0.00 61.79 60.94 3m1u h SER 334 Cb -0.05 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 61.91 3m1u h SER 334 CO -0.03 1.37 -0.37 0.77 -0.87 0.00 0.00 176.83 177.70 3m1u h SER 335 N 0.06 0.00 -0.12 4.97 4.64 -1.76 -1.27 113.55 120.07 3m1u h SER 335 Ca -0.19 0.00 0.03 0.00 -0.47 0.00 0.00 61.79 61.16 3m1u h SER 335 Cb 1.99 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 64.05 3m1u h SER 335 CO 0.17 0.37 -0.07 0.74 -0.87 0.00 0.00 176.83 177.17 3m1u h THR 336 N 0.00 0.78 -0.21 2.95 2.02 -1.34 -0.85 112.91 116.26 3m1u h THR 336 Ca -0.00 0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.06 3m1u h THR 336 Cb 0.82 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 68.01 3m1u h THR 336 CO 0.05 0.00 -0.34 -0.07 0.37 0.00 0.00 175.52 175.53 3m1u h LEU 337 N -0.07 0.65 -0.17 2.58 3.38 -1.47 -1.16 115.31 119.06 3m1u h LEU 337 Ca 0.07 -0.53 0.01 0.00 0.09 0.00 0.00 57.88 57.52 3m1u h LEU 337 Cb 0.17 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3m1u h LEU 337 CO -0.16 1.06 0.10 -0.09 0.09 0.00 0.00 178.44 179.44 3m1u h ARG 338 N 0.27 0.20 -0.28 1.13 2.43 -1.20 -1.78 114.38 115.15 3m1u h ARG 338 Ca 0.02 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 59.06 3m1u h ARG 338 Cb 0.93 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 3m1u h ARG 338 CO 0.08 0.13 -0.31 -0.44 -1.51 0.00 0.00 179.97 177.92 3m1u h ASP 339 N 0.21 0.62 -0.89 -3.80 3.32 -1.09 -1.75 116.42 113.03 3m1u h ASP 339 Ca 0.06 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 3m1u h ASP 339 Cb -0.01 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.33 3m1u h ASP 339 CO -0.03 0.89 0.52 0.25 -1.72 0.00 0.00 179.24 179.16 3m1u h LEU 340 N 0.51 1.09 0.00 1.55 5.85 -1.03 -3.07 115.31 120.21 3m1u h LEU 340 Ca 0.06 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.70 3m1u h LEU 340 Cb 0.79 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.55 3m1u h LEU 340 CO 0.06 0.85 -0.43 -0.26 -0.34 0.00 0.00 178.44 178.32 3m1u h PHE 341 N 1.24 0.00 -0.32 1.25 0.04 -1.05 -3.37 116.94 114.73 3m1u h PHE 341 Ca 0.32 0.00 0.03 0.00 2.80 0.00 0.00 57.97 61.12 3m1u h PHE 341 Cb -0.02 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.10 3m1u h PHE 341 CO 0.01 0.00 0.14 1.15 -0.60 0.00 0.00 178.31 179.01 3m1u h THR 342 N 0.00 0.96 -0.02 -1.55 2.02 -1.22 -2.12 112.91 110.97 3m1u h THR 342 Ca 0.00 -0.10 0.01 0.00 0.77 0.00 0.00 66.41 67.08 3m1u h THR 342 Cb 0.80 0.63 -0.00 0.00 -1.74 0.00 0.00 68.15 67.84 3m1u h THR 342 CO 0.00 0.05 0.06 -0.65 0.37 0.00 0.00 175.52 175.35 3m1u h PRO 343 N 0.30 0.00 -0.01 6.66 0.11 -1.73 -0.02 132.00 137.31 3m1u h PRO 343 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 3m1u h PRO 343 Cb 0.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.18 3m1u h PRO 343 CO -0.11 0.00 -0.22 1.19 -0.21 0.00 0.00 178.00 178.65 3m1u n PHE 344 N -3.33 0.00 -1.06 0.65 3.72 -0.81 -1.06 117.46 115.56 3m1u n PHE 344 Ca -0.02 0.00 -0.02 0.00 -0.05 0.00 0.00 57.45 57.36 3m1u n PHE 344 Cb 0.14 -0.08 -0.01 0.00 -0.94 0.00 0.00 39.48 38.59 3m1u n PHE 344 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3m1u n GLY 345 N 1.31 0.55 3.48 1.37 0.00 -0.02 -4.72 105.19 107.17 3m1u n GLY 345 Ca 0.13 -0.73 -0.43 0.00 0.00 0.00 0.00 46.02 44.99 3m1u n GLY 345 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m1u s LEU 346 N -0.47 4.87 0.00 0.99 1.02 -1.11 -2.74 118.68 121.24 3m1u s LEU 346 Ca 0.00 -0.70 -0.30 0.00 0.02 0.00 0.00 54.13 53.15 3m1u s LEU 346 Cb 0.00 -2.43 -0.05 0.00 0.02 0.00 0.00 46.19 43.73 3m1u s LEU 346 CO 0.00 -0.65 1.24 0.86 0.02 0.00 0.00 176.35 177.82 3m1u s TRP 347 N 2.26 3.23 0.02 0.29 -0.11 -1.26 -4.27 118.94 119.10 3m1u s TRP 347 Ca 0.13 1.18 0.09 0.00 1.22 0.00 0.00 56.10 58.71 3m1u s TRP 347 Cb -0.17 -3.47 -0.02 0.00 -1.50 0.00 0.00 33.47 28.31 3m1u s TRP 347 CO 0.14 -1.51 -0.26 -0.51 -4.62 0.00 0.00 176.95 170.19 3m1u s LEU 348 N 1.78 2.12 1.14 5.86 1.43 -1.26 -5.06 118.68 124.68 3m1u s LEU 348 Ca 0.58 -0.53 -0.15 0.00 -1.03 0.00 0.00 54.13 53.01 3m1u s LEU 348 Cb -0.28 -1.27 0.26 0.00 0.03 0.00 0.00 46.19 44.93 3m1u s LEU 348 CO 0.26 0.27 1.06 -2.16 0.23 0.00 0.00 176.35 176.01 3m1u s PRO 349 N -0.96 -0.72 0.08 1.29 0.04 -1.26 -4.89 135.00 128.58 3m1u s PRO 349 Ca 0.11 0.44 -0.12 0.00 0.04 0.00 0.00 61.00 61.47 3m1u s PRO 349 Cb -0.10 -1.61 -0.22 0.00 0.04 0.00 0.00 34.50 32.62 3m1u s PRO 349 CO 0.01 -3.49 1.20 -0.09 0.04 0.00 0.00 177.00 174.67 3m1u h ARG 350 N -2.44 0.63 -6.21 4.56 9.65 -1.94 -3.44 114.38 115.20 3m1u h ARG 350 Ca -0.54 -0.71 -0.58 0.00 -1.10 0.00 0.00 59.98 57.05 3m1u h ARG 350 Cb 1.33 0.21 -0.04 0.00 -1.39 0.00 0.00 29.97 30.08 3m1u h ARG 350 CO 0.49 1.29 -0.14 1.21 2.80 0.00 0.00 179.97 185.62 3m1u s ASN 351 N -7.28 6.80 0.21 -3.80 2.47 -1.26 -4.44 114.94 107.64 3m1u s ASN 351 Ca -0.09 1.01 -0.09 0.00 0.42 0.00 0.00 52.86 54.11 3m1u s ASN 351 Cb 0.07 -2.26 0.29 0.00 -1.45 0.00 0.00 41.25 37.90 3m1u s ASN 351 CO 0.91 0.17 1.74 0.77 -3.72 0.00 0.00 177.10 176.98 3m1u h SER 352 N 3.88 0.23 -0.47 -4.21 4.64 -1.94 -1.18 113.55 114.50 3m1u h SER 352 Ca -0.49 0.08 -0.07 0.00 -0.47 0.00 0.00 61.79 60.84 3m1u h SER 352 Cb 1.20 0.06 -0.02 0.00 -0.31 0.00 0.00 62.40 63.32 3m1u h SER 352 CO 0.65 0.13 0.05 0.00 -0.87 0.00 0.00 176.83 176.79 3m1u h ALA 353 N 1.42 1.08 -0.57 5.18 0.00 -1.95 -1.08 119.26 123.35 3m1u h ALA 353 Ca 0.31 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.87 3m1u h ALA 353 Cb 0.39 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3m1u h ALA 353 CO -0.31 0.59 -0.02 0.77 0.00 0.00 0.00 179.25 180.28 3m1u h SER 354 N 0.82 0.98 -0.47 0.00 0.02 -1.80 -3.10 113.55 110.00 3m1u h SER 354 Ca 0.16 -0.28 -0.06 0.00 -0.84 0.00 0.00 61.79 60.77 3m1u h SER 354 Cb 0.42 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.67 3m1u h SER 354 CO 0.01 1.05 0.09 1.56 -1.14 0.00 0.00 176.83 178.40 3m1u h GLN 355 N 0.92 0.83 -0.03 3.45 4.20 -0.66 -1.31 115.11 122.51 3m1u h GLN 355 Ca 0.16 -0.19 0.01 0.00 0.06 0.00 0.00 58.65 58.69 3m1u h GLN 355 Cb 0.56 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 3m1u h GLN 355 CO 0.03 0.77 0.03 0.00 -0.67 0.00 0.00 178.83 178.99 3m1u h ALA 356 N 1.31 1.61 0.00 3.87 0.00 -1.14 -2.21 119.26 122.70 3m1u h ALA 356 Ca 0.17 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 3m1u h ALA 356 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3m1u h ALA 356 CO 0.00 -0.04 -0.46 1.63 0.00 0.00 0.00 179.25 180.38 3m1u n LYS 357 N -3.91 0.19 0.18 0.00 4.76 -0.50 -4.58 118.16 114.30 3m1u n LYS 357 Ca -0.02 0.07 0.06 0.00 -2.87 0.00 0.00 58.31 55.55 3m1u n LYS 357 Cb 0.12 -1.64 0.15 0.00 -1.84 0.00 0.00 35.03 31.82 3m1u n LYS 357 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3m1u h ALA 358 N 2.67 0.82 -3.00 7.82 0.00 -1.28 -3.47 119.26 122.82 3m1u h ALA 358 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3m1u h ALA 358 Cb 0.66 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3m1u h ALA 358 CO 0.00 0.40 0.00 0.41 0.00 0.00 0.00 179.25 180.06 3m1u n GLY 359 N 0.98 4.03 3.63 0.00 0.00 -1.26 -3.91 105.19 108.66 3m1u n GLY 359 Ca 0.02 -1.88 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 3m1u n GLY 359 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3m1u s ARG 360 N 2.66 4.05 0.27 1.61 3.52 0.21 -4.77 118.95 126.49 3m1u s ARG 360 Ca 0.00 0.87 -0.23 0.00 -0.13 0.00 0.00 55.73 56.24 3m1u s ARG 360 Cb 0.00 -3.71 -0.09 0.00 -1.56 0.00 0.00 34.95 29.59 3m1u s ARG 360 CO 0.00 -0.73 0.83 -0.47 -0.81 0.00 0.00 175.30 174.12 3m1u s TYR 361 N 3.21 3.67 -0.17 5.12 5.04 -1.26 -0.01 117.35 132.94 3m1u s TYR 361 Ca 0.38 1.58 -0.01 0.00 -2.44 0.00 0.00 57.07 56.58 3m1u s TYR 361 Cb -0.14 -2.77 0.05 0.00 0.35 0.00 0.00 41.96 39.45 3m1u s TYR 361 CO 0.12 0.28 -0.02 0.08 -1.34 0.00 0.00 175.55 174.67 3m1u s VAL 362 N -1.57 0.85 0.12 3.14 1.01 -1.26 -4.97 120.40 117.72 3m1u s VAL 362 Ca 0.46 -0.56 -0.30 0.00 0.00 0.00 0.00 61.98 61.58 3m1u s VAL 362 Cb -0.18 -1.14 -0.06 0.00 0.00 0.00 0.00 36.38 34.99 3m1u s VAL 362 CO 0.22 0.01 1.12 -0.62 0.00 0.00 0.00 175.10 175.84 3m1u s ASP 363 N 1.73 7.21 -0.00 3.32 2.15 -1.26 -4.36 116.67 125.46 3m1u s ASP 363 Ca 0.00 2.03 0.00 0.00 0.43 0.00 0.00 52.55 55.01 3m1u s ASP 363 Cb -0.16 -2.59 0.01 0.00 -0.30 0.00 0.00 42.92 39.88 3m1u s ASP 363 CO -0.07 -0.31 0.73 2.30 -0.17 0.00 0.00 175.17 177.64 3m1u n ILE 364 N 3.05 0.44 -0.29 4.11 -5.35 -0.39 -4.96 119.36 115.97 3m1u n ILE 364 Ca 0.05 -0.44 0.06 0.00 -0.27 0.00 0.00 62.75 62.15 3m1u n ILE 364 Cb 0.47 0.76 0.27 0.00 -1.74 0.00 0.00 39.64 39.40 3m1u n ILE 364 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3m1u h ALA 365 N 0.00 1.58 -0.01 -1.28 0.00 -1.81 -2.40 119.26 115.35 3m1u h ALA 365 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3m1u h ALA 365 Cb 0.81 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3m1u h ALA 365 CO 0.00 0.25 -0.21 1.63 0.00 0.00 0.00 179.25 180.92 3m1u n LYS 366 N -4.51 1.20 -2.40 0.00 4.01 -1.26 -4.90 118.16 110.30 3m1u n LYS 366 Ca 0.14 -0.78 -0.36 0.00 -0.51 0.00 0.00 58.31 56.80 3m1u n LYS 366 Cb 0.26 -1.48 -0.02 0.00 -0.51 0.00 0.00 35.03 33.27 3m1u n LYS 366 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 3m1u s LEU 367 N -2.34 3.99 0.61 -0.35 1.43 -0.90 -5.02 118.68 116.09 3m1u s LEU 367 Ca 0.27 2.14 -0.18 0.00 -1.03 0.00 0.00 54.13 55.33 3m1u s LEU 367 Cb 0.20 -4.32 -0.05 0.00 0.03 0.00 0.00 46.19 42.04 3m1u s LEU 367 CO 0.47 -0.79 0.88 0.47 0.23 0.00 0.00 176.35 177.60 3m1u n ASP 368 N -0.54 0.38 -0.14 2.29 9.92 -1.26 -4.69 116.55 122.52 3m1u n ASP 368 Ca 0.07 0.78 -0.04 0.00 -0.53 0.00 0.00 54.79 55.07 3m1u n ASP 368 Cb 0.50 -1.35 0.04 0.00 -0.64 0.00 0.00 41.12 39.67 3m1u n ASP 368 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3m1u h ALA 369 N 0.37 0.52 -0.11 2.24 0.00 -1.94 0.17 119.26 120.51 3m1u h ALA 369 Ca -0.48 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.40 3m1u h ALA 369 Cb 1.37 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.19 3m1u h ALA 369 CO 0.50 -0.24 -0.31 0.38 0.00 0.00 0.00 179.25 179.57 3m1u h ASP 370 N 0.31 0.22 -0.01 0.00 2.03 -1.98 -1.31 116.42 115.68 3m1u h ASP 370 Ca 0.21 -0.07 -0.11 0.00 -0.73 0.00 0.00 57.03 56.33 3m1u h ASP 370 Cb 0.21 -0.06 -0.01 0.00 -0.83 0.00 0.00 39.33 38.64 3m1u h ASP 370 CO -0.22 0.52 -0.33 0.44 -1.03 0.00 0.00 179.24 178.63 3m1u h ASP 371 N 0.19 0.50 -0.03 4.15 3.32 -1.57 -0.86 116.42 122.12 3m1u h ASP 371 Ca 0.03 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 56.88 3m1u h ASP 371 Cb 0.65 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 3m1u h ASP 371 CO 0.05 0.80 0.01 0.11 -1.72 0.00 0.00 179.24 178.48 3m1u h LYS 372 N 0.41 0.04 -0.62 3.56 1.57 0.34 -1.02 116.57 120.86 3m1u h LYS 372 Ca 0.05 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 3m1u h LYS 372 Cb 0.78 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 33.04 3m1u h LYS 372 CO 0.06 0.19 0.37 1.49 -0.57 0.00 0.00 179.45 180.99 3m1u h GLU 373 N -0.12 0.70 -0.94 3.15 4.57 -1.21 -0.65 114.58 120.06 3m1u h GLU 373 Ca 0.01 -0.04 0.03 0.00 -1.18 0.00 0.00 59.36 58.18 3m1u h GLU 373 Cb 0.16 -0.16 -0.05 0.00 -0.16 0.00 0.00 28.75 28.54 3m1u h GLU 373 CO -0.00 0.46 0.62 0.00 -1.18 0.00 0.00 179.01 178.91 3m1u h ALA 374 N 1.28 1.24 -0.54 2.92 0.00 -0.99 -0.90 119.26 122.27 3m1u h ALA 374 Ca 0.26 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 55.00 3m1u h ALA 374 Cb 0.06 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 3m1u h ALA 374 CO -0.12 0.51 -0.12 -0.09 0.00 0.00 0.00 179.25 179.43 3m1u h ARG 375 N 1.21 1.04 -0.48 0.00 9.65 -0.66 0.87 114.38 126.00 3m1u h ARG 375 Ca 0.37 -0.39 -0.01 0.00 -1.10 0.00 0.00 59.98 58.84 3m1u h ARG 375 Cb -0.03 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 28.47 3m1u h ARG 375 CO -0.11 1.08 0.25 0.82 2.80 0.00 0.00 179.97 184.81 3m1u h ILE 376 N 0.92 1.18 -0.67 1.20 2.04 -0.77 -0.25 117.51 121.15 3m1u h ILE 376 Ca 0.14 -0.48 -0.04 0.00 1.00 0.00 0.00 64.86 65.48 3m1u h ILE 376 Cb 0.70 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 3m1u h ILE 376 CO 0.05 0.19 0.28 0.58 0.00 0.00 0.00 178.15 179.25 3m1u h VAL 377 N 0.64 1.24 -0.04 1.67 2.07 -0.98 0.26 116.25 121.11 3m1u h VAL 377 Ca 0.17 -0.74 -0.21 0.00 0.82 0.00 0.00 66.70 66.74 3m1u h VAL 377 Cb 0.08 0.47 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 3m1u h VAL 377 CO -0.02 0.29 -0.85 0.00 0.02 0.00 0.00 177.57 177.01 3m1u h ALA 378 N 1.12 0.44 0.00 1.67 0.00 -0.55 -3.38 119.26 118.56 3m1u h ALA 378 Ca 0.22 -0.66 0.00 0.00 0.00 0.00 0.00 54.91 54.47 3m1u h ALA 378 Cb 0.19 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3m1u h ALA 378 CO -0.02 0.79 -1.07 0.39 0.00 0.00 0.00 179.25 179.34 3m1u n GLU 379 N -3.79 1.04 -2.10 0.00 1.02 -0.13 -5.02 120.64 111.66 3m1u n GLU 379 Ca -0.06 -0.04 -0.39 0.00 -0.02 0.00 0.00 57.16 56.65 3m1u n GLU 379 Cb 0.78 -1.06 -0.00 0.00 -0.02 0.00 0.00 31.44 31.14 3m1u n GLU 379 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3m1u s GLY 380 N -2.41 2.89 -0.34 0.62 0.00 0.92 -5.00 107.32 104.00 3m1u s GLY 380 Ca -0.01 1.16 -0.07 0.00 0.00 0.00 0.00 44.72 45.80 3m1u s GLY 380 CO 0.22 1.71 0.12 0.14 0.00 0.00 0.00 173.10 175.29 3m1u s VAL 381 N -1.32 3.92 0.20 1.40 1.01 -1.26 -4.92 120.40 119.42 3m1u s VAL 381 Ca 0.59 -1.07 -0.32 0.00 0.00 0.00 0.00 61.98 61.18 3m1u s VAL 381 Cb -0.36 -3.20 -0.14 0.00 0.00 0.00 0.00 36.38 32.68 3m1u s VAL 381 CO 0.45 -0.18 1.34 -2.65 0.00 0.00 0.00 175.10 174.07 3m1u n PRO 382 N 4.84 1.72 -2.67 2.72 -0.02 -1.26 -2.57 135.00 137.76 3m1u n PRO 382 Ca -0.12 0.61 -0.08 0.00 -2.02 0.00 0.00 63.50 61.89 3m1u n PRO 382 Cb 0.45 -2.23 0.02 0.00 -0.02 0.00 0.00 33.50 31.72 3m1u n PRO 382 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 3m1u n PHE 383 N 1.91 -0.81 -1.57 6.00 3.01 -0.16 -4.95 117.46 120.89 3m1u n PHE 383 Ca 0.13 0.25 0.00 0.00 1.01 0.00 0.00 57.45 58.84 3m1u n PHE 383 Cb 0.28 -2.28 0.00 0.00 -0.01 0.00 0.00 39.48 37.47 3m1u n PHE 383 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 3m1u n THR 385 N -3.54 -1.35 -3.86 4.37 -1.04 -1.06 -5.01 114.28 102.78 3m1u n THR 385 Ca -0.02 0.63 -0.37 0.00 -2.04 0.00 0.00 64.05 62.25 3m1u n THR 385 Cb 0.53 -0.81 -0.06 0.00 -1.82 0.00 0.00 70.33 68.17 3m1u n THR 385 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3m1u s LEU 386 N -1.37 4.37 -0.17 -4.42 1.43 0.32 -1.09 118.68 117.74 3m1u s LEU 386 Ca 0.00 0.44 -0.04 0.00 -1.03 0.00 0.00 54.13 53.51 3m1u s LEU 386 Cb 0.00 -2.07 -0.02 0.00 0.03 0.00 0.00 46.19 44.12 3m1u s LEU 386 CO 0.00 0.38 -0.04 -0.76 0.23 0.00 0.00 176.35 176.17 3m1u s LEU 387 N -0.87 3.14 -0.07 1.79 1.43 -0.20 -0.56 118.68 123.34 3m1u s LEU 387 Ca 0.14 -0.21 0.03 0.00 -1.03 0.00 0.00 54.13 53.07 3m1u s LEU 387 Cb -0.12 -1.77 0.00 0.00 0.03 0.00 0.00 46.19 44.34 3m1u s LEU 387 CO 0.03 0.11 -0.18 0.86 0.23 0.00 0.00 176.35 177.41 3m1u s TRP 388 N 0.71 1.93 0.23 0.29 -0.00 -0.46 -1.25 118.94 120.39 3m1u s TRP 388 Ca -0.02 -0.72 0.06 0.00 -0.00 0.00 0.00 56.10 55.42 3m1u s TRP 388 Cb -0.14 -1.33 -0.05 0.00 -0.00 0.00 0.00 33.47 31.94 3m1u s TRP 388 CO 0.02 -0.31 -0.08 -0.48 -0.00 0.00 0.00 176.95 176.11 3m1u s LEU 389 N 0.41 2.45 0.06 5.86 2.34 -0.63 -0.69 118.68 128.48 3m1u s LEU 389 Ca -0.14 -1.13 -0.30 0.00 0.06 0.00 0.00 54.13 52.62 3m1u s LEU 389 Cb -0.16 -0.54 -0.09 0.00 -0.56 0.00 0.00 46.19 44.84 3m1u s LEU 389 CO 0.05 -0.33 1.88 -0.13 -1.06 0.00 0.00 176.35 176.77 3m1u s ARG 390 N -3.73 4.15 0.00 1.48 3.00 -1.26 -1.61 118.95 120.97 3m1u s ARG 390 Ca 0.26 2.56 0.00 0.00 0.00 0.00 0.00 55.73 58.55 3m1u s ARG 390 Cb 0.03 -3.93 0.00 0.00 0.00 0.00 0.00 34.95 31.04 3m1u s ARG 390 CO 0.08 -0.90 0.00 0.41 0.00 0.00 0.00 175.30 174.90 3m1u n GLY 391 N 4.38 0.80 3.40 -3.53 0.00 -1.26 -5.03 105.19 103.95 3m1u n GLY 391 Ca 0.19 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.07 3m1u n GLY 391 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3m1u s HIS 392 N -3.07 -0.51 0.02 1.61 5.04 -0.63 -5.03 115.29 112.72 3m1u s HIS 392 Ca 0.00 1.15 0.00 0.00 -1.54 0.00 0.00 55.06 54.67 3m1u s HIS 392 Cb 0.00 0.21 -0.02 0.00 0.04 0.00 0.00 32.58 32.81 3m1u s HIS 392 CO 0.00 -0.34 -0.03 -1.50 -2.34 0.00 0.00 174.74 170.53 3m1u s ILE 393 N -0.23 0.11 0.08 0.89 2.07 -1.26 -1.61 121.20 121.26 3m1u s ILE 393 Ca -0.04 -0.71 -0.02 0.00 -1.41 0.00 0.00 60.65 58.47 3m1u s ILE 393 Cb -0.03 -0.22 -0.03 0.00 0.13 0.00 0.00 42.46 42.30 3m1u s ILE 393 CO 0.03 -0.37 0.03 0.42 -1.91 0.00 0.00 174.94 173.14 3m1u s THR 394 N -1.11 0.17 -0.24 4.00 -4.23 -0.38 -4.74 115.64 109.10 3m1u s THR 394 Ca -0.12 -1.75 -0.09 0.00 -1.18 0.00 0.00 61.69 58.55 3m1u s THR 394 Cb -0.08 -1.67 -0.04 0.00 1.34 0.00 0.00 72.50 72.05 3m1u s THR 394 CO -0.01 -0.77 0.12 -0.22 -0.54 0.00 0.00 174.62 173.20 3m1u s LEU 395 N -2.95 3.79 0.07 4.79 2.96 0.02 -1.04 118.68 126.32 3m1u s LEU 395 Ca 0.12 -0.04 -0.30 0.00 -0.22 0.00 0.00 54.13 53.70 3m1u s LEU 395 Cb 0.07 -2.02 -0.05 0.00 0.50 0.00 0.00 46.19 44.70 3m1u s LEU 395 CO -0.06 0.03 1.08 -0.47 -1.32 0.00 0.00 176.35 175.60 3m1u s TYR 396 N 1.28 3.59 -0.50 5.38 5.04 -0.25 -0.23 117.35 131.65 3m1u s TYR 396 Ca 0.06 1.55 0.10 0.00 -2.44 0.00 0.00 57.07 56.34 3m1u s TYR 396 Cb -0.14 -3.25 -0.11 0.00 0.35 0.00 0.00 41.96 38.81 3m1u s TYR 396 CO 0.05 -0.55 0.44 1.28 -1.34 0.00 0.00 175.55 175.44 3m1u n LEU 397 N 3.47 0.51 0.00 6.97 4.77 0.30 -0.99 117.00 132.03 3m1u n LEU 397 Ca 0.06 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 3m1u n LEU 397 Cb 0.48 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.57 3m1u n LEU 397 CO 0.53 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.33 3m1u n GLY 398 N 1.23 0.01 3.77 -0.72 0.00 -1.25 -4.46 105.19 103.77 3m1u n GLY 398 Ca 0.02 -2.28 -0.39 0.00 0.00 0.00 0.00 46.02 43.36 3m1u n GLY 398 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3m1u s LEU 399 N 0.00 4.52 -0.14 0.99 1.43 -1.26 -1.10 118.68 123.12 3m1u s LEU 399 Ca 0.00 1.50 -0.01 0.00 -1.03 0.00 0.00 54.13 54.59 3m1u s LEU 399 Cb 0.00 -3.20 0.03 0.00 0.03 0.00 0.00 46.19 43.05 3m1u s LEU 399 CO 0.00 0.14 -0.06 -2.28 0.23 0.00 0.00 176.35 174.38 3m1u s HIS 400 N -0.66 1.53 -1.54 0.29 2.46 0.12 -4.79 115.29 112.70 3m1u s HIS 400 Ca 0.36 -0.88 -0.08 0.00 0.47 0.00 0.00 55.06 54.93 3m1u s HIS 400 Cb -0.21 -1.24 0.06 0.00 -0.13 0.00 0.00 32.58 31.06 3m1u s HIS 400 CO 0.24 -0.56 0.54 0.39 -2.47 0.00 0.00 174.74 172.88 3m1u n GLU 401 N 4.93 -3.11 -0.70 2.88 1.02 -1.26 -1.69 120.64 122.71 3m1u n GLU 401 Ca -0.12 0.37 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 3m1u n GLU 401 Cb 0.49 -4.70 0.00 0.00 -0.02 0.00 0.00 31.44 27.21 3m1u n GLU 401 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3m1u n GLY 402 N -1.80 1.00 3.33 0.62 0.00 -1.26 -5.03 105.19 102.05 3m1u n GLY 402 Ca -0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 3m1u n GLY 402 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3m1u s GLN 403 N -0.23 1.73 0.24 1.61 -0.21 -0.68 -5.08 119.66 117.04 3m1u s GLN 403 Ca 0.00 -1.09 -0.30 0.00 0.02 0.00 0.00 55.36 53.99 3m1u s GLN 403 Cb 0.00 -1.90 -0.10 0.00 1.00 0.00 0.00 33.01 32.00 3m1u s GLN 403 CO 0.00 0.49 1.51 0.00 -2.12 0.00 0.00 175.29 175.18 3m1u s ALA 404 N -0.81 3.70 0.50 6.09 0.00 -1.26 -0.70 121.76 129.28 3m1u s ALA 404 Ca 0.11 1.40 0.05 0.00 0.00 0.00 0.00 51.96 53.52 3m1u s ALA 404 Cb -0.10 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.43 3m1u s ALA 404 CO 0.02 -0.81 0.28 0.00 0.00 0.00 0.00 175.76 175.25 3m1u s ALA 405 N 0.32 4.15 -0.09 0.00 0.00 -0.26 -3.80 121.76 122.08 3m1u s ALA 405 Ca 0.63 -1.34 -0.05 0.00 0.00 0.00 0.00 51.96 51.20 3m1u s ALA 405 Cb -0.44 -0.53 0.04 0.00 0.00 0.00 0.00 23.12 22.19 3m1u s ALA 405 CO 0.41 -0.29 0.21 0.12 0.00 0.00 0.00 175.76 176.21 3m1u s PHE 407 N -2.73 -0.26 -0.02 0.00 5.36 0.68 -0.54 117.98 120.46 3m1u s PHE 407 Ca 0.31 0.66 -0.28 0.00 -0.96 0.00 0.00 56.93 56.66 3m1u s PHE 407 Cb -0.00 0.02 0.10 0.00 -0.34 0.00 0.00 43.02 42.79 3m1u s PHE 407 CO 0.19 -0.19 0.83 -3.38 -1.46 0.00 0.00 175.22 171.20 3m1u s HIS 408 N 1.03 -0.44 0.03 10.12 -3.43 -0.47 -0.80 115.29 121.33 3m1u s HIS 408 Ca -0.08 0.50 0.03 0.00 -0.80 0.00 0.00 55.06 54.72 3m1u s HIS 408 Cb -0.09 0.50 -0.04 0.00 -1.43 0.00 0.00 32.58 31.52 3m1u s HIS 408 CO -0.06 -0.56 -0.01 1.21 -2.00 0.00 0.00 174.74 173.32 3m1u s ASN 409 N -1.95 5.00 0.00 7.38 3.84 -1.26 -0.86 114.94 127.08 3m1u s ASN 409 Ca -0.00 -0.09 0.00 0.00 0.21 0.00 0.00 52.86 52.97 3m1u s ASN 409 Cb -0.01 -1.24 0.00 0.00 -0.55 0.00 0.00 41.25 39.45 3m1u s ASN 409 CO -0.04 0.24 0.00 1.87 -2.79 0.00 0.00 177.10 176.39 3m1u n TRP 411 N 1.12 0.00 -4.12 0.43 -0.00 -1.26 -3.06 117.44 110.55 3m1u n TRP 411 Ca -0.13 0.00 -0.10 0.00 -0.00 0.00 0.00 57.50 57.27 3m1u n TRP 411 Cb 0.52 0.00 -0.09 0.00 -0.00 0.00 0.00 31.31 31.74 3m1u n TRP 411 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 177.69 177.89 3m1u s GLY 412 N -0.87 0.92 -0.10 5.87 0.00 -1.26 -0.70 107.32 111.18 3m1u s GLY 412 Ca 0.00 -1.38 -0.23 0.00 0.00 0.00 0.00 44.72 43.12 3m1u s GLY 412 CO 0.00 -1.27 0.67 -0.42 0.00 0.00 0.00 173.10 172.08 3m1u s ILE 413 N -4.04 5.05 0.06 0.90 -1.09 -0.06 -4.83 121.20 117.18 3m1u s ILE 413 Ca 0.24 1.36 -0.31 0.00 -2.23 0.00 0.00 60.65 59.71 3m1u s ILE 413 Cb 0.07 -4.01 -0.07 0.00 -1.58 0.00 0.00 42.46 36.87 3m1u s ILE 413 CO 0.02 0.22 1.43 -0.13 -1.23 0.00 0.00 174.94 175.25 3m1u s ARG 414 N 1.07 4.29 0.12 2.79 3.00 -1.26 -0.68 118.95 128.27 3m1u s ARG 414 Ca 0.35 2.06 0.03 0.00 0.00 0.00 0.00 55.73 58.16 3m1u s ARG 414 Cb -0.17 -3.44 -0.04 0.00 0.00 0.00 0.00 34.95 31.30 3m1u s ARG 414 CO 0.15 -0.54 -0.08 0.95 0.00 0.00 0.00 175.30 175.79 3m1u s THR 415 N 1.88 0.88 -0.05 0.02 -4.23 -0.68 -1.09 115.64 112.37 3m1u s THR 415 Ca 0.65 -1.99 0.01 0.00 -1.18 0.00 0.00 61.69 59.19 3m1u s THR 415 Cb -0.35 -1.77 0.02 0.00 1.34 0.00 0.00 72.50 71.74 3m1u s THR 415 CO 0.29 -0.81 -0.06 -1.00 -0.54 0.00 0.00 174.62 172.50 3m1u s HIS 416 N -3.51 0.86 -0.02 3.99 3.76 -0.58 0.18 115.29 119.96 3m1u s HIS 416 Ca 0.14 -0.26 -0.02 0.00 -0.15 0.00 0.00 55.06 54.78 3m1u s HIS 416 Cb 0.04 -0.72 0.01 0.00 1.11 0.00 0.00 32.58 33.02 3m1u s HIS 416 CO -0.02 -0.20 0.06 1.03 -0.85 0.00 0.00 174.74 174.76 3m1u s ARG 417 N 0.82 0.07 -1.61 1.40 0.52 -0.42 -4.43 118.95 115.31 3m1u s ARG 417 Ca -0.12 0.07 0.00 0.00 -0.52 0.00 0.00 55.73 55.16 3m1u s ARG 417 Cb -0.14 0.04 0.00 0.00 0.52 0.00 0.00 34.95 35.36 3m1u s ARG 417 CO 0.01 -0.01 0.00 0.41 0.02 0.00 0.00 175.30 175.73 3m1u n GLY 418 N 3.02 0.79 2.01 -3.53 0.00 -1.26 -0.53 105.19 105.68 3m1u n GLY 418 Ca -0.12 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.90 3m1u n GLY 418 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3m1u n GLY 419 N -0.53 0.48 3.19 -0.02 0.00 -1.26 -5.04 105.19 102.01 3m1u n GLY 419 Ca -0.17 -0.18 -0.29 0.00 0.00 0.00 0.00 46.02 45.37 3m1u n GLY 419 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m1u s VAL 420 N -1.99 1.79 0.26 1.61 1.01 0.30 -5.12 120.40 118.26 3m1u s VAL 420 Ca 0.00 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 60.79 3m1u s VAL 420 Cb 0.00 -1.54 -0.10 0.00 0.00 0.00 0.00 36.38 34.74 3m1u s VAL 420 CO 0.00 0.50 1.39 -0.70 0.00 0.00 0.00 175.10 176.29 3m1u s GLU 421 N 0.14 4.31 0.35 2.72 2.12 -1.26 -1.30 118.70 125.77 3m1u s GLU 421 Ca -0.10 2.24 0.07 0.00 0.36 0.00 0.00 54.97 57.55 3m1u s GLU 421 Cb -0.15 -3.11 -0.03 0.00 0.26 0.00 0.00 34.13 31.10 3m1u s GLU 421 CO 0.05 -0.34 0.25 0.41 -0.54 0.00 0.00 175.26 175.09 3m1u n GLY 422 N 1.89 2.98 2.89 -1.50 0.00 0.13 -4.51 105.19 107.07 3m1u n GLY 422 Ca 0.05 -1.94 -0.20 0.00 0.00 0.00 0.00 46.02 43.93 3m1u n GLY 422 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3m1u s ARG 423 N -3.40 0.80 -0.51 1.61 1.81 -1.26 -1.68 118.95 116.32 3m1u s ARG 423 Ca 0.36 -0.10 -0.19 0.00 -1.72 0.00 0.00 55.73 54.07 3m1u s ARG 423 Cb 0.02 -0.81 0.06 0.00 -0.45 0.00 0.00 34.95 33.77 3m1u s ARG 423 CO 0.25 -0.07 0.65 -0.47 -0.68 0.00 0.00 175.30 174.97 3m1u s TYR 424 N 0.88 3.03 -0.13 -0.53 6.14 0.14 -4.87 117.35 122.01 3m1u s TYR 424 Ca -0.12 -0.54 -0.20 0.00 0.64 0.00 0.00 57.07 56.86 3m1u s TYR 424 Cb -0.14 -3.59 -0.04 0.00 0.42 0.00 0.00 41.96 38.61 3m1u s TYR 424 CO 0.00 -1.06 0.56 0.08 0.64 0.00 0.00 175.55 175.76 3m1u s VAL 425 N 2.70 5.12 -0.26 3.14 1.01 -1.26 -0.88 120.40 129.97 3m1u s VAL 425 Ca 0.16 1.09 -0.08 0.00 0.00 0.00 0.00 61.98 63.15 3m1u s VAL 425 Cb -0.19 -3.89 -0.15 0.00 0.00 0.00 0.00 36.38 32.14 3m1u s VAL 425 CO 0.12 0.25 -0.21 0.18 0.00 0.00 0.00 175.10 175.44 3m1u n LEU 426 N 4.09 2.39 -2.45 3.92 4.77 0.12 -3.94 117.00 125.90 3m1u n LEU 426 Ca -0.05 0.16 -0.19 0.00 -0.03 0.00 0.00 56.01 55.90 3m1u n LEU 426 Cb 0.51 -0.89 0.02 0.00 -2.33 0.00 0.00 43.42 40.73 3m1u n LEU 426 CO 0.44 0.71 -0.10 0.61 -1.33 0.00 0.00 177.39 177.72 3m1u n GLY 427 N 1.70 -0.38 3.69 -0.72 0.00 -0.21 -4.92 105.19 104.35 3m1u n GLY 427 Ca -0.48 -0.03 -0.01 0.00 0.00 0.00 0.00 46.02 45.50 3m1u n GLY 427 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3m1u s ARG 428 N -5.31 0.76 -0.05 1.61 1.70 -1.26 -0.50 118.95 115.91 3m1u s ARG 428 Ca 0.16 -0.43 -0.30 0.00 -0.47 0.00 0.00 55.73 54.70 3m1u s ARG 428 Cb -0.07 0.26 -0.04 0.00 -0.57 0.00 0.00 34.95 34.53 3m1u s ARG 428 CO 0.20 -0.35 1.24 0.00 -1.08 0.00 0.00 175.30 175.31 3m1u s ALA 429 N -2.78 3.52 0.14 7.88 0.00 -0.70 -4.46 121.76 125.36 3m1u s ALA 429 Ca 0.14 0.66 -0.05 0.00 0.00 0.00 0.00 51.96 52.71 3m1u s ALA 429 Cb 0.02 -3.53 -0.02 0.00 0.00 0.00 0.00 23.12 19.58 3m1u s ALA 429 CO -0.01 -0.80 0.17 0.14 0.00 0.00 0.00 175.76 175.26 3m1u s VAL 430 N 2.29 0.09 -0.17 0.00 -7.23 -0.04 -0.79 120.40 114.55 3m1u s VAL 430 Ca 0.57 -1.60 -0.01 0.00 -1.81 0.00 0.00 61.98 59.13 3m1u s VAL 430 Cb -0.26 -1.87 -0.01 0.00 0.56 0.00 0.00 36.38 34.80 3m1u s VAL 430 CO 0.22 -0.42 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.79 3m1u s VAL 431 N -3.99 3.00 0.32 1.32 1.01 -1.26 -1.37 120.40 119.43 3m1u s VAL 431 Ca 0.19 -0.65 0.08 0.00 0.00 0.00 0.00 61.98 61.59 3m1u s VAL 431 Cb 0.05 -2.29 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 3m1u s VAL 431 CO -0.01 0.49 0.27 0.35 0.00 0.00 0.00 175.10 176.21 3m1u n THR 432 N 4.09 0.00 -1.43 3.92 -2.24 -1.26 -4.59 114.28 112.78 3m1u n THR 432 Ca -0.19 -2.37 -0.23 0.00 -2.27 0.00 0.00 64.05 59.00 3m1u n THR 432 Cb 0.52 1.18 0.18 0.00 -2.10 0.00 0.00 70.33 70.11 3m1u n THR 432 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3m1u n SER 433 N -1.72 -0.66 0.00 3.42 3.41 -1.26 -4.40 113.62 112.40 3m1u n SER 433 Ca 0.08 -1.25 0.12 0.00 -0.26 0.00 0.00 58.87 57.56 3m1u n SER 433 Cb 0.59 -0.80 0.66 0.00 -0.26 0.00 0.00 64.21 64.40 3m1u n SER 433 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3m1u n THR 434 N -3.80 0.16 -3.16 6.66 -2.24 -1.25 -3.93 114.28 106.72 3m1u n THR 434 Ca 0.13 0.04 -0.23 0.00 -2.27 0.00 0.00 64.05 61.72 3m1u n THR 434 Cb 0.46 -0.63 -0.05 0.00 -2.10 0.00 0.00 70.33 68.01 3m1u n THR 434 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3m1u n ARG 435 N -1.21 1.72 0.29 -0.78 1.74 -1.26 -1.02 116.66 116.15 3m1u n ARG 435 Ca 0.14 -3.91 0.15 0.00 -0.77 0.00 0.00 57.85 53.45 3m1u n ARG 435 Cb 0.17 -1.82 0.89 0.00 -1.02 0.00 0.00 32.46 30.69 3m1u n ARG 435 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 3m1u h PRO 436 N 3.38 0.00 -0.63 5.56 0.13 -1.95 -2.78 132.00 135.70 3m1u h PRO 436 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3m1u h PRO 436 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 3m1u h PRO 436 CO 0.62 0.03 0.00 0.41 -0.23 0.00 0.00 178.00 178.83 3m1u n GLY 437 N -1.13 2.28 0.26 1.56 0.00 -1.26 -4.57 105.19 102.33 3m1u n GLY 437 Ca -0.03 -0.70 0.04 0.00 0.00 0.00 0.00 46.02 45.33 3m1u n GLY 437 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3m1u h LEU 438 N 3.37 0.22 -0.00 0.99 5.85 -1.90 -0.81 115.31 123.03 3m1u h LEU 438 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 3m1u h LEU 438 Cb 1.27 0.09 0.00 0.00 0.37 0.00 0.00 40.66 42.40 3m1u h LEU 438 CO 0.21 0.09 -0.00 -0.90 -0.34 0.00 0.00 178.44 177.50 3m1u n ASP 439 N -5.02 0.01 -4.67 1.25 5.75 -1.26 -4.88 116.55 107.72 3m1u n ASP 439 Ca 0.12 -0.21 -0.41 0.00 -0.01 0.00 0.00 54.79 54.28 3m1u n ASP 439 Cb 0.38 -0.26 -0.04 0.00 -1.03 0.00 0.00 41.12 40.16 3m1u n ASP 439 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 3m1u s VAL 440 N -2.53 4.90 0.29 2.12 1.01 -0.31 -4.52 120.40 121.36 3m1u s VAL 440 Ca 0.30 1.59 -0.30 0.00 0.00 0.00 0.00 61.98 63.57 3m1u s VAL 440 Cb 0.20 -4.12 -0.11 0.00 0.00 0.00 0.00 36.38 32.36 3m1u s VAL 440 CO 0.46 0.05 1.52 -2.84 0.00 0.00 0.00 175.10 174.29 3m1u s PRO 441 N 2.01 4.18 0.00 2.72 0.02 -1.26 -2.74 135.00 139.93 3m1u s PRO 441 Ca 0.38 2.47 0.00 0.00 0.02 0.00 0.00 61.00 63.86 3m1u s PRO 441 Cb -0.17 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.30 3m1u s PRO 441 CO 0.13 -0.53 0.00 0.41 -0.33 0.00 0.00 177.00 176.68 3m1u n GLY 442 N 1.98 0.65 3.68 0.52 0.00 -1.26 -4.75 105.19 106.00 3m1u n GLY 442 Ca 0.07 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.60 3m1u n GLY 442 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3m1u n ASN 443 N 0.00 3.18 0.17 1.61 2.85 -1.11 -1.53 115.26 120.42 3m1u n ASN 443 Ca 0.00 1.01 0.03 0.00 -0.11 0.00 0.00 54.58 55.51 3m1u n ASN 443 Cb 0.00 -1.35 0.27 0.00 1.24 0.00 0.00 39.78 39.94 3m1u n ASN 443 CO 0.00 0.00 0.00 0.44 -2.11 0.00 0.00 177.26 175.59 3m1u h ASP 444 N 8.05 0.00 -3.37 1.20 3.32 -1.46 -3.42 116.42 120.75 3m1u h ASP 444 Ca -0.47 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 55.94 3m1u h ASP 444 Cb 1.28 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.69 3m1u h ASP 444 CO 0.93 0.48 0.38 0.20 -1.72 0.00 0.00 179.24 179.51 3m1u s ASN 445 N -6.64 6.34 0.55 6.45 0.02 -1.26 -4.94 114.94 115.46 3m1u s ASN 445 Ca -0.01 -0.38 0.22 0.00 -1.02 0.00 0.00 52.86 51.67 3m1u s ASN 445 Cb 0.12 -2.39 1.48 0.00 0.02 0.00 0.00 41.25 40.48 3m1u s ASN 445 CO 0.72 -1.04 2.18 0.00 0.02 0.00 0.00 177.10 178.97 3m1u h ALA 446 N 9.12 1.86 -0.09 0.60 0.00 -2.01 -1.32 119.26 127.42 3m1u h ALA 446 Ca -0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3m1u h ALA 446 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3m1u h ALA 446 CO 1.01 -0.04 0.00 -0.25 0.00 0.00 0.00 179.25 179.97 3m1u n ASP 447 N -4.27 2.76 -0.33 0.00 8.00 -1.26 -5.10 116.55 116.36 3m1u n ASP 447 Ca -0.02 -2.89 0.00 0.00 0.71 0.00 0.00 54.79 52.59 3m1u n ASP 447 Cb 0.12 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 40.82 3m1u n ASP 447 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3m1u n GLY 448 N -0.97 -0.69 0.23 0.44 0.00 -0.50 -1.85 105.19 101.85 3m1u n GLY 448 Ca 0.15 -1.08 -0.03 0.00 0.00 0.00 0.00 46.02 45.06 3m1u n GLY 448 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3m1u h LEU 449 N 0.00 0.49 -0.95 0.99 3.38 -1.89 -1.91 115.31 115.41 3m1u h LEU 449 Ca 0.00 0.02 0.21 0.00 0.09 0.00 0.00 57.88 58.21 3m1u h LEU 449 Cb 0.00 -0.07 -0.18 0.00 0.09 0.00 0.00 40.66 40.50 3m1u h LEU 449 CO 0.00 0.33 -0.15 0.25 0.09 0.00 0.00 178.44 178.96 3m1u h LEU 450 N 0.62 -0.74 -2.03 1.67 5.85 -1.16 0.47 115.31 119.99 3m1u h LEU 450 Ca 0.26 0.28 0.00 0.00 0.84 0.00 0.00 57.88 59.26 3m1u h LEU 450 Cb 0.13 0.55 -0.00 0.00 0.37 0.00 0.00 40.66 41.71 3m1u h LEU 450 CO -0.16 -0.32 0.00 1.23 -0.34 0.00 0.00 178.44 178.86 3m1u h GLY 451 N 0.01 0.00 -7.65 3.75 0.00 -0.58 -3.46 103.07 95.14 3m1u h GLY 451 Ca 0.49 0.00 -0.73 0.00 0.00 0.00 0.00 47.33 47.09 3m1u h GLY 451 CO -0.94 0.00 1.18 0.50 0.00 0.00 0.00 176.54 177.27 3m1u s ARG 452 N -5.04 3.97 0.00 4.80 0.52 0.15 -4.99 118.95 118.37 3m1u s ARG 452 Ca -0.05 -2.41 0.00 0.00 -0.52 0.00 0.00 55.73 52.75 3m1u s ARG 452 Cb 0.17 -5.00 0.00 0.00 0.52 0.00 0.00 34.95 30.64 3m1u s ARG 452 CO 0.66 -1.74 0.00 1.04 0.02 0.00 0.00 175.30 175.28 3m1u n GLN 454 N 5.72 0.00 0.00 3.54 1.13 0.13 -4.39 117.38 123.51 3m1u n GLN 454 Ca 0.33 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.39 3m1u n GLN 454 Cb 0.44 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.79 3m1u n GLN 454 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3m1u n GLY 455 N -0.35 2.62 3.15 1.08 0.00 -1.17 -1.26 105.19 109.26 3m1u n GLY 455 Ca 0.00 -0.39 0.05 0.00 0.00 0.00 0.00 46.02 45.68 3m1u n GLY 455 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3m1u s SER 457 N 2.00 -0.69 -0.39 1.61 0.15 0.27 -1.35 113.70 115.31 3m1u s SER 457 Ca 0.00 0.40 -0.19 0.00 0.70 0.00 0.00 55.95 56.86 3m1u s SER 457 Cb 0.00 1.56 0.01 0.00 -1.71 0.00 0.00 66.02 65.88 3m1u s SER 457 CO 0.00 -0.13 0.55 -0.63 1.20 0.00 0.00 173.24 174.23 3m1u s ILE 458 N 2.93 4.96 0.48 6.45 1.01 0.98 -0.52 121.20 137.49 3m1u s ILE 458 Ca 0.06 0.20 -0.17 0.00 0.00 0.00 0.00 60.65 60.74 3m1u s ILE 458 Cb -0.11 -4.06 -0.09 0.00 0.01 0.00 0.00 42.46 38.22 3m1u s ILE 458 CO -0.14 -0.37 0.96 -0.76 0.00 0.00 0.00 174.94 174.63 3m1u s LEU 459 N 2.51 3.73 0.62 2.97 1.43 -1.26 -0.62 118.68 128.06 3m1u s LEU 459 Ca 0.19 1.58 0.04 0.00 -1.03 0.00 0.00 54.13 54.91 3m1u s LEU 459 Cb -0.15 -4.49 0.09 0.00 0.03 0.00 0.00 46.19 41.67 3m1u s LEU 459 CO 0.15 -0.51 0.86 -2.16 0.23 0.00 0.00 176.35 174.92 3m1u s PRO 460 N -3.80 2.12 0.00 1.29 0.04 -1.26 -4.91 135.00 128.48 3m1u s PRO 460 Ca 0.59 -1.22 0.15 0.00 0.04 0.00 0.00 61.00 60.56 3m1u s PRO 460 Cb -0.10 -2.49 0.12 0.00 0.04 0.00 0.00 34.50 32.07 3m1u s PRO 460 CO 0.26 -1.03 0.98 0.41 0.04 0.00 0.00 177.00 177.66