#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1m14 n GLU 673 N 0.00 -3.10 -1.98 1.61 4.71 -1.26 -4.58 120.64 116.04 1m14 n GLU 673 Ca 0.00 2.37 -0.00 0.00 -0.01 0.00 0.00 57.16 59.51 1m14 n GLU 673 Cb 0.00 -3.71 -0.00 0.00 -1.01 0.00 0.00 31.44 26.72 1m14 n GLU 673 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1m14 n ALA 674 N -3.50 -3.22 -1.87 0.62 0.00 -1.26 -4.97 120.51 106.32 1m14 n ALA 674 Ca -0.05 0.34 -0.42 0.00 0.00 0.00 0.00 53.44 53.31 1m14 n ALA 674 Cb 0.68 -0.67 -0.03 0.00 0.00 0.00 0.00 19.45 19.43 1m14 n ALA 674 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1m14 s PRO 675 N -0.70 4.20 -0.99 0.00 0.04 -1.26 -4.93 135.00 131.37 1m14 s PRO 675 Ca -0.02 2.41 -0.22 0.00 0.04 0.00 0.00 61.00 63.21 1m14 s PRO 675 Cb 0.00 -3.11 0.07 0.00 0.04 0.00 0.00 34.50 31.50 1m14 s PRO 675 CO 0.32 -0.59 1.36 1.21 0.04 0.00 0.00 177.00 179.34 1m14 s ASN 676 N 0.89 6.52 -0.05 6.66 3.04 -1.26 -4.85 114.94 125.90 1m14 s ASN 676 Ca 0.67 -1.58 0.01 0.00 0.04 0.00 0.00 52.86 52.00 1m14 s ASN 676 Cb -0.45 -2.52 0.09 0.00 -1.54 0.00 0.00 41.25 36.83 1m14 s ASN 676 CO 0.36 -1.40 0.95 0.00 -3.04 0.00 0.00 177.10 173.97 1m14 n GLN 677 N 8.27 1.27 -2.13 0.43 6.02 -1.26 -4.92 117.38 125.06 1m14 n GLN 677 Ca 0.30 -0.37 -0.38 0.00 -0.01 0.00 0.00 57.00 56.53 1m14 n GLN 677 Cb 0.50 -1.31 -0.00 0.00 1.02 0.00 0.00 30.24 30.46 1m14 n GLN 677 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1m14 s ALA 678 N -0.69 3.02 -0.27 -1.58 0.00 -1.26 -5.01 121.76 115.97 1m14 s ALA 678 Ca 0.07 1.07 -0.15 0.00 0.00 0.00 0.00 51.96 52.95 1m14 s ALA 678 Cb 0.06 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 1m14 s ALA 678 CO 0.02 -0.81 0.40 -0.51 0.00 0.00 0.00 175.76 174.86 1m14 s LEU 679 N -2.94 4.04 -0.29 0.00 1.02 -1.26 -5.05 118.68 114.20 1m14 s LEU 679 Ca 0.63 0.34 -0.17 0.00 0.02 0.00 0.00 54.13 54.94 1m14 s LEU 679 Cb -0.33 -2.47 -0.02 0.00 0.02 0.00 0.00 46.19 43.39 1m14 s LEU 679 CO 0.40 -0.20 0.49 -0.22 0.02 0.00 0.00 176.35 176.85 1m14 s LEU 680 N 2.09 4.14 -0.19 1.79 0.20 -1.26 -4.97 118.68 120.47 1m14 s LEU 680 Ca 0.16 0.32 -0.12 0.00 0.69 0.00 0.00 54.13 55.18 1m14 s LEU 680 Cb -0.16 -2.60 -0.05 0.00 -0.43 0.00 0.00 46.19 42.95 1m14 s LEU 680 CO 0.10 -0.33 0.21 -0.60 -0.29 0.00 0.00 176.35 175.43 1m14 s ARG 681 N 2.31 4.20 -0.27 1.98 3.52 -1.26 -5.03 118.95 124.40 1m14 s ARG 681 Ca 0.19 -0.08 -0.10 0.00 -0.13 0.00 0.00 55.73 55.61 1m14 s ARG 681 Cb -0.16 -3.44 -0.04 0.00 -1.56 0.00 0.00 34.95 29.75 1m14 s ARG 681 CO 0.11 0.23 0.15 0.42 -0.81 0.00 0.00 175.30 175.40 1m14 s ILE 682 N 0.53 5.07 -0.08 4.11 -1.09 -1.26 -0.90 121.20 127.57 1m14 s ILE 682 Ca 0.12 0.08 -0.05 0.00 -2.23 0.00 0.00 60.65 58.57 1m14 s ILE 682 Cb -0.12 -3.40 -0.04 0.00 -1.58 0.00 0.00 42.46 37.32 1m14 s ILE 682 CO 0.01 0.29 0.13 -0.76 -1.23 0.00 0.00 174.94 173.38 1m14 s LEU 683 N 1.61 4.25 -0.03 2.97 1.02 -0.17 -4.95 118.68 123.38 1m14 s LEU 683 Ca 0.07 0.38 -0.29 0.00 0.02 0.00 0.00 54.13 54.31 1m14 s LEU 683 Cb -0.15 -2.17 -0.03 0.00 0.02 0.00 0.00 46.19 43.86 1m14 s LEU 683 CO 0.08 0.36 0.94 -0.54 0.02 0.00 0.00 176.35 177.22 1m14 s LYS 684 N -1.26 4.52 0.49 1.70 1.02 -1.26 -4.48 119.74 120.46 1m14 s LYS 684 Ca 0.18 1.33 0.34 0.00 0.02 0.00 0.00 55.97 57.84 1m14 s LYS 684 Cb -0.12 -3.47 1.47 0.00 -0.52 0.00 0.00 37.83 35.18 1m14 s LYS 684 CO 0.08 -0.08 1.71 1.49 -0.92 0.00 0.00 175.35 177.63 1m14 h GLU 685 N 6.85 0.10 0.00 1.68 4.57 -1.97 0.33 114.58 126.14 1m14 h GLU 685 Ca -0.39 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.78 1m14 h GLU 685 Cb 1.20 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.77 1m14 h GLU 685 CO 0.77 0.06 0.00 0.25 -1.18 0.00 0.00 179.01 178.91 1m14 n THR 686 N -4.35 0.07 1.48 0.32 -2.24 -1.26 -3.13 114.28 105.17 1m14 n THR 686 Ca 0.32 0.02 0.14 0.00 -2.27 0.00 0.00 64.05 62.26 1m14 n THR 686 Cb 1.37 -0.55 0.61 0.00 -2.10 0.00 0.00 70.33 69.65 1m14 n THR 686 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1m14 n GLU 687 N -1.24 0.91 -3.79 -0.78 1.02 0.12 -4.88 120.64 111.99 1m14 n GLU 687 Ca 0.15 -0.36 -0.13 0.00 -0.02 0.00 0.00 57.16 56.80 1m14 n GLU 687 Cb 0.20 -1.49 -0.12 0.00 -0.02 0.00 0.00 31.44 30.01 1m14 n GLU 687 CO 0.00 0.00 0.00 -0.59 1.18 0.00 0.00 177.13 177.72 1m14 s PHE 688 N -2.34 -0.24 -0.26 -0.32 -0.12 -1.18 0.76 117.98 114.28 1m14 s PHE 688 Ca 0.32 0.59 -0.09 0.00 -0.05 0.00 0.00 56.93 57.71 1m14 s PHE 688 Cb 0.20 0.08 -0.04 0.00 -0.63 0.00 0.00 43.02 42.64 1m14 s PHE 688 CO 0.44 -0.12 0.12 0.15 -0.05 0.00 0.00 175.22 175.77 1m14 s LYS 689 N 0.15 3.79 0.02 1.99 1.02 -0.85 -4.97 119.74 120.89 1m14 s LYS 689 Ca -0.00 -0.41 0.09 0.00 0.02 0.00 0.00 55.97 55.67 1m14 s LYS 689 Cb -0.02 -3.47 0.38 0.00 -0.52 0.00 0.00 37.83 34.20 1m14 s LYS 689 CO 0.00 -0.18 1.28 1.63 -0.92 0.00 0.00 175.35 177.16 1m14 n LYS 690 N 4.97 0.01 0.00 1.68 5.02 -1.26 -2.04 118.16 126.53 1m14 n LYS 690 Ca -0.15 0.37 0.00 0.00 -2.02 0.00 0.00 58.31 56.51 1m14 n LYS 690 Cb 0.52 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 1m14 n LYS 690 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 1m14 n ILE 691 N -1.54 0.00 -3.88 -0.18 5.41 -1.25 -4.09 119.36 113.83 1m14 n ILE 691 Ca 0.02 0.00 -0.11 0.00 1.00 0.00 0.00 62.75 63.66 1m14 n ILE 691 Cb 0.10 0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 38.93 1m14 n ILE 691 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 1m14 s LYS 692 N 0.00 0.45 0.50 0.38 2.20 -1.11 -5.05 119.74 117.10 1m14 s LYS 692 Ca 0.00 -0.39 -0.19 0.00 -0.36 0.00 0.00 55.97 55.03 1m14 s LYS 692 Cb 0.00 0.19 -0.08 0.00 -1.51 0.00 0.00 37.83 36.42 1m14 s LYS 692 CO 0.00 -0.10 1.02 0.54 -0.36 0.00 0.00 175.35 176.45 1m14 s VAL 693 N -1.32 3.94 0.00 4.02 0.11 -1.26 -1.23 120.40 124.66 1m14 s VAL 693 Ca -0.14 1.14 0.00 0.00 -2.93 0.00 0.00 61.98 60.05 1m14 s VAL 693 Cb -0.08 -3.48 0.00 0.00 -1.53 0.00 0.00 36.38 31.29 1m14 s VAL 693 CO 0.01 -0.32 0.00 -0.11 -3.33 0.00 0.00 175.10 171.35 1m14 n LEU 694 N -1.12 0.00 0.00 2.54 7.94 -0.59 -4.80 117.00 120.98 1m14 n LEU 694 Ca 0.09 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.99 1m14 n LEU 694 Cb 0.53 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.48 1m14 n LEU 694 CO 0.41 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.30 1m14 n GLY 695 N 2.66 -1.24 2.03 -3.96 0.00 -0.93 -5.00 105.19 98.74 1m14 n GLY 695 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1m14 n GLY 695 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1m14 n SER 696 N 0.16 -0.57 0.00 1.61 7.64 -1.26 -2.75 113.62 118.45 1m14 n SER 696 Ca 0.00 0.39 0.00 0.00 1.01 0.00 0.00 58.87 60.27 1m14 n SER 696 Cb 0.00 0.69 0.00 0.00 -1.01 0.00 0.00 64.21 63.89 1m14 n SER 696 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1m14 n GLY 697 N 1.04 2.17 0.00 0.23 0.00 -1.26 -3.64 105.19 103.73 1m14 n GLY 697 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1m14 n GLY 697 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m14 n ALA 698 N 8.75 0.17 -0.01 4.61 0.00 -1.26 -4.90 120.51 127.87 1m14 n ALA 698 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 1m14 n ALA 698 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1m14 n ALA 698 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1m14 h PHE 699 N 0.00 0.42 0.00 0.00 0.05 -1.94 -3.50 116.94 111.97 1m14 h PHE 699 Ca 0.00 -0.23 0.00 0.00 3.82 0.00 0.00 57.97 61.56 1m14 h PHE 699 Cb 0.00 -0.05 0.00 0.00 2.00 0.00 0.00 35.95 37.90 1m14 h PHE 699 CO 0.00 1.04 0.00 0.41 -0.18 0.00 0.00 178.31 179.58 1m14 n GLY 700 N 1.06 -1.01 3.15 -1.45 0.00 -1.24 -4.21 105.19 101.49 1m14 n GLY 700 Ca -0.10 0.72 -0.11 0.00 0.00 0.00 0.00 46.02 46.53 1m14 n GLY 700 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1m14 s THR 701 N 0.00 -0.51 -0.35 2.61 2.01 -1.21 -4.49 115.64 113.70 1m14 s THR 701 Ca 0.00 0.21 -0.13 0.00 0.31 0.00 0.00 61.69 62.08 1m14 s THR 701 Cb 0.00 -0.56 -0.01 0.00 0.01 0.00 0.00 72.50 71.93 1m14 s THR 701 CO 0.00 0.09 0.25 -0.69 -0.69 0.00 0.00 174.62 173.58 1m14 s VAL 702 N 2.46 5.28 0.59 3.82 1.01 -1.11 -2.79 120.40 129.66 1m14 s VAL 702 Ca -0.01 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 61.76 1m14 s VAL 702 Cb -0.12 -3.74 0.08 0.00 0.00 0.00 0.00 36.38 32.61 1m14 s VAL 702 CO -0.11 -0.04 0.82 -0.31 0.00 0.00 0.00 175.10 175.46 1m14 s TYR 703 N 1.72 1.87 -0.04 5.22 1.51 0.16 -1.53 117.35 126.26 1m14 s TYR 703 Ca 0.06 -0.45 0.02 0.00 -1.01 0.00 0.00 57.07 55.70 1m14 s TYR 703 Cb -0.18 -2.55 0.01 0.00 -0.11 0.00 0.00 41.96 39.14 1m14 s TYR 703 CO 0.10 -1.17 -0.09 0.21 -1.11 0.00 0.00 175.55 173.49 1m14 s LYS 704 N -4.77 1.08 0.00 -0.62 2.20 -0.37 -1.42 119.74 115.84 1m14 s LYS 704 Ca 0.62 -0.29 0.00 0.00 -0.36 0.00 0.00 55.97 55.93 1m14 s LYS 704 Cb -0.07 -0.99 0.00 0.00 -1.51 0.00 0.00 37.83 35.26 1m14 s LYS 704 CO 0.40 0.07 0.00 0.41 -0.36 0.00 0.00 175.35 175.86 1m14 n GLY 705 N 3.52 2.81 2.98 5.54 0.00 0.37 -2.76 105.19 117.64 1m14 n GLY 705 Ca -0.20 -0.62 -0.20 0.00 0.00 0.00 0.00 46.02 45.00 1m14 n GLY 705 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1m14 s LEU 706 N 0.00 1.74 -0.21 0.99 1.43 -0.87 -1.28 118.68 120.49 1m14 s LEU 706 Ca 0.00 -0.16 -0.07 0.00 -1.03 0.00 0.00 54.13 52.87 1m14 s LEU 706 Cb 0.00 -0.49 -0.03 0.00 0.03 0.00 0.00 46.19 45.69 1m14 s LEU 706 CO 0.00 0.05 0.05 0.86 0.23 0.00 0.00 176.35 177.54 1m14 s TRP 707 N 0.27 3.16 -0.54 0.29 -0.00 -0.42 -2.00 118.94 119.70 1m14 s TRP 707 Ca -0.04 -0.15 0.04 0.00 -0.00 0.00 0.00 56.10 55.95 1m14 s TRP 707 Cb -0.09 -2.13 0.16 0.00 -0.00 0.00 0.00 33.47 31.41 1m14 s TRP 707 CO 0.00 -0.07 0.36 0.42 -0.00 0.00 0.00 176.95 177.67 1m14 s ILE 708 N 0.86 1.76 0.20 5.86 1.01 0.23 -1.47 121.20 129.66 1m14 s ILE 708 Ca 0.03 -3.27 -0.32 0.00 0.00 0.00 0.00 60.65 57.09 1m14 s ILE 708 Cb -0.14 -2.19 -0.15 0.00 0.01 0.00 0.00 42.46 39.99 1m14 s ILE 708 CO 0.02 -1.02 1.17 -2.65 0.00 0.00 0.00 174.94 172.47 1m14 n PRO 709 N 2.75 1.33 -0.16 2.79 -0.02 -1.26 -4.76 135.00 135.67 1m14 n PRO 709 Ca 0.18 0.47 -0.06 0.00 -2.02 0.00 0.00 63.50 62.07 1m14 n PRO 709 Cb 0.38 -1.97 -0.05 0.00 -0.02 0.00 0.00 33.50 31.84 1m14 n PRO 709 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1m14 h GLU 710 N 3.27 -0.07 0.18 -0.52 4.81 -1.97 -3.26 114.58 117.02 1m14 h GLU 710 Ca -0.43 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 58.80 1m14 h GLU 710 Cb 1.33 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.73 1m14 h GLU 710 CO 0.69 -0.05 -0.09 0.78 -0.73 0.00 0.00 179.01 179.62 1m14 h GLY 711 N -0.08 -0.25 -1.34 1.92 0.00 -2.02 -3.46 103.07 97.84 1m14 h GLY 711 Ca 0.06 0.09 -0.52 0.00 0.00 0.00 0.00 47.33 46.97 1m14 h GLY 711 CO -0.40 -0.09 0.27 -0.54 0.00 0.00 0.00 176.54 175.77 1m14 s GLU 712 N -4.69 1.48 -0.78 4.80 8.01 -1.23 -4.97 118.70 121.31 1m14 s GLU 712 Ca -0.15 1.47 0.03 0.00 0.01 0.00 0.00 54.97 56.33 1m14 s GLU 712 Cb 0.02 -1.79 0.25 0.00 -4.31 0.00 0.00 34.13 28.31 1m14 s GLU 712 CO 0.59 -2.28 0.89 1.17 0.01 0.00 0.00 175.26 175.65 1m14 n LYS 713 N -3.87 2.92 -3.78 1.61 3.00 -1.26 -4.74 118.16 112.03 1m14 n LYS 713 Ca 0.11 -4.61 -0.13 0.00 -0.00 0.00 0.00 58.31 53.68 1m14 n LYS 713 Cb 0.52 -2.34 -0.10 0.00 0.00 0.00 0.00 35.03 33.12 1m14 n LYS 713 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1m14 s VAL 714 N -2.33 0.05 -0.14 3.15 0.11 -1.26 -5.15 120.40 114.83 1m14 s VAL 714 Ca 0.35 -0.39 0.02 0.00 -2.93 0.00 0.00 61.98 59.03 1m14 s VAL 714 Cb 0.08 -0.53 0.01 0.00 -1.53 0.00 0.00 36.38 34.41 1m14 s VAL 714 CO -0.01 -0.21 -0.20 -0.54 -3.33 0.00 0.00 175.10 170.80 1m14 s LYS 715 N -0.94 3.08 -0.28 1.54 1.02 -1.26 -4.42 119.74 118.48 1m14 s LYS 715 Ca -0.10 -0.82 -0.04 0.00 0.02 0.00 0.00 55.97 55.03 1m14 s LYS 715 Cb -0.05 -2.49 0.03 0.00 -0.52 0.00 0.00 37.83 34.80 1m14 s LYS 715 CO 0.03 0.00 0.01 0.42 -0.92 0.00 0.00 175.35 174.89 1m14 s ILE 716 N 0.80 3.31 0.27 2.17 1.01 -0.54 -4.92 121.20 123.30 1m14 s ILE 716 Ca -0.07 -0.99 -0.31 0.00 0.00 0.00 0.00 60.65 59.28 1m14 s ILE 716 Cb -0.16 -2.74 -0.12 0.00 0.01 0.00 0.00 42.46 39.45 1m14 s ILE 716 CO -0.01 0.08 1.56 -2.65 0.00 0.00 0.00 174.94 173.92 1m14 n PRO 717 N 4.73 2.53 -3.96 2.79 -0.02 -1.26 -1.30 135.00 138.52 1m14 n PRO 717 Ca -0.15 0.90 -0.09 0.00 -2.02 0.00 0.00 63.50 62.14 1m14 n PRO 717 Cb 0.46 -2.66 -0.10 0.00 -0.02 0.00 0.00 33.50 31.19 1m14 n PRO 717 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1m14 s VAL 718 N 0.10 0.15 -0.17 -1.45 1.01 -0.41 -2.81 120.40 116.83 1m14 s VAL 718 Ca 0.66 -1.21 -0.02 0.00 0.00 0.00 0.00 61.98 61.41 1m14 s VAL 718 Cb -0.54 -0.96 -0.02 0.00 0.00 0.00 0.00 36.38 34.87 1m14 s VAL 718 CO 0.47 -0.67 -0.08 0.00 0.00 0.00 0.00 175.10 174.82 1m14 s ALA 719 N -2.78 2.77 -0.34 5.51 0.00 0.08 -0.48 121.76 126.52 1m14 s ALA 719 Ca -0.03 -0.96 -0.02 0.00 0.00 0.00 0.00 51.96 50.94 1m14 s ALA 719 Cb -0.00 -1.45 0.07 0.00 0.00 0.00 0.00 23.12 21.73 1m14 s ALA 719 CO -0.05 0.02 0.06 0.42 0.00 0.00 0.00 175.76 176.21 1m14 s ILE 720 N 0.72 3.05 0.06 0.00 1.01 -0.51 -1.17 121.20 124.36 1m14 s ILE 720 Ca -0.04 -1.64 0.00 0.00 0.00 0.00 0.00 60.65 58.98 1m14 s ILE 720 Cb -0.15 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.40 1m14 s ILE 720 CO 0.02 -0.31 0.19 -0.75 0.00 0.00 0.00 174.94 174.09 1m14 s LYS 721 N 1.20 3.39 0.14 2.79 2.20 -0.10 0.38 119.74 129.74 1m14 s LYS 721 Ca -0.00 -0.45 -0.03 0.00 -0.36 0.00 0.00 55.97 55.12 1m14 s LYS 721 Cb -0.21 -3.01 0.01 0.00 -1.51 0.00 0.00 37.83 33.11 1m14 s LYS 721 CO -0.02 0.61 0.25 -0.85 -0.36 0.00 0.00 175.35 174.98 1m14 n GLU 722 N 0.36 0.36 -3.92 4.03 0.28 -1.12 -0.41 120.64 120.22 1m14 n GLU 722 Ca -0.06 -0.98 -0.21 0.00 -0.16 0.00 0.00 57.16 55.75 1m14 n GLU 722 Cb 0.51 1.06 -0.04 0.00 1.43 0.00 0.00 31.44 34.41 1m14 n GLU 722 CO 0.00 0.00 0.00 -1.17 -0.16 0.00 0.00 177.13 175.80 1m14 s LEU 723 N 0.00 3.65 0.89 -1.84 2.96 -1.26 -3.32 118.68 119.76 1m14 s LEU 723 Ca 0.09 -0.43 -0.11 0.00 -0.22 0.00 0.00 54.13 53.46 1m14 s LEU 723 Cb -0.01 -2.23 0.13 0.00 0.50 0.00 0.00 46.19 44.58 1m14 s LEU 723 CO 0.06 -0.25 1.16 -0.60 -1.32 0.00 0.00 176.35 175.41 1m14 s ARG 724 N -3.94 1.13 0.23 1.98 6.06 -1.26 -4.75 118.95 118.40 1m14 s ARG 724 Ca 0.38 1.62 -0.15 0.00 -2.50 0.00 0.00 55.73 55.08 1m14 s ARG 724 Cb -0.06 -1.73 0.27 0.00 0.06 0.00 0.00 34.95 33.48 1m14 s ARG 724 CO 0.26 -2.56 1.59 1.05 -2.50 0.00 0.00 175.30 173.13 1m14 h GLU 725 N -1.66 -0.04 -6.29 5.12 9.09 -1.99 -3.38 114.58 115.43 1m14 h GLU 725 Ca -0.44 0.00 -0.55 0.00 0.05 0.00 0.00 59.36 58.43 1m14 h GLU 725 Cb 1.28 0.01 -0.01 0.00 -1.65 0.00 0.00 28.75 28.38 1m14 h GLU 725 CO 0.42 -0.03 1.01 0.00 0.05 0.00 0.00 179.01 180.47 1m14 s ALA 726 N -6.13 3.63 -0.21 1.06 0.00 -1.26 -4.92 121.76 113.92 1m14 s ALA 726 Ca -0.14 0.91 -0.28 0.00 0.00 0.00 0.00 51.96 52.45 1m14 s ALA 726 Cb 0.21 -3.70 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1m14 s ALA 726 CO 0.73 -1.26 0.96 0.99 0.00 0.00 0.00 175.76 177.19 1m14 s THR 727 N 3.53 4.75 -0.28 0.00 2.01 -1.26 -5.02 115.64 119.37 1m14 s THR 727 Ca 0.70 1.87 -0.03 0.00 0.31 0.00 0.00 61.69 64.54 1m14 s THR 727 Cb -0.33 -4.24 0.03 0.00 0.01 0.00 0.00 72.50 67.97 1m14 s THR 727 CO 0.28 -0.11 0.01 -0.55 -0.69 0.00 0.00 174.62 173.56 1m14 s SER 728 N 1.22 4.78 0.15 3.53 0.15 -1.26 -5.04 113.70 117.23 1m14 s SER 728 Ca 0.42 -0.99 -0.21 0.00 0.70 0.00 0.00 55.95 55.86 1m14 s SER 728 Cb -0.16 -1.75 0.03 0.00 -1.71 0.00 0.00 66.02 62.44 1m14 s SER 728 CO 0.08 -0.20 1.26 -2.65 1.20 0.00 0.00 173.24 172.93 1m14 n PRO 729 N 4.71 -0.30 0.00 5.44 -0.02 -1.26 -0.40 135.00 143.17 1m14 n PRO 729 Ca -0.15 1.24 0.08 0.00 -2.02 0.00 0.00 63.50 62.66 1m14 n PRO 729 Cb 0.46 -1.84 0.39 0.00 -0.02 0.00 0.00 33.50 32.49 1m14 n PRO 729 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 1m14 n LYS 730 N -5.09 0.17 0.04 -0.52 2.85 -1.26 -1.00 118.16 113.35 1m14 n LYS 730 Ca 0.04 0.16 -0.16 0.00 -1.05 0.00 0.00 58.31 57.30 1m14 n LYS 730 Cb 0.25 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 32.99 1m14 n LYS 730 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1m14 h ALA 731 N 2.71 0.38 -0.03 0.58 0.00 -1.15 -2.56 119.26 119.19 1m14 h ALA 731 Ca 0.00 -1.21 -0.18 0.00 0.00 0.00 0.00 54.91 53.52 1m14 h ALA 731 Cb 0.19 0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1m14 h ALA 731 CO 0.00 1.24 -0.77 -0.91 0.00 0.00 0.00 179.25 178.81 1m14 h ASN 732 N 0.06 0.31 -0.52 0.00 4.21 -0.58 -2.01 115.58 117.05 1m14 h ASN 732 Ca -0.27 -0.22 -0.02 0.00 1.21 0.00 0.00 56.30 56.99 1m14 h ASN 732 Cb 2.01 -0.09 -0.02 0.00 -1.12 0.00 0.00 38.32 39.10 1m14 h ASN 732 CO 0.14 0.96 0.23 0.50 -1.29 0.00 0.00 177.43 177.97 1m14 h LYS 733 N 0.16 0.76 -0.64 0.81 3.64 -1.12 -1.58 116.57 118.61 1m14 h LYS 733 Ca -0.03 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.17 1m14 h LYS 733 Cb 1.34 -0.13 -0.03 0.00 -0.41 0.00 0.00 32.23 33.01 1m14 h LYS 733 CO 0.12 0.65 0.17 0.93 -2.27 0.00 0.00 179.45 179.05 1m14 h GLU 734 N 0.69 0.99 -0.30 1.90 5.08 -1.26 0.43 114.58 122.11 1m14 h GLU 734 Ca 0.18 -0.21 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 1m14 h GLU 734 Cb 0.16 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1m14 h GLU 734 CO -0.02 0.87 -0.11 0.82 -1.00 0.00 0.00 179.01 179.57 1m14 h ILE 735 N 0.95 1.29 0.00 3.13 2.04 -1.23 -1.93 117.51 121.75 1m14 h ILE 735 Ca 0.21 -1.19 -0.05 0.00 1.00 0.00 0.00 64.86 64.83 1m14 h ILE 735 Cb 0.32 1.43 -0.01 0.00 -0.74 0.00 0.00 36.82 37.83 1m14 h ILE 735 CO -0.00 0.38 -0.22 -0.07 0.00 0.00 0.00 178.15 178.24 1m14 h LEU 736 N 0.36 0.00 -0.68 1.44 -0.00 -0.98 -0.81 115.31 114.64 1m14 h LEU 736 Ca 0.07 0.00 -0.14 0.00 -0.00 0.00 0.00 57.88 57.81 1m14 h LEU 736 Cb 0.62 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.27 1m14 h LEU 736 CO 0.04 0.22 -0.56 0.44 -0.00 0.00 0.00 178.44 178.57 1m14 h ASP 737 N 0.00 0.33 -0.11 -0.43 3.32 -0.60 -1.62 116.42 117.31 1m14 h ASP 737 Ca -0.00 -0.17 -0.10 0.00 0.02 0.00 0.00 57.03 56.78 1m14 h ASP 737 Cb 0.41 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.87 1m14 h ASP 737 CO 0.03 0.82 -0.31 -0.08 -1.72 0.00 0.00 179.24 177.98 1m14 h GLU 738 N 0.22 0.41 -0.84 3.56 4.81 -0.61 -2.68 114.58 119.44 1m14 h GLU 738 Ca 0.00 -0.29 0.06 0.00 -0.13 0.00 0.00 59.36 59.00 1m14 h GLU 738 Cb 1.05 0.05 -0.05 0.00 0.63 0.00 0.00 28.75 30.42 1m14 h GLU 738 CO 0.09 0.90 0.55 0.00 -0.73 0.00 0.00 179.01 179.82 1m14 h ALA 739 N 0.50 1.56 0.66 2.92 0.00 -1.09 0.18 119.26 123.99 1m14 h ALA 739 Ca -0.01 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1m14 h ALA 739 Cb 0.92 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1m14 h ALA 739 CO 0.07 0.32 -0.40 -0.92 0.00 0.00 0.00 179.25 178.32 1m14 h TYR 740 N 0.96 -1.05 -0.80 0.00 5.03 -1.13 0.69 116.97 120.65 1m14 h TYR 740 Ca 0.36 -0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.62 1m14 h TYR 740 Cb 0.18 0.37 -0.04 0.00 1.55 0.00 0.00 36.73 38.80 1m14 h TYR 740 CO -0.00 -0.61 0.38 -0.39 -1.32 0.00 0.00 178.16 176.22 1m14 h VAL 741 N -1.00 1.25 -0.15 1.81 -1.51 -1.09 -2.82 116.25 112.74 1m14 h VAL 741 Ca -0.08 -0.72 -0.08 0.00 -1.23 0.00 0.00 66.70 64.58 1m14 h VAL 741 Cb 0.80 0.24 -0.01 0.00 -2.13 0.00 0.00 31.29 30.19 1m14 h VAL 741 CO 0.09 0.31 -0.28 0.24 -1.23 0.00 0.00 177.57 176.69 1m14 h MET 742 N 1.14 0.28 0.00 5.19 2.86 -0.51 -1.70 114.93 122.19 1m14 h MET 742 Ca 0.27 -0.10 0.00 0.00 -2.06 0.00 0.00 59.70 57.81 1m14 h MET 742 Cb 0.13 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.77 1m14 h MET 742 CO -0.03 0.54 0.00 0.00 1.06 0.00 0.00 176.91 178.48 1m14 n ALA 743 N -2.48 2.10 0.26 6.32 0.00 0.22 -3.28 120.51 123.65 1m14 n ALA 743 Ca -0.01 -0.08 0.11 0.00 0.00 0.00 0.00 53.44 53.46 1m14 n ALA 743 Cb 0.39 -1.39 0.21 0.00 0.00 0.00 0.00 19.45 18.66 1m14 n ALA 743 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1m14 n SER 744 N -1.51 3.43 -4.34 0.00 7.64 -0.64 -4.58 113.62 113.61 1m14 n SER 744 Ca 0.06 -1.98 -0.31 0.00 1.01 0.00 0.00 58.87 57.65 1m14 n SER 744 Cb 0.28 -0.25 -0.15 0.00 -1.01 0.00 0.00 64.21 63.08 1m14 n SER 744 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1m14 s VAL 745 N -1.43 2.19 -0.36 0.44 -7.23 -1.21 -5.07 120.40 107.74 1m14 s VAL 745 Ca 0.38 -1.24 0.03 0.00 -1.81 0.00 0.00 61.98 59.34 1m14 s VAL 745 Cb 0.22 -1.82 0.15 0.00 0.56 0.00 0.00 36.38 35.50 1m14 s VAL 745 CO 0.31 0.46 0.38 -0.62 -0.31 0.00 0.00 175.10 175.32 1m14 s ASP 746 N -0.98 1.01 -0.08 4.85 2.15 -1.26 -4.90 116.67 117.46 1m14 s ASP 746 Ca 0.11 -1.32 -0.15 0.00 0.43 0.00 0.00 52.55 51.62 1m14 s ASP 746 Cb -0.10 0.68 0.03 0.00 -0.30 0.00 0.00 42.92 43.24 1m14 s ASP 746 CO 0.01 -0.28 0.37 0.21 -0.17 0.00 0.00 175.17 175.31 1m14 s ASN 747 N 1.68 -0.32 0.66 -0.34 3.84 -1.26 -5.04 114.94 114.15 1m14 s ASN 747 Ca 0.15 0.45 0.39 0.00 0.21 0.00 0.00 52.86 54.06 1m14 s ASN 747 Cb -0.14 0.55 2.12 0.00 -0.55 0.00 0.00 41.25 43.23 1m14 s ASN 747 CO -0.10 -0.31 2.19 -0.65 -2.79 0.00 0.00 177.10 175.44 1m14 h PRO 748 N 4.60 0.00 -0.23 0.43 0.11 -1.99 -1.79 132.00 133.13 1m14 h PRO 748 Ca -0.28 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.76 1m14 h PRO 748 Cb 1.18 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.25 1m14 h PRO 748 CO 0.33 0.00 -0.07 0.72 -0.21 0.00 0.00 178.00 178.77 1m14 n HIS 749 N -2.99 0.76 -4.48 0.65 8.25 -1.26 -4.80 115.22 111.36 1m14 n HIS 749 Ca -0.03 -1.23 -0.20 0.00 -0.26 0.00 0.00 57.72 56.00 1m14 n HIS 749 Cb 0.18 -0.35 -0.15 0.00 1.12 0.00 0.00 29.99 30.79 1m14 n HIS 749 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1m14 s VAL 750 N -3.04 0.88 0.13 1.59 1.01 -0.67 -1.42 120.40 118.88 1m14 s VAL 750 Ca 0.41 -0.46 -0.35 0.00 0.00 0.00 0.00 61.98 61.58 1m14 s VAL 750 Cb 0.36 -0.75 -0.15 0.00 0.00 0.00 0.00 36.38 35.84 1m14 s VAL 750 CO 0.03 0.25 1.47 0.00 0.00 0.00 0.00 175.10 176.85 1m14 s ARG 752 N 0.69 4.05 -0.08 0.00 3.52 -1.26 -4.99 118.95 120.88 1m14 s ARG 752 Ca 0.81 0.44 -0.23 0.00 -0.13 0.00 0.00 55.73 56.62 1m14 s ARG 752 Cb -0.80 -3.67 -0.04 0.00 -1.56 0.00 0.00 34.95 28.89 1m14 s ARG 752 CO 0.42 -0.43 0.69 -1.17 -0.81 0.00 0.00 175.30 174.00 1m14 s LEU 753 N 2.48 4.30 -0.16 -0.88 2.96 -1.26 -2.49 118.68 123.64 1m14 s LEU 753 Ca 0.25 1.15 0.01 0.00 -0.22 0.00 0.00 54.13 55.32 1m14 s LEU 753 Cb -0.15 -3.06 -0.23 0.00 0.50 0.00 0.00 46.19 43.24 1m14 s LEU 753 CO 0.09 -0.13 0.20 0.18 -1.32 0.00 0.00 176.35 175.37 1m14 n LEU 754 N 3.92 2.20 0.00 -0.68 4.77 0.17 -4.94 117.00 122.44 1m14 n LEU 754 Ca -0.01 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 1m14 n LEU 754 Cb 0.51 -0.70 0.00 0.00 -2.33 0.00 0.00 43.42 40.91 1m14 n LEU 754 CO 0.47 0.77 0.00 0.61 -1.33 0.00 0.00 177.39 177.91 1m14 n GLY 755 N 1.98 -2.12 3.29 -0.72 0.00 -1.13 -4.63 105.19 101.87 1m14 n GLY 755 Ca -0.34 -1.21 -0.23 0.00 0.00 0.00 0.00 46.02 44.25 1m14 n GLY 755 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1m14 s ILE 756 N -2.33 1.68 -0.20 -0.61 -4.36 -0.08 -1.17 121.20 114.13 1m14 s ILE 756 Ca 0.00 -1.64 -0.01 0.00 -0.26 0.00 0.00 60.65 58.74 1m14 s ILE 756 Cb 0.00 -1.60 0.01 0.00 1.25 0.00 0.00 42.46 42.12 1m14 s ILE 756 CO 0.00 -0.16 -0.14 0.00 0.24 0.00 0.00 174.94 174.88 1m14 n LEU 758 N 4.69 6.87 0.00 0.00 4.77 -1.26 -1.32 117.00 130.75 1m14 n LEU 758 Ca -0.20 -4.50 0.00 0.00 -0.03 0.00 0.00 56.01 51.28 1m14 n LEU 758 Cb 0.50 -1.53 0.00 0.00 -2.33 0.00 0.00 43.42 40.06 1m14 n LEU 758 CO 0.27 1.36 0.00 0.35 -1.33 0.00 0.00 177.39 178.04 1m14 n THR 759 N 3.78 0.00 -0.29 -5.08 -2.24 -1.26 -4.92 114.28 104.27 1m14 n THR 759 Ca 0.46 0.00 0.11 0.00 -2.27 0.00 0.00 64.05 62.35 1m14 n THR 759 Cb 0.36 -1.50 0.26 0.00 -2.10 0.00 0.00 70.33 67.36 1m14 n THR 759 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1m14 h SER 760 N 0.00 -0.03 -3.69 3.42 0.02 -1.99 -3.36 113.55 107.92 1m14 h SER 760 Ca 0.00 0.19 -0.62 0.00 -0.84 0.00 0.00 61.79 60.52 1m14 h SER 760 Cb 0.00 0.27 -0.32 0.00 0.14 0.00 0.00 62.40 62.48 1m14 h SER 760 CO 0.00 -0.14 -0.86 0.42 -1.14 0.00 0.00 176.83 175.11 1m14 s THR 761 N -5.97 1.72 -0.05 -2.27 -4.23 -1.26 -4.97 115.64 98.61 1m14 s THR 761 Ca -0.12 -0.85 -0.29 0.00 -1.18 0.00 0.00 61.69 59.24 1m14 s THR 761 Cb 0.25 -1.49 -0.08 0.00 1.34 0.00 0.00 72.50 72.53 1m14 s THR 761 CO 0.77 0.49 2.05 0.54 -0.54 0.00 0.00 174.62 177.92 1m14 s VAL 762 N 0.18 3.02 -0.08 2.29 0.11 -1.26 -4.83 120.40 119.83 1m14 s VAL 762 Ca -0.10 0.02 -0.15 0.00 -2.93 0.00 0.00 61.98 58.83 1m14 s VAL 762 Cb -0.15 -3.02 -0.05 0.00 -1.53 0.00 0.00 36.38 31.64 1m14 s VAL 762 CO 0.05 -0.01 0.37 -1.10 -3.33 0.00 0.00 175.10 171.08 1m14 s GLN 763 N 5.09 4.06 -0.19 1.54 -0.21 -0.43 -4.49 119.66 125.03 1m14 s GLN 763 Ca 0.92 0.29 -0.16 0.00 0.02 0.00 0.00 55.36 56.43 1m14 s GLN 763 Cb -0.39 -3.32 -0.04 0.00 1.00 0.00 0.00 33.01 30.26 1m14 s GLN 763 CO 0.39 0.47 0.41 -0.51 -2.12 0.00 0.00 175.29 173.93 1m14 s LEU 764 N -0.30 4.18 -0.26 2.90 1.43 0.45 -1.33 118.68 125.74 1m14 s LEU 764 Ca 0.21 0.56 -0.05 0.00 -1.03 0.00 0.00 54.13 53.83 1m14 s LEU 764 Cb -0.15 -2.54 0.00 0.00 0.03 0.00 0.00 46.19 43.54 1m14 s LEU 764 CO 0.09 -0.06 0.02 -0.63 0.23 0.00 0.00 176.35 176.00 1m14 s ILE 765 N 1.19 3.60 0.41 -0.59 1.09 -0.32 -0.92 121.20 125.66 1m14 s ILE 765 Ca 0.20 -0.67 0.04 0.00 -1.10 0.00 0.00 60.65 59.12 1m14 s ILE 765 Cb -0.15 -2.78 -0.04 0.00 -1.06 0.00 0.00 42.46 38.43 1m14 s ILE 765 CO 0.08 0.22 0.05 0.42 -0.10 0.00 0.00 174.94 175.61 1m14 s THR 766 N 1.47 1.19 0.20 2.92 -4.23 -0.32 -0.65 115.64 116.21 1m14 s THR 766 Ca 0.03 -2.00 -0.30 0.00 -1.18 0.00 0.00 61.69 58.24 1m14 s THR 766 Cb -0.16 -2.57 -0.08 0.00 1.34 0.00 0.00 72.50 71.03 1m14 s THR 766 CO -0.00 0.00 1.22 -1.58 -0.54 0.00 0.00 174.62 173.71 1m14 s GLN 767 N -3.81 4.47 0.09 3.99 0.74 -1.04 -0.74 119.66 123.37 1m14 s GLN 767 Ca 0.26 1.92 -0.31 0.00 0.05 0.00 0.00 55.36 57.27 1m14 s GLN 767 Cb 0.06 -3.22 -0.07 0.00 1.10 0.00 0.00 33.01 30.87 1m14 s GLN 767 CO 0.13 -0.11 1.36 -1.17 -0.55 0.00 0.00 175.29 174.95 1m14 s LEU 768 N -0.35 4.36 -0.69 3.68 2.96 -1.12 -4.47 118.68 123.05 1m14 s LEU 768 Ca 0.53 2.25 -0.03 0.00 -0.22 0.00 0.00 54.13 56.66 1m14 s LEU 768 Cb -0.34 -3.58 0.18 0.00 0.50 0.00 0.00 46.19 42.95 1m14 s LEU 768 CO 0.38 -0.63 0.52 -0.04 -1.32 0.00 0.00 176.35 175.26 1m14 s MET 769 N 1.23 2.74 0.33 1.98 -1.94 -1.26 -4.93 119.30 117.45 1m14 s MET 769 Ca 0.63 -2.73 0.11 0.00 -1.71 0.00 0.00 55.69 51.99 1m14 s MET 769 Cb -0.35 -3.78 0.97 0.00 2.01 0.00 0.00 34.83 33.68 1m14 s MET 769 CO 0.30 -1.20 1.65 -1.35 -0.01 0.00 0.00 175.02 174.41 1m14 h PRO 770 N 6.75 0.26 -0.08 2.03 0.11 -1.80 -1.79 132.00 137.47 1m14 h PRO 770 Ca 0.03 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1m14 h PRO 770 Cb 0.92 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 31.97 1m14 h PRO 770 CO 0.74 0.17 0.00 1.19 -0.21 0.00 0.00 178.00 179.89 1m14 n PHE 771 N -5.13 0.11 -4.64 0.65 3.01 -1.04 -5.03 117.46 105.39 1m14 n PHE 771 Ca 0.29 -0.05 0.00 0.00 1.01 0.00 0.00 57.45 58.69 1m14 n PHE 771 Cb 0.90 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.37 1m14 n PHE 771 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1m14 n GLY 772 N 0.77 -0.20 3.81 1.37 0.00 -0.68 -4.74 105.19 105.52 1m14 n GLY 772 Ca 0.09 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.75 1m14 n GLY 772 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m14 h LEU 774 N 0.63 0.02 0.16 0.00 5.85 -0.87 -2.53 115.31 118.57 1m14 h LEU 774 Ca -0.47 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.24 1m14 h LEU 774 Cb 1.21 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 42.24 1m14 h LEU 774 CO 0.58 0.40 -0.08 0.25 -0.34 0.00 0.00 178.44 179.25 1m14 h LEU 775 N 0.02 -0.19 -1.13 2.25 5.85 -1.79 -1.02 115.31 119.31 1m14 h LEU 775 Ca -0.00 -0.05 -0.06 0.00 0.84 0.00 0.00 57.88 58.60 1m14 h LEU 775 Cb 0.68 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1m14 h LEU 775 CO 0.05 -0.07 -0.30 0.44 -0.34 0.00 0.00 178.44 178.22 1m14 h ASP 776 N -0.29 0.00 -0.26 1.25 3.45 -1.89 -2.43 116.42 116.24 1m14 h ASP 776 Ca -0.02 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.39 1m14 h ASP 776 Cb 0.23 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.99 1m14 h ASP 776 CO 0.04 0.30 -0.01 0.22 -1.57 0.00 0.00 179.24 178.22 1m14 h TYR 777 N 0.00 0.51 -0.39 4.55 5.03 -0.98 -0.72 116.97 124.96 1m14 h TYR 777 Ca -0.00 -0.09 -0.14 0.00 2.58 0.00 0.00 58.73 61.08 1m14 h TYR 777 Cb 0.77 -0.13 -0.01 0.00 1.55 0.00 0.00 36.73 38.91 1m14 h TYR 777 CO 0.00 0.63 -0.30 -0.39 -1.32 0.00 0.00 178.16 176.79 1m14 h VAL 778 N 0.24 1.28 -0.58 1.81 -1.51 -1.06 -0.78 116.25 115.64 1m14 h VAL 778 Ca 0.07 -1.45 -0.02 0.00 -1.23 0.00 0.00 66.70 64.07 1m14 h VAL 778 Cb 0.43 1.29 -0.03 0.00 -2.13 0.00 0.00 31.29 30.86 1m14 h VAL 778 CO 0.01 0.48 0.28 0.03 -1.23 0.00 0.00 177.57 177.14 1m14 h ARG 779 N 0.72 0.84 0.00 5.19 3.08 -1.36 -0.49 114.38 122.36 1m14 h ARG 779 Ca 0.08 -0.13 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1m14 h ARG 779 Cb 0.85 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.75 1m14 h ARG 779 CO 0.07 0.69 0.00 0.93 -1.07 0.00 0.00 179.97 180.59 1m14 h GLU 780 N 0.79 0.00 0.00 0.04 4.39 -1.03 -3.33 114.58 115.44 1m14 h GLU 780 Ca 0.20 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 1m14 h GLU 780 Cb 0.13 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1m14 h GLU 780 CO -0.02 0.00 -0.02 0.72 -1.16 0.00 0.00 179.01 178.52 1m14 n HIS 781 N -2.62 0.00 -0.20 4.33 8.25 -0.31 -4.90 115.22 119.77 1m14 n HIS 781 Ca 0.04 -0.72 -0.05 0.00 -0.26 0.00 0.00 57.72 56.73 1m14 n HIS 781 Cb 0.44 -0.10 -0.05 0.00 1.12 0.00 0.00 29.99 31.40 1m14 n HIS 781 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1m14 n LYS 782 N -0.95 -0.21 0.00 -0.41 5.02 -0.22 -0.29 118.16 121.09 1m14 n LYS 782 Ca 0.08 0.75 0.04 0.00 -2.02 0.00 0.00 58.31 57.16 1m14 n LYS 782 Cb 0.48 -1.11 0.22 0.00 -0.02 0.00 0.00 35.03 34.61 1m14 n LYS 782 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1m14 n ASP 783 N -4.55 0.00 -0.03 4.39 8.00 -1.26 -2.47 116.55 120.63 1m14 n ASP 783 Ca 0.01 -0.34 0.00 0.00 0.71 0.00 0.00 54.79 55.17 1m14 n ASP 783 Cb 0.13 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.23 1m14 n ASP 783 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1m14 n ASN 784 N -0.91 0.82 -4.43 -2.24 3.02 0.60 -4.95 115.26 107.17 1m14 n ASN 784 Ca 0.06 -1.49 -0.41 0.00 -0.03 0.00 0.00 54.58 52.70 1m14 n ASN 784 Cb 0.03 -0.03 -0.11 0.00 -0.61 0.00 0.00 39.78 39.06 1m14 n ASN 784 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1m14 s ILE 785 N -0.47 4.90 0.64 2.41 1.01 -1.03 -5.06 121.20 123.60 1m14 s ILE 785 Ca 0.01 -0.66 0.01 0.00 0.00 0.00 0.00 60.65 60.01 1m14 s ILE 785 Cb 0.01 -3.68 0.08 0.00 0.01 0.00 0.00 42.46 38.88 1m14 s ILE 785 CO 0.00 -0.20 0.88 -0.83 0.00 0.00 0.00 174.94 174.79 1m14 s GLY 786 N 1.62 1.79 0.50 6.18 0.00 -1.26 -4.84 107.32 111.31 1m14 s GLY 786 Ca 0.04 -1.58 0.15 0.00 0.00 0.00 0.00 44.72 43.33 1m14 s GLY 786 CO 0.08 -1.15 2.11 1.48 0.00 0.00 0.00 173.10 175.62 1m14 h SER 787 N -0.22 0.10 -0.56 1.64 4.64 -1.92 -2.75 113.55 114.48 1m14 h SER 787 Ca -0.38 -0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.85 1m14 h SER 787 Cb 1.28 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 63.33 1m14 h SER 787 CO 0.45 0.07 0.02 -0.61 -0.87 0.00 0.00 176.83 175.90 1m14 h GLN 788 N 0.11 0.97 -0.17 4.77 5.75 -1.94 -1.89 115.11 122.71 1m14 h GLN 788 Ca 0.07 -0.30 -0.05 0.00 -0.15 0.00 0.00 58.65 58.22 1m14 h GLN 788 Cb 0.14 -0.09 -0.00 0.00 1.07 0.00 0.00 27.48 28.59 1m14 h GLN 788 CO -0.01 0.96 -0.10 1.88 -2.65 0.00 0.00 178.83 178.91 1m14 h TYR 789 N 0.86 0.43 -0.27 3.99 0.05 -1.88 -0.97 116.97 119.17 1m14 h TYR 789 Ca 0.16 -0.11 0.03 0.00 0.05 0.00 0.00 58.73 58.86 1m14 h TYR 789 Cb 0.51 -0.10 -0.03 0.00 1.01 0.00 0.00 36.73 38.13 1m14 h TYR 789 CO 0.04 0.70 0.10 -0.07 -1.05 0.00 0.00 178.16 177.88 1m14 h LEU 790 N 0.03 0.12 -0.55 3.88 3.38 -1.47 -0.94 115.31 119.77 1m14 h LEU 790 Ca 0.03 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 1m14 h LEU 790 Cb 0.60 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1m14 h LEU 790 CO 0.03 0.10 -0.28 -0.07 0.09 0.00 0.00 178.44 178.32 1m14 h LEU 791 N 0.23 0.91 -1.29 1.67 3.38 -1.35 -2.45 115.31 116.41 1m14 h LEU 791 Ca 0.12 -0.36 -0.06 0.00 0.09 0.00 0.00 57.88 57.66 1m14 h LEU 791 Cb 0.08 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1m14 h LEU 791 CO -0.11 1.12 -0.19 0.78 0.09 0.00 0.00 178.44 180.12 1m14 h ASN 792 N 0.75 0.23 -0.22 -0.43 2.35 -0.94 -2.03 115.58 115.28 1m14 h ASN 792 Ca 0.09 -0.06 -0.14 0.00 -0.55 0.00 0.00 56.30 55.64 1m14 h ASN 792 Cb 0.83 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.13 1m14 h ASN 792 CO 0.07 0.44 -0.35 -0.50 -1.65 0.00 0.00 177.43 175.44 1m14 h TRP 793 N 0.22 0.87 -0.49 1.19 6.55 -0.83 -1.68 115.95 121.78 1m14 h TRP 793 Ca 0.04 -0.24 -0.04 0.00 0.95 0.00 0.00 58.89 59.60 1m14 h TRP 793 Cb 0.48 -0.19 -0.02 0.00 -0.86 0.00 0.00 29.16 28.56 1m14 h TRP 793 CO 0.01 0.99 0.14 0.00 -1.05 0.00 0.00 178.44 178.52 1m14 h VAL 795 N 0.72 1.17 -0.58 0.00 2.07 -1.02 -2.42 116.25 116.19 1m14 h VAL 795 Ca 0.16 -0.92 0.05 0.00 0.82 0.00 0.00 66.70 66.81 1m14 h VAL 795 Cb 0.24 1.76 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 1m14 h VAL 795 CO -0.01 0.23 0.32 1.56 0.02 0.00 0.00 177.57 179.69 1m14 h GLN 796 N -0.52 0.59 -0.37 1.57 4.20 -1.12 0.15 115.11 119.62 1m14 h GLN 796 Ca -0.01 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 1m14 h GLN 796 Cb 0.44 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 28.07 1m14 h GLN 796 CO 0.02 0.39 -0.09 0.82 -0.67 0.00 0.00 178.83 179.29 1m14 h ILE 797 N 0.61 1.24 -0.26 2.54 2.04 -1.24 -0.63 117.51 121.80 1m14 h ILE 797 Ca 0.25 -1.05 -0.15 0.00 1.00 0.00 0.00 64.86 64.91 1m14 h ILE 797 Cb 0.13 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.27 1m14 h ILE 797 CO -0.16 0.35 -0.44 0.00 0.00 0.00 0.00 178.15 177.91 1m14 h ALA 798 N 1.32 0.74 -0.28 1.87 0.00 -0.70 -1.65 119.26 120.56 1m14 h ALA 798 Ca 0.11 -0.46 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 1m14 h ALA 798 Cb 0.51 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1m14 h ALA 798 CO 0.03 0.66 0.11 0.87 0.00 0.00 0.00 179.25 180.92 1m14 h LYS 799 N 0.53 0.42 -0.63 0.00 1.57 -0.32 0.07 116.57 118.21 1m14 h LYS 799 Ca 0.04 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1m14 h LYS 799 Cb 0.97 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 33.19 1m14 h LYS 799 CO 0.09 0.46 0.41 0.78 -0.57 0.00 0.00 179.45 180.62 1m14 h GLY 800 N 0.30 0.89 1.26 3.86 0.00 -0.98 -1.80 103.07 106.59 1m14 h GLY 800 Ca 0.09 -0.34 -0.14 0.00 0.00 0.00 0.00 47.33 46.94 1m14 h GLY 800 CO -0.01 0.33 -0.34 -0.33 0.00 0.00 0.00 176.54 176.19 1m14 h MET 801 N 0.86 0.83 -0.41 4.80 2.86 -1.14 -1.83 114.93 120.89 1m14 h MET 801 Ca 0.23 -0.40 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 1m14 h MET 801 Cb -0.09 -0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.55 1m14 h MET 801 CO -0.05 1.04 0.20 -0.97 1.06 0.00 0.00 176.91 178.19 1m14 h ASN 802 N 0.69 0.51 -0.34 1.22 -1.24 -0.64 -0.97 115.58 114.80 1m14 h ASN 802 Ca 0.07 -0.04 -0.07 0.00 0.71 0.00 0.00 56.30 56.97 1m14 h ASN 802 Cb 0.90 -0.13 -0.01 0.00 0.73 0.00 0.00 38.32 39.81 1m14 h ASN 802 CO 0.08 0.44 -0.05 0.22 -1.29 0.00 0.00 177.43 176.82 1m14 h TYR 803 N 0.57 0.72 -0.08 0.67 3.20 -1.01 -1.04 116.97 120.00 1m14 h TYR 803 Ca 0.15 -0.14 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1m14 h TYR 803 Cb 0.06 -0.18 -0.00 0.00 1.54 0.00 0.00 36.73 38.15 1m14 h TYR 803 CO 0.00 0.79 0.03 -0.07 -1.64 0.00 0.00 178.16 177.27 1m14 h LEU 804 N 0.44 0.09 -0.17 2.82 3.38 -0.39 -1.90 115.31 119.57 1m14 h LEU 804 Ca 0.09 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.89 1m14 h LEU 804 Cb 0.54 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1m14 h LEU 804 CO 0.03 0.08 -0.54 -0.08 0.09 0.00 0.00 178.44 178.02 1m14 h GLU 805 N 0.10 0.67 -0.92 1.13 4.81 -0.51 0.27 114.58 120.13 1m14 h GLU 805 Ca 0.03 -0.49 0.07 0.00 -0.13 0.00 0.00 59.36 58.84 1m14 h GLU 805 Cb 0.02 0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.42 1m14 h GLU 805 CO -0.00 1.11 0.60 -0.44 -0.73 0.00 0.00 179.01 179.54 1m14 h ASP 806 N 0.35 0.92 -0.24 1.04 3.45 -0.56 -0.80 116.42 120.58 1m14 h ASP 806 Ca -0.02 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.45 1m14 h ASP 806 Cb 1.16 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 39.74 1m14 h ASP 806 CO 0.11 0.58 0.00 0.54 -1.57 0.00 0.00 179.24 178.90 1m14 n ARG 807 N -4.50 2.04 -3.88 3.56 5.12 -0.78 -4.90 116.66 113.32 1m14 n ARG 807 Ca 0.14 -1.06 -0.28 0.00 -1.93 0.00 0.00 57.85 54.72 1m14 n ARG 807 Cb 0.22 -1.51 0.03 0.00 -1.16 0.00 0.00 32.46 30.04 1m14 n ARG 807 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1m14 n ARG 808 N 0.26 -5.38 -4.42 5.56 1.74 -0.30 -4.86 116.66 109.25 1m14 n ARG 808 Ca 0.10 0.60 -0.33 0.00 -0.77 0.00 0.00 57.85 57.44 1m14 n ARG 808 Cb 0.42 -5.41 -0.15 0.00 -1.02 0.00 0.00 32.46 26.30 1m14 n ARG 808 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1m14 s LEU 809 N -7.16 2.45 -0.32 0.55 2.96 0.93 -1.32 118.68 116.76 1m14 s LEU 809 Ca 0.52 -0.49 -0.12 0.00 -0.22 0.00 0.00 54.13 53.82 1m14 s LEU 809 Cb -0.26 -1.56 -0.03 0.00 0.50 0.00 0.00 46.19 44.84 1m14 s LEU 809 CO 0.83 0.06 0.22 -0.69 -1.32 0.00 0.00 176.35 175.45 1m14 s VAL 810 N 0.95 5.22 0.08 1.68 1.01 -0.65 -4.29 120.40 124.40 1m14 s VAL 810 Ca -0.03 -0.13 -0.21 0.00 0.00 0.00 0.00 61.98 61.60 1m14 s VAL 810 Cb -0.15 -3.62 -0.11 0.00 0.00 0.00 0.00 36.38 32.50 1m14 s VAL 810 CO -0.02 0.07 1.64 -0.74 0.00 0.00 0.00 175.10 176.05 1m14 h HIS 811 N 8.44 0.19 0.00 5.22 2.76 -1.91 -1.66 115.15 128.19 1m14 h HIS 811 Ca -0.32 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 57.84 1m14 h HIS 811 Cb 1.17 -0.06 0.00 0.00 1.55 0.00 0.00 27.41 30.07 1m14 h HIS 811 CO 0.69 0.25 0.00 0.54 -1.30 0.00 0.00 177.93 178.10 1m14 n ARG 812 N -4.92 0.00 -2.49 5.26 1.74 -1.26 -3.10 116.66 111.89 1m14 n ARG 812 Ca -0.05 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.03 1m14 n ARG 812 Cb 0.10 -3.65 0.05 0.00 -1.02 0.00 0.00 32.46 27.94 1m14 n ARG 812 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1m14 n ASP 813 N 0.00 1.12 -4.70 0.55 2.03 -1.26 -4.89 116.55 109.39 1m14 n ASP 813 Ca 0.00 -2.03 -0.42 0.00 0.52 0.00 0.00 54.79 52.86 1m14 n ASP 813 Cb 0.00 -0.32 -0.03 0.00 -0.72 0.00 0.00 41.12 40.05 1m14 n ASP 813 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 1m14 s LEU 814 N -2.92 4.33 -0.00 -2.67 2.96 -1.26 -4.78 118.68 114.34 1m14 s LEU 814 Ca 0.26 1.92 -0.29 0.00 -0.22 0.00 0.00 54.13 55.80 1m14 s LEU 814 Cb 0.34 -3.57 0.10 0.00 0.50 0.00 0.00 46.19 43.56 1m14 s LEU 814 CO -0.07 -0.52 0.92 0.00 -1.32 0.00 0.00 176.35 175.36 1m14 s ALA 815 N 1.59 -1.83 0.54 5.97 0.00 -1.26 -4.72 121.76 122.05 1m14 s ALA 815 Ca 0.57 0.97 0.27 0.00 0.00 0.00 0.00 51.96 53.78 1m14 s ALA 815 Cb -0.27 0.40 1.44 0.00 0.00 0.00 0.00 23.12 24.69 1m14 s ALA 815 CO 0.26 -0.72 1.97 0.00 0.00 0.00 0.00 175.76 177.27 1m14 h ALA 816 N 2.00 2.50 0.00 0.00 0.00 -1.92 0.13 119.26 121.96 1m14 h ALA 816 Ca -0.22 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1m14 h ALA 816 Cb 1.24 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.07 1m14 h ALA 816 CO 0.30 -0.74 -0.07 0.07 0.00 0.00 0.00 179.25 178.81 1m14 h ARG 817 N 0.00 0.00 -0.98 0.00 0.11 -1.95 -3.00 114.38 108.56 1m14 h ARG 817 Ca 0.28 0.00 -0.52 0.00 0.10 0.00 0.00 59.98 59.83 1m14 h ARG 817 Cb 1.16 0.00 -0.30 0.00 1.11 0.00 0.00 29.97 31.94 1m14 h ARG 817 CO -0.00 0.07 0.65 0.09 0.10 0.00 0.00 179.97 180.88 1m14 n ASN 818 N -3.18 4.04 -3.90 0.08 3.02 0.44 -4.75 115.26 111.00 1m14 n ASN 818 Ca 0.01 -3.63 -0.24 0.00 -0.03 0.00 0.00 54.58 50.69 1m14 n ASN 818 Cb 0.37 -0.84 -0.17 0.00 -0.61 0.00 0.00 39.78 38.53 1m14 n ASN 818 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1m14 s VAL 819 N -3.43 0.79 0.24 2.41 1.01 -1.18 -1.20 120.40 119.05 1m14 s VAL 819 Ca 0.57 -0.21 0.06 0.00 0.00 0.00 0.00 61.98 62.40 1m14 s VAL 819 Cb 0.48 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 36.01 1m14 s VAL 819 CO 0.10 0.30 0.26 -0.76 0.00 0.00 0.00 175.10 175.00 1m14 s LEU 820 N 1.29 4.04 -0.32 3.92 1.43 0.98 -0.50 118.68 129.52 1m14 s LEU 820 Ca -0.04 -0.09 -0.04 0.00 -1.03 0.00 0.00 54.13 52.93 1m14 s LEU 820 Cb -0.14 -2.58 0.04 0.00 0.03 0.00 0.00 46.19 43.54 1m14 s LEU 820 CO -0.03 -0.04 0.04 -0.69 0.23 0.00 0.00 176.35 175.87 1m14 s VAL 821 N -2.03 3.33 0.06 -1.59 1.01 0.75 -1.36 120.40 120.58 1m14 s VAL 821 Ca 0.33 -1.27 -0.11 0.00 0.00 0.00 0.00 61.98 60.93 1m14 s VAL 821 Cb -0.09 -2.90 -0.31 0.00 0.00 0.00 0.00 36.38 33.08 1m14 s VAL 821 CO 0.27 -0.13 1.09 0.50 0.00 0.00 0.00 175.10 176.82 1m14 h LYS 822 N 8.09 0.47 -3.24 2.72 3.64 -1.54 -2.77 116.57 123.94 1m14 h LYS 822 Ca -0.22 -0.73 -0.02 0.00 -1.27 0.00 0.00 60.65 58.40 1m14 h LYS 822 Cb 1.07 0.26 -0.11 0.00 -0.41 0.00 0.00 32.23 33.05 1m14 h LYS 822 CO 0.56 1.34 0.06 0.95 -2.27 0.00 0.00 179.45 180.09 1m14 s THR 823 N -2.74 0.03 0.66 1.00 -4.23 -1.10 -4.54 115.64 104.72 1m14 s THR 823 Ca -0.07 -0.58 0.40 0.00 -1.18 0.00 0.00 61.69 60.26 1m14 s THR 823 Cb 0.06 -1.39 0.41 0.00 1.34 0.00 0.00 72.50 72.92 1m14 s THR 823 CO 0.92 -0.13 2.26 -0.65 -0.54 0.00 0.00 174.62 176.48 1m14 h PRO 824 N 2.18 0.00 -0.35 3.99 0.11 -2.01 -1.00 132.00 134.92 1m14 h PRO 824 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1m14 h PRO 824 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1m14 h PRO 824 CO 0.39 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.18 1m14 n GLN 825 N -3.11 2.36 -3.46 1.05 0.00 -1.26 -4.89 117.38 108.07 1m14 n GLN 825 Ca -0.03 -2.17 -0.15 0.00 0.00 0.00 0.00 57.00 54.65 1m14 n GLN 825 Cb 0.15 -1.46 -0.11 0.00 0.00 0.00 0.00 30.24 28.82 1m14 n GLN 825 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.06 175.48 1m14 s HIS 826 N -1.37 -0.44 0.31 2.61 5.04 -0.38 -5.02 115.29 116.05 1m14 s HIS 826 Ca 0.35 0.42 0.10 0.00 -1.54 0.00 0.00 55.06 54.38 1m14 s HIS 826 Cb 0.20 -0.24 -0.05 0.00 0.04 0.00 0.00 32.58 32.53 1m14 s HIS 826 CO 0.28 -0.63 -0.05 0.14 -2.34 0.00 0.00 174.74 172.15 1m14 s VAL 827 N 2.39 2.70 -0.04 0.89 -7.23 -1.26 -1.39 120.40 116.46 1m14 s VAL 827 Ca 0.08 -2.08 -0.07 0.00 -1.81 0.00 0.00 61.98 58.10 1m14 s VAL 827 Cb -0.16 -2.68 0.01 0.00 0.56 0.00 0.00 36.38 34.12 1m14 s VAL 827 CO -0.13 -0.27 0.17 -0.54 -0.31 0.00 0.00 175.10 174.02 1m14 s LYS 828 N -3.65 0.31 0.29 4.82 1.02 -0.46 -4.60 119.74 117.47 1m14 s LYS 828 Ca 0.33 0.03 -0.28 0.00 0.02 0.00 0.00 55.97 56.07 1m14 s LYS 828 Cb -0.02 0.14 -0.09 0.00 -0.52 0.00 0.00 37.83 37.33 1m14 s LYS 828 CO 0.18 -0.06 0.96 0.42 -0.92 0.00 0.00 175.35 175.94 1m14 s ILE 829 N -0.41 4.06 0.00 2.17 1.01 -0.51 -0.02 121.20 127.50 1m14 s ILE 829 Ca -0.05 1.87 0.00 0.00 0.00 0.00 0.00 60.65 62.47 1m14 s ILE 829 Cb -0.03 -4.11 0.00 0.00 0.01 0.00 0.00 42.46 38.32 1m14 s ILE 829 CO 0.01 0.30 0.00 1.07 0.00 0.00 0.00 174.94 176.31 1m14 n THR 830 N 0.95 0.00 -2.96 2.92 5.66 -0.34 -0.50 114.28 120.02 1m14 n THR 830 Ca 0.00 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 60.88 1m14 n THR 830 Cb 0.48 0.00 0.01 0.00 -1.55 0.00 0.00 70.33 69.28 1m14 n THR 830 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 1m14 n ASP 831 N -1.55 -7.55 -1.88 1.09 -0.08 -1.26 -4.85 116.55 100.46 1m14 n ASP 831 Ca 0.00 0.47 -0.01 0.00 -1.51 0.00 0.00 54.79 53.74 1m14 n ASP 831 Cb 0.00 -4.75 0.32 0.00 2.34 0.00 0.00 41.12 39.04 1m14 n ASP 831 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1m14 n PHE 832 N -0.21 2.17 0.44 -0.67 3.72 -1.26 -4.56 117.46 117.09 1m14 n PHE 832 Ca 0.08 -0.95 0.04 0.00 -0.05 0.00 0.00 57.45 56.57 1m14 n PHE 832 Cb 0.47 -0.59 0.22 0.00 -0.94 0.00 0.00 39.48 38.65 1m14 n PHE 832 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1m14 n GLY 833 N 0.17 -0.43 0.00 1.37 0.00 -1.26 -2.17 105.19 102.86 1m14 n GLY 833 Ca 0.33 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1m14 n GLY 833 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1m14 n LEU 834 N -1.17 0.21 -4.76 0.99 4.32 -1.26 -5.04 117.00 110.29 1m14 n LEU 834 Ca 0.05 -0.24 -0.40 0.00 -0.02 0.00 0.00 56.01 55.40 1m14 n LEU 834 Cb 0.05 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 41.86 1m14 n LEU 834 CO 0.06 0.05 1.07 0.00 -1.22 0.00 0.00 177.39 177.34 1m14 n ALA 835 N -0.06 2.04 -3.48 -1.18 0.00 -0.92 -4.72 120.51 112.19 1m14 n ALA 835 Ca 0.00 0.28 -0.21 0.00 0.00 0.00 0.00 53.44 53.51 1m14 n ALA 835 Cb 0.14 -2.38 -0.16 0.00 0.00 0.00 0.00 19.45 17.04 1m14 n ALA 835 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1m14 s LYS 836 N -2.32 1.06 -0.07 0.00 -0.14 -0.63 -4.99 119.74 112.65 1m14 s LYS 836 Ca 0.59 -0.22 -0.26 0.00 -1.36 0.00 0.00 55.97 54.73 1m14 s LYS 836 Cb -0.46 -0.98 -0.03 0.00 -1.68 0.00 0.00 37.83 34.68 1m14 s LYS 836 CO 0.59 -0.02 0.81 -0.51 -0.76 0.00 0.00 175.35 175.46 1m14 s LEU 837 N 0.70 4.30 0.14 3.17 1.43 -1.26 -1.63 118.68 125.52 1m14 s LEU 837 Ca -0.11 1.31 -0.13 0.00 -1.03 0.00 0.00 54.13 54.17 1m14 s LEU 837 Cb -0.14 -3.25 -0.07 0.00 0.03 0.00 0.00 46.19 42.77 1m14 s LEU 837 CO 0.01 -0.22 0.52 -0.76 0.23 0.00 0.00 176.35 176.13 1m14 s LEU 838 N 1.18 4.33 0.00 1.79 1.43 -0.44 -5.01 118.68 121.96 1m14 s LEU 838 Ca 0.42 1.01 0.00 0.00 -1.03 0.00 0.00 54.13 54.53 1m14 s LEU 838 Cb -0.18 -3.23 0.00 0.00 0.03 0.00 0.00 46.19 42.81 1m14 s LEU 838 CO 0.19 0.11 0.00 0.61 0.23 0.00 0.00 176.35 177.49 1m14 n GLY 839 N 0.79 -2.45 0.13 -3.19 0.00 -1.26 -4.75 105.19 94.46 1m14 n GLY 839 Ca -0.06 -1.36 -0.21 0.00 0.00 0.00 0.00 46.02 44.40 1m14 n GLY 839 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1m14 n ALA 840 N -3.00 1.10 0.34 4.61 0.00 -1.26 -4.21 120.51 118.09 1m14 n ALA 840 Ca 0.00 -0.81 0.07 0.00 0.00 0.00 0.00 53.44 52.69 1m14 n ALA 840 Cb 0.00 -0.39 0.22 0.00 0.00 0.00 0.00 19.45 19.28 1m14 n ALA 840 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1m14 n GLU 841 N -3.57 2.43 -4.16 0.00 -0.58 -1.26 -4.89 120.64 108.62 1m14 n GLU 841 Ca -0.39 -1.74 -0.28 0.00 -0.42 0.00 0.00 57.16 54.33 1m14 n GLU 841 Cb 0.98 -1.53 -0.08 0.00 -0.57 0.00 0.00 31.44 30.24 1m14 n GLU 841 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 1m14 s GLU 842 N -1.58 2.51 0.00 3.49 2.12 -1.26 -5.02 118.70 118.96 1m14 s GLU 842 Ca 0.32 -0.97 0.00 0.00 0.36 0.00 0.00 54.97 54.68 1m14 s GLU 842 Cb 0.19 -2.46 0.00 0.00 0.26 0.00 0.00 34.13 32.11 1m14 s GLU 842 CO 0.18 0.49 0.02 0.36 -0.54 0.00 0.00 175.26 175.77 1m14 n LYS 843 N 0.15 0.94 -3.66 4.30 2.85 -1.26 -4.71 118.16 116.77 1m14 n LYS 843 Ca -0.10 -0.02 -0.13 0.00 -1.05 0.00 0.00 58.31 57.01 1m14 n LYS 843 Cb 0.54 -0.19 -0.08 0.00 -0.65 0.00 0.00 35.03 34.65 1m14 n LYS 843 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 177.40 175.52 1m14 s GLU 844 N -0.14 0.72 -0.16 -1.58 -1.05 -1.26 -4.79 118.70 110.43 1m14 s GLU 844 Ca 0.00 0.88 -0.18 0.00 -0.15 0.00 0.00 54.97 55.51 1m14 s GLU 844 Cb 0.00 0.34 -0.04 0.00 -0.44 0.00 0.00 34.13 33.99 1m14 s GLU 844 CO 0.00 -0.09 0.51 -0.47 0.95 0.00 0.00 175.26 176.15 1m14 s TYR 845 N 0.41 3.44 -0.54 4.83 5.04 -0.47 -4.90 117.35 125.16 1m14 s TYR 845 Ca -0.01 0.84 -0.16 0.00 -2.44 0.00 0.00 57.07 55.30 1m14 s TYR 845 Cb -0.04 -2.62 0.12 0.00 0.35 0.00 0.00 41.96 39.77 1m14 s TYR 845 CO -0.00 0.02 0.51 -1.01 -1.34 0.00 0.00 175.55 173.73 1m14 s HIS 846 N 1.17 3.23 1.05 4.97 3.76 -1.26 -2.19 115.29 126.02 1m14 s HIS 846 Ca 0.25 -1.24 -0.13 0.00 -0.15 0.00 0.00 55.06 53.79 1m14 s HIS 846 Cb -0.15 -3.78 0.22 0.00 1.11 0.00 0.00 32.58 29.97 1m14 s HIS 846 CO 0.10 -1.03 1.08 0.00 -0.85 0.00 0.00 174.74 174.05 1m14 s ALA 847 N 1.69 0.67 0.00 -1.40 0.00 -0.99 -5.01 121.76 116.72 1m14 s ALA 847 Ca 0.04 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.59 1m14 s ALA 847 Cb -0.29 -3.11 0.00 0.00 0.00 0.00 0.00 23.12 19.72 1m14 s ALA 847 CO 0.04 -3.08 0.00 -1.91 0.00 0.00 0.00 175.76 170.80 1m14 n GLU 848 N -4.35 1.39 0.00 0.00 4.07 -1.26 -4.97 120.64 115.51 1m14 n GLU 848 Ca 0.05 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.15 1m14 n GLU 848 Cb 0.57 -0.41 0.00 0.00 -0.06 0.00 0.00 31.44 31.55 1m14 n GLU 848 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1m14 n GLY 849 N 0.22 -0.85 0.00 8.31 0.00 -1.26 -5.08 105.19 106.53 1m14 n GLY 849 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1m14 n GLY 849 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1m14 n GLY 850 N 1.80 -0.23 0.87 -0.02 0.00 -1.26 -5.08 105.19 101.28 1m14 n GLY 850 Ca 0.00 0.05 -0.04 0.00 0.00 0.00 0.00 46.02 46.04 1m14 n GLY 850 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1m14 n LYS 851 N 0.00 0.00 -3.27 1.61 2.85 -1.26 -5.12 118.16 112.97 1m14 n LYS 851 Ca 0.00 -0.79 -0.38 0.00 -1.05 0.00 0.00 58.31 56.08 1m14 n LYS 851 Cb 0.00 0.26 -0.06 0.00 -0.65 0.00 0.00 35.03 34.58 1m14 n LYS 851 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1m14 s VAL 852 N 0.00 4.73 -0.22 0.58 1.01 -1.26 -5.01 120.40 120.24 1m14 s VAL 852 Ca 0.03 1.21 -0.29 0.00 0.00 0.00 0.00 61.98 62.94 1m14 s VAL 852 Cb 0.03 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.48 1m14 s VAL 852 CO -0.02 0.53 1.85 -2.16 0.00 0.00 0.00 175.10 175.31 1m14 s PRO 853 N -1.16 3.56 0.31 2.72 0.04 -1.26 -4.91 135.00 134.29 1m14 s PRO 853 Ca 0.30 1.80 0.01 0.00 0.04 0.00 0.00 61.00 63.16 1m14 s PRO 853 Cb -0.19 -4.18 0.50 0.00 0.04 0.00 0.00 34.50 30.67 1m14 s PRO 853 CO 0.19 -1.60 1.85 0.82 0.04 0.00 0.00 177.00 178.30 1m14 h ILE 854 N 6.50 1.21 0.00 0.56 2.04 -1.95 -3.09 117.51 122.79 1m14 h ILE 854 Ca -0.37 -0.79 0.00 0.00 1.00 0.00 0.00 64.86 64.69 1m14 h ILE 854 Cb 1.19 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.07 1m14 h ILE 854 CO 0.99 0.29 0.00 0.29 0.00 0.00 0.00 178.15 179.72 1m14 n LYS 855 N -4.28 0.28 -0.00 2.37 5.02 -1.26 -2.07 118.16 118.23 1m14 n LYS 855 Ca 0.03 0.11 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 1m14 n LYS 855 Cb 0.23 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 1m14 n LYS 855 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1m14 n TRP 856 N -1.21 0.00 -4.05 2.13 8.01 -1.17 -4.96 117.44 116.19 1m14 n TRP 856 Ca 0.08 -0.17 -0.26 0.00 -1.31 0.00 0.00 57.50 55.84 1m14 n TRP 856 Cb 0.10 -0.02 -0.05 0.00 -2.01 0.00 0.00 31.31 29.33 1m14 n TRP 856 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1m14 s MET 857 N -0.35 3.03 0.82 -0.99 0.23 -0.88 -3.74 119.30 117.44 1m14 s MET 857 Ca 0.00 -0.82 -0.11 0.00 -1.03 0.00 0.00 55.69 53.74 1m14 s MET 857 Cb 0.00 -2.72 0.09 0.00 -1.53 0.00 0.00 34.83 30.67 1m14 s MET 857 CO 0.00 0.49 1.12 0.00 -2.03 0.00 0.00 175.02 174.60 1m14 s ALA 858 N -1.78 1.93 0.14 3.16 0.00 -1.26 -4.91 121.76 119.04 1m14 s ALA 858 Ca 0.32 0.45 -0.13 0.00 0.00 0.00 0.00 51.96 52.59 1m14 s ALA 858 Cb -0.10 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 1m14 s ALA 858 CO 0.25 -2.17 1.56 1.25 0.00 0.00 0.00 175.76 176.65 1m14 h LEU 859 N -1.35 0.80 -2.83 0.00 5.85 -1.97 -2.55 115.31 113.26 1m14 h LEU 859 Ca -0.44 -0.33 -0.00 0.00 0.84 0.00 0.00 57.88 57.95 1m14 h LEU 859 Cb 1.25 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 42.06 1m14 h LEU 859 CO 0.47 0.94 -0.00 1.05 -0.34 0.00 0.00 178.44 180.56 1m14 h GLU 860 N 0.64 0.00 0.11 1.25 4.11 -1.91 -1.03 114.58 117.75 1m14 h GLU 860 Ca 0.12 0.00 -0.30 0.00 0.07 0.00 0.00 59.36 59.24 1m14 h GLU 860 Cb 0.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1m14 h GLU 860 CO 0.03 0.00 -1.53 0.77 0.07 0.00 0.00 179.01 178.35 1m14 h SER 861 N 0.00 0.37 -0.04 3.06 0.02 -1.57 -2.44 113.55 112.95 1m14 h SER 861 Ca -0.00 -0.52 -0.21 0.00 -0.84 0.00 0.00 61.79 60.22 1m14 h SER 861 Cb 0.05 -0.12 0.01 0.00 0.14 0.00 0.00 62.40 62.48 1m14 h SER 861 CO 0.00 1.43 -0.80 0.40 -1.14 0.00 0.00 176.83 176.72 1m14 h ILE 862 N 0.06 1.33 0.11 3.27 2.04 -1.10 -1.15 117.51 122.08 1m14 h ILE 862 Ca -0.24 -2.09 -0.27 0.00 1.00 0.00 0.00 64.86 63.26 1m14 h ILE 862 Cb 2.01 2.34 -0.00 0.00 -0.74 0.00 0.00 36.82 40.43 1m14 h ILE 862 CO 0.16 0.64 -1.24 -0.07 0.00 0.00 0.00 178.15 177.63 1m14 h LEU 863 N 0.25 0.38 -1.56 1.44 -0.00 -1.38 -3.40 115.31 111.03 1m14 h LEU 863 Ca -0.09 -0.41 0.00 0.00 -0.00 0.00 0.00 57.88 57.38 1m14 h LEU 863 Cb 1.47 -0.12 0.00 0.00 -0.00 0.00 0.00 40.66 42.00 1m14 h LEU 863 CO 0.16 1.32 0.00 1.41 -0.00 0.00 0.00 178.44 181.33 1m14 n HIS 864 N -3.50 0.00 -2.32 1.13 8.25 -0.93 -5.02 115.22 112.82 1m14 n HIS 864 Ca -0.08 -0.17 -0.17 0.00 -0.26 0.00 0.00 57.72 57.04 1m14 n HIS 864 Cb 1.02 -0.02 -0.01 0.00 1.12 0.00 0.00 29.99 32.10 1m14 n HIS 864 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1m14 n ARG 865 N -0.17 -1.88 -3.33 -0.41 1.74 -0.43 -4.89 116.66 107.28 1m14 n ARG 865 Ca 0.00 0.84 -0.32 0.00 -0.77 0.00 0.00 57.85 57.59 1m14 n ARG 865 Cb 0.34 -5.44 -0.06 0.00 -1.02 0.00 0.00 32.46 26.29 1m14 n ARG 865 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1m14 s ILE 866 N -2.80 4.85 -0.10 0.55 1.01 -1.13 -2.34 121.20 121.25 1m14 s ILE 866 Ca 0.00 0.64 -0.04 0.00 0.00 0.00 0.00 60.65 61.25 1m14 s ILE 866 Cb 0.00 -3.63 0.05 0.00 0.01 0.00 0.00 42.46 38.89 1m14 s ILE 866 CO 0.00 -0.07 0.21 -0.31 0.00 0.00 0.00 174.94 174.77 1m14 s TYR 867 N -1.83 -0.28 0.32 3.97 2.02 -0.93 -3.85 117.35 116.77 1m14 s TYR 867 Ca 0.48 0.72 0.04 0.00 -0.37 0.00 0.00 57.07 57.95 1m14 s TYR 867 Cb -0.11 -0.07 -0.03 0.00 -0.40 0.00 0.00 41.96 41.34 1m14 s TYR 867 CO 0.20 -0.25 0.20 0.95 -1.57 0.00 0.00 175.55 175.07 1m14 s THR 868 N 1.74 0.22 0.34 -0.71 -4.23 -1.26 -1.37 115.64 110.36 1m14 s THR 868 Ca -0.04 -2.00 0.03 0.00 -1.18 0.00 0.00 61.69 58.50 1m14 s THR 868 Cb -0.11 -2.48 0.21 0.00 1.34 0.00 0.00 72.50 71.46 1m14 s THR 868 CO -0.07 0.00 1.94 0.45 -0.54 0.00 0.00 174.62 176.39 1m14 h HIS 869 N 2.15 0.67 0.00 3.99 3.86 -1.93 -1.07 115.15 122.81 1m14 h HIS 869 Ca -0.31 -0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 58.85 1m14 h HIS 869 Cb 1.25 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 29.50 1m14 h HIS 869 CO 1.31 0.52 -0.11 1.96 0.86 0.00 0.00 177.93 182.47 1m14 h GLN 870 N 0.67 0.00 0.00 2.45 1.08 -1.94 0.15 115.11 117.52 1m14 h GLN 870 Ca 0.16 0.00 -0.19 0.00 -1.45 0.00 0.00 58.65 57.18 1m14 h GLN 870 Cb 0.13 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.54 1m14 h GLN 870 CO -0.02 0.11 -0.86 1.03 -0.95 0.00 0.00 178.83 178.14 1m14 h SER 871 N 0.00 0.09 0.39 1.46 0.87 -1.59 -2.91 113.55 111.86 1m14 h SER 871 Ca -0.00 -0.07 -0.09 0.00 -1.23 0.00 0.00 61.79 60.39 1m14 h SER 871 Cb 0.39 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.31 1m14 h SER 871 CO 0.01 0.91 -0.43 0.44 -0.53 0.00 0.00 176.83 177.23 1m14 h ASP 872 N 0.03 0.05 -0.55 6.23 3.45 -0.47 -2.92 116.42 122.26 1m14 h ASP 872 Ca -0.02 -0.02 -0.02 0.00 0.43 0.00 0.00 57.03 57.40 1m14 h ASP 872 Cb 1.51 -0.02 -0.03 0.00 -0.56 0.00 0.00 39.33 40.24 1m14 h ASP 872 CO 0.12 0.48 0.28 0.58 -1.57 0.00 0.00 179.24 179.13 1m14 h VAL 873 N 0.04 1.19 -0.35 -1.35 2.07 -1.19 0.23 116.25 116.90 1m14 h VAL 873 Ca 0.00 -0.52 0.07 0.00 0.82 0.00 0.00 66.70 67.07 1m14 h VAL 873 Cb 0.78 0.53 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 1m14 h VAL 873 CO 0.06 0.21 -0.04 -0.25 0.02 0.00 0.00 177.57 177.58 1m14 h TRP 874 N 0.74 -0.09 -0.18 1.57 2.91 -1.48 0.13 115.95 119.54 1m14 h TRP 874 Ca 0.19 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.22 1m14 h TRP 874 Cb 0.08 0.09 -0.01 0.00 -0.51 0.00 0.00 29.16 28.81 1m14 h TRP 874 CO -0.01 -0.10 0.02 0.77 -1.03 0.00 0.00 178.44 178.09 1m14 h SER 875 N 0.06 0.24 -0.54 2.65 0.02 -1.36 -0.58 113.55 114.03 1m14 h SER 875 Ca 0.17 -0.02 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 1m14 h SER 875 Cb 0.25 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 1m14 h SER 875 CO -0.32 0.27 0.23 0.22 -1.14 0.00 0.00 176.83 176.10 1m14 h TYR 876 N 0.26 0.81 -0.44 3.45 5.03 0.12 -0.27 116.97 125.94 1m14 h TYR 876 Ca 0.06 -0.05 0.04 0.00 2.58 0.00 0.00 58.73 61.36 1m14 h TYR 876 Cb 0.15 -0.25 -0.04 0.00 1.55 0.00 0.00 36.73 38.15 1m14 h TYR 876 CO 0.00 0.65 0.20 0.78 -1.32 0.00 0.00 178.16 178.47 1m14 h GLY 877 N 0.73 0.59 1.42 1.82 0.00 0.67 -0.26 103.07 108.04 1m14 h GLY 877 Ca 0.18 -0.13 -0.09 0.00 0.00 0.00 0.00 47.33 47.30 1m14 h GLY 877 CO -0.02 0.07 -0.13 -2.08 0.00 0.00 0.00 176.54 174.38 1m14 h VAL 878 N 0.39 1.25 -0.76 4.60 2.07 -1.17 -1.77 116.25 120.88 1m14 h VAL 878 Ca 0.19 -1.15 -0.05 0.00 0.82 0.00 0.00 66.70 66.51 1m14 h VAL 878 Cb 0.13 1.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.98 1m14 h VAL 878 CO -0.16 0.39 0.29 0.74 0.02 0.00 0.00 177.57 178.84 1m14 h THR 879 N 0.62 1.26 -0.51 2.57 2.02 -0.18 -0.59 112.91 118.10 1m14 h THR 879 Ca 0.11 -0.83 -0.05 0.00 0.77 0.00 0.00 66.41 66.40 1m14 h THR 879 Cb 0.58 0.38 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 1m14 h THR 879 CO 0.04 0.33 0.12 0.58 0.37 0.00 0.00 175.52 176.96 1m14 h VAL 880 N 1.10 1.24 -0.67 3.16 2.07 -0.76 -1.79 116.25 120.60 1m14 h VAL 880 Ca 0.25 -0.86 0.02 0.00 0.82 0.00 0.00 66.70 66.94 1m14 h VAL 880 Cb 0.24 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.80 1m14 h VAL 880 CO -0.02 0.31 0.42 -0.25 0.02 0.00 0.00 177.57 178.06 1m14 h TRP 881 N 0.70 0.79 -0.36 1.57 7.01 -0.79 0.18 115.95 125.06 1m14 h TRP 881 Ca 0.16 0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.20 1m14 h TRP 881 Cb 0.34 -0.26 -0.03 0.00 -2.10 0.00 0.00 29.16 27.11 1m14 h TRP 881 CO 0.02 0.46 0.19 0.93 -2.79 0.00 0.00 178.44 177.26 1m14 h GLU 882 N 0.84 0.38 -0.26 2.65 5.08 -0.77 -0.74 114.58 121.76 1m14 h GLU 882 Ca 0.26 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.58 1m14 h GLU 882 Cb -0.01 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1m14 h GLU 882 CO -0.09 0.25 0.08 -0.07 -1.00 0.00 0.00 179.01 178.18 1m14 h LEU 883 N 0.39 0.38 -2.16 1.33 3.38 -0.63 0.11 115.31 118.12 1m14 h LEU 883 Ca 0.15 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1m14 h LEU 883 Cb 0.03 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1m14 h LEU 883 CO -0.09 0.49 -0.03 0.24 0.09 0.00 0.00 178.44 179.14 1m14 h MET 884 N 0.26 0.00 -0.66 1.13 2.86 -0.36 -1.43 114.93 116.73 1m14 h MET 884 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1m14 h MET 884 Cb 0.24 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.90 1m14 h MET 884 CO -0.00 0.03 0.00 0.25 1.06 0.00 0.00 176.91 178.24 1m14 n THR 885 N -4.15 1.61 -3.25 2.22 -2.24 -0.31 -4.73 114.28 103.43 1m14 n THR 885 Ca -0.03 -1.16 -0.23 0.00 -2.27 0.00 0.00 64.05 60.36 1m14 n THR 885 Cb 0.11 0.23 0.04 0.00 -2.10 0.00 0.00 70.33 68.61 1m14 n THR 885 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1m14 n PHE 886 N 1.22 -2.20 -0.15 4.78 3.72 -0.54 -3.70 117.46 120.59 1m14 n PHE 886 Ca 0.25 0.66 0.00 0.00 -0.05 0.00 0.00 57.45 58.31 1m14 n PHE 886 Cb 0.81 -4.45 0.00 0.00 -0.94 0.00 0.00 39.48 34.90 1m14 n PHE 886 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1m14 n GLY 887 N -1.62 1.83 3.85 1.37 0.00 0.36 -3.82 105.19 107.16 1m14 n GLY 887 Ca -0.07 -0.07 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 1m14 n GLY 887 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1m14 s SER 888 N -2.08 6.10 -0.19 1.61 0.01 -1.24 -4.97 113.70 112.94 1m14 s SER 888 Ca 0.00 1.49 -0.18 0.00 1.31 0.00 0.00 55.95 58.57 1m14 s SER 888 Cb 0.00 -2.48 -0.04 0.00 0.21 0.00 0.00 66.02 63.71 1m14 s SER 888 CO 0.00 -0.95 0.48 -0.54 0.41 0.00 0.00 173.24 172.63 1m14 s LYS 889 N -4.98 4.20 0.06 12.44 1.02 -1.26 -4.79 119.74 126.43 1m14 s LYS 889 Ca 0.56 0.35 -0.31 0.00 0.02 0.00 0.00 55.97 56.60 1m14 s LYS 889 Cb -0.12 -3.54 -0.08 0.00 -0.52 0.00 0.00 37.83 33.58 1m14 s LYS 889 CO 0.51 -0.08 1.60 -1.25 -0.92 0.00 0.00 175.35 175.21 1m14 s PRO 890 N 1.42 4.21 -1.20 -1.68 0.04 -1.26 -2.68 135.00 133.86 1m14 s PRO 890 Ca 0.23 2.26 -0.03 0.00 0.04 0.00 0.00 61.00 63.50 1m14 s PRO 890 Cb -0.15 -3.57 0.00 0.00 0.04 0.00 0.00 34.50 30.82 1m14 s PRO 890 CO 0.09 -0.70 1.02 0.66 0.04 0.00 0.00 177.00 178.11 1m14 n TYR 891 N 5.48 -2.32 -0.59 0.56 4.01 -1.26 -4.85 117.16 118.18 1m14 n TYR 891 Ca 0.15 0.93 0.47 0.00 -0.16 0.00 0.00 57.90 59.29 1m14 n TYR 891 Cb 0.41 -4.95 0.77 0.00 -0.31 0.00 0.00 39.34 35.26 1m14 n TYR 891 CO 0.00 0.00 0.00 0.22 -0.46 0.00 0.00 176.86 176.62 1m14 h ASP 892 N -2.07 0.06 0.00 7.72 -0.00 -1.94 -2.90 116.42 117.29 1m14 h ASP 892 Ca -0.56 0.04 0.00 0.00 -0.00 0.00 0.00 57.03 56.51 1m14 h ASP 892 Cb 1.34 0.04 0.00 0.00 -0.00 0.00 0.00 39.33 40.70 1m14 h ASP 892 CO 0.50 -0.06 0.00 0.61 -0.00 0.00 0.00 179.24 180.29 1m14 n GLY 893 N -1.79 0.66 2.14 -0.78 0.00 -1.26 -4.95 105.19 99.20 1m14 n GLY 893 Ca 0.41 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.06 1m14 n GLY 893 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1m14 n ILE 894 N -1.17 0.00 -3.05 -0.61 2.08 -1.10 -4.91 119.36 110.60 1m14 n ILE 894 Ca 0.00 0.00 -0.37 0.00 0.56 0.00 0.00 62.75 62.94 1m14 n ILE 894 Cb 0.00 -0.04 -0.06 0.00 -0.75 0.00 0.00 39.64 38.79 1m14 n ILE 894 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 1m14 s PRO 895 N 0.24 4.34 0.17 0.38 0.04 -1.26 -4.93 135.00 133.97 1m14 s PRO 895 Ca 0.56 0.96 -0.07 0.00 0.04 0.00 0.00 61.00 62.49 1m14 s PRO 895 Cb -0.79 -2.95 0.24 0.00 0.04 0.00 0.00 34.50 31.04 1m14 s PRO 895 CO 0.36 0.42 0.99 0.00 0.04 0.00 0.00 177.00 178.82 1m14 n ALA 896 N 0.90 0.07 0.32 8.56 0.00 -1.26 -0.06 120.51 129.04 1m14 n ALA 896 Ca -0.03 0.68 0.20 0.00 0.00 0.00 0.00 53.44 54.29 1m14 n ALA 896 Cb 0.50 -0.37 1.07 0.00 0.00 0.00 0.00 19.45 20.65 1m14 n ALA 896 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1m14 h SER 897 N 0.00 0.00 0.35 0.00 4.64 -2.03 -2.73 113.55 113.78 1m14 h SER 897 Ca 0.28 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.41 1m14 h SER 897 Cb 0.43 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.49 1m14 h SER 897 CO -0.65 0.00 -1.82 1.21 -0.87 0.00 0.00 176.83 174.70 1m14 n GLU 898 N -3.32 0.65 -0.33 4.77 2.13 0.92 -4.52 120.64 120.94 1m14 n GLU 898 Ca -0.02 0.06 0.12 0.00 0.66 0.00 0.00 57.16 57.97 1m14 n GLU 898 Cb 0.13 -1.66 0.25 0.00 0.27 0.00 0.00 31.44 30.43 1m14 n GLU 898 CO 0.00 0.00 0.00 0.82 -0.41 0.00 0.00 177.13 177.54 1m14 h ILE 899 N 0.00 0.06 -0.97 6.31 1.08 -1.42 0.13 117.51 122.71 1m14 h ILE 899 Ca -0.23 -0.01 0.16 0.00 -0.39 0.00 0.00 64.86 64.39 1m14 h ILE 899 Cb 1.63 0.04 -0.10 0.00 -3.07 0.00 0.00 36.82 35.32 1m14 h ILE 899 CO 0.03 0.00 0.58 -1.28 -0.69 0.00 0.00 178.15 176.79 1m14 h SER 900 N 0.02 0.76 -0.15 1.72 0.87 -1.79 -2.13 113.55 112.85 1m14 h SER 900 Ca 0.55 0.08 -0.06 0.00 -1.23 0.00 0.00 61.79 61.14 1m14 h SER 900 Cb 1.08 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.98 1m14 h SER 900 CO -0.90 0.32 -0.14 0.28 -0.53 0.00 0.00 176.83 175.85 1m14 h SER 901 N 0.79 0.39 -0.57 6.23 0.02 -1.04 -2.53 113.55 116.83 1m14 h SER 901 Ca 0.53 -0.47 0.02 0.00 -0.84 0.00 0.00 61.79 61.03 1m14 h SER 901 Cb 0.74 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 1m14 h SER 901 CO -0.35 0.78 0.38 0.16 -1.14 0.00 0.00 176.83 176.66 1m14 h ILE 902 N -0.00 1.12 -0.14 3.27 3.07 -1.33 -1.98 117.51 121.51 1m14 h ILE 902 Ca 0.03 -0.25 -0.14 0.00 1.55 0.00 0.00 64.86 66.05 1m14 h ILE 902 Cb 0.67 0.32 -0.01 0.00 -0.27 0.00 0.00 36.82 37.53 1m14 h ILE 902 CO 0.04 0.13 -0.50 -0.07 -1.05 0.00 0.00 178.15 176.70 1m14 h LEU 903 N 0.73 0.41 -0.73 0.16 3.38 -1.31 -2.18 115.31 115.77 1m14 h LEU 903 Ca 0.22 -0.20 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 1m14 h LEU 903 Cb -0.02 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1m14 h LEU 903 CO -0.05 0.84 -0.62 -0.33 0.09 0.00 0.00 178.44 178.37 1m14 h GLU 904 N 0.30 0.06 -0.28 1.13 5.08 -0.94 -3.00 114.58 116.93 1m14 h GLU 904 Ca 0.01 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.21 1m14 h GLU 904 Cb 0.98 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1m14 h GLU 904 CO 0.08 0.66 -0.32 0.87 -1.00 0.00 0.00 179.01 179.30 1m14 h LYS 905 N 0.04 0.60 0.00 2.33 1.57 -1.24 -3.47 116.57 116.41 1m14 h LYS 905 Ca -0.01 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1m14 h LYS 905 Cb 1.10 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1m14 h LYS 905 CO 0.08 0.85 0.00 0.41 -0.57 0.00 0.00 179.45 180.22 1m14 n GLY 906 N -0.15 0.87 3.77 3.86 0.00 -1.03 -5.12 105.19 107.39 1m14 n GLY 906 Ca -0.01 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 1m14 n GLY 906 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1m14 s GLU 907 N 0.00 4.15 0.36 1.61 2.12 -0.85 -4.99 118.70 121.10 1m14 s GLU 907 Ca 0.00 2.25 0.06 0.00 0.36 0.00 0.00 54.97 57.64 1m14 s GLU 907 Cb 0.00 -2.92 -0.02 0.00 0.26 0.00 0.00 34.13 31.44 1m14 s GLU 907 CO 0.00 -0.37 0.22 0.54 -0.54 0.00 0.00 175.26 175.11 1m14 n ARG 908 N 0.47 0.47 -2.26 4.30 5.12 -1.26 -4.36 116.66 119.14 1m14 n ARG 908 Ca 0.02 -3.33 -0.38 0.00 -1.93 0.00 0.00 57.85 52.23 1m14 n ARG 908 Cb 0.42 2.34 -0.02 0.00 -1.16 0.00 0.00 32.46 34.05 1m14 n ARG 908 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1m14 s LEU 909 N 0.00 4.17 0.71 0.55 1.43 -1.26 -5.00 118.68 119.29 1m14 s LEU 909 Ca 0.31 2.38 -0.11 0.00 -1.03 0.00 0.00 54.13 55.68 1m14 s LEU 909 Cb 0.02 -4.04 0.02 0.00 0.03 0.00 0.00 46.19 42.22 1m14 s LEU 909 CO 0.22 -0.73 1.08 -2.16 0.23 0.00 0.00 176.35 174.99 1m14 s PRO 910 N -2.34 2.70 -0.12 1.29 0.04 -1.26 -4.97 135.00 130.35 1m14 s PRO 910 Ca 0.58 1.09 -0.29 0.00 0.04 0.00 0.00 61.00 62.42 1m14 s PRO 910 Cb -0.31 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 1m14 s PRO 910 CO 0.39 -1.30 1.61 -1.14 0.04 0.00 0.00 177.00 176.61 1m14 s GLN 911 N -4.83 4.05 0.27 4.56 0.74 -1.26 -4.96 119.66 118.23 1m14 s GLN 911 Ca 0.60 1.98 -0.30 0.00 0.05 0.00 0.00 55.36 57.70 1m14 s GLN 911 Cb -0.16 -3.98 -0.10 0.00 1.10 0.00 0.00 33.01 29.87 1m14 s GLN 911 CO 0.53 -0.99 1.39 -2.14 -0.55 0.00 0.00 175.29 173.53 1m14 s PRO 912 N 4.21 4.30 0.43 1.67 0.02 -1.26 -4.91 135.00 139.46 1m14 s PRO 912 Ca 0.71 2.26 0.28 0.00 0.02 0.00 0.00 61.00 64.27 1m14 s PRO 912 Cb -0.30 -3.11 1.37 0.00 0.02 0.00 0.00 34.50 32.49 1m14 s PRO 912 CO 0.28 -0.34 1.64 -1.35 -0.33 0.00 0.00 177.00 176.90 1m14 h PRO 913 N 4.57 0.13 -0.00 5.54 0.10 -1.93 0.13 132.00 140.53 1m14 h PRO 913 Ca -0.47 -0.01 0.00 0.00 0.10 0.00 0.00 66.00 65.63 1m14 h PRO 913 Cb 1.22 -0.03 0.00 0.00 0.10 0.00 0.00 31.00 32.29 1m14 h PRO 913 CO 0.74 0.08 -0.21 0.44 0.10 0.00 0.00 178.00 179.15 1m14 n ILE 914 N -4.72 0.00 -2.99 4.15 -5.35 -1.26 -4.86 119.36 104.32 1m14 n ILE 914 Ca 0.35 -0.02 -0.40 0.00 -0.27 0.00 0.00 62.75 62.41 1m14 n ILE 914 Cb 1.34 -0.09 -0.04 0.00 -1.74 0.00 0.00 39.64 39.10 1m14 n ILE 914 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1m14 s THR 916 N 0.84 2.98 0.46 0.00 -4.23 -1.07 -4.84 115.64 109.78 1m14 s THR 916 Ca 0.40 0.32 0.33 0.00 -1.18 0.00 0.00 61.69 61.56 1m14 s THR 916 Cb -0.18 -3.26 0.36 0.00 1.34 0.00 0.00 72.50 70.76 1m14 s THR 916 CO 0.20 -0.41 2.16 -0.29 -0.54 0.00 0.00 174.62 175.74 1m14 h ILE 917 N -0.87 0.33 0.04 2.99 2.10 -1.97 -1.92 117.51 118.20 1m14 h ILE 917 Ca -0.46 -0.32 -0.00 0.00 1.08 0.00 0.00 64.86 65.16 1m14 h ILE 917 Cb 1.28 1.24 0.00 0.00 -1.09 0.00 0.00 36.82 38.25 1m14 h ILE 917 CO 0.63 0.05 -0.02 0.44 -1.08 0.00 0.00 178.15 178.18 1m14 h ASP 918 N 0.00 -0.05 -0.30 2.19 5.19 -1.91 -1.33 116.42 120.20 1m14 h ASP 918 Ca -0.00 -0.18 -0.13 0.00 -0.62 0.00 0.00 57.03 56.10 1m14 h ASP 918 Cb 0.23 0.01 -0.00 0.00 0.18 0.00 0.00 39.33 39.75 1m14 h ASP 918 CO 0.01 0.15 -0.33 0.58 -3.12 0.00 0.00 179.24 176.53 1m14 h VAL 919 N -0.25 1.29 0.00 -1.35 2.07 -1.73 -3.17 116.25 113.11 1m14 h VAL 919 Ca -0.01 -1.50 -0.05 0.00 0.82 0.00 0.00 66.70 65.96 1m14 h VAL 919 Cb 0.22 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1m14 h VAL 919 CO 0.01 0.49 -0.24 0.22 0.02 0.00 0.00 177.57 178.06 1m14 h TYR 920 N 0.52 0.00 -0.15 1.57 -0.00 -1.37 -2.27 116.97 115.27 1m14 h TYR 920 Ca 0.05 0.00 -0.11 0.00 -0.00 0.00 0.00 58.73 58.66 1m14 h TYR 920 Cb 0.91 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.63 1m14 h TYR 920 CO 0.07 0.24 -0.39 1.98 -0.00 0.00 0.00 178.16 180.07 1m14 h MET 921 N 0.00 0.34 -0.18 1.82 4.05 -1.21 -1.59 114.93 118.16 1m14 h MET 921 Ca -0.00 -0.16 -0.02 0.00 -0.28 0.00 0.00 59.70 59.24 1m14 h MET 921 Cb 0.54 -0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.33 1m14 h MET 921 CO 0.03 0.68 0.04 0.82 0.23 0.00 0.00 176.91 178.71 1m14 h ILE 922 N 0.29 1.21 0.22 1.77 1.08 -1.42 -1.36 117.51 119.30 1m14 h ILE 922 Ca 0.03 -0.69 0.01 0.00 -0.39 0.00 0.00 64.86 63.81 1m14 h ILE 922 Cb 0.82 1.32 -0.02 0.00 -3.07 0.00 0.00 36.82 35.86 1m14 h ILE 922 CO 0.07 0.21 -0.25 0.24 -0.69 0.00 0.00 178.15 177.72 1m14 h MET 923 N 0.10 -0.50 -0.84 2.37 2.86 -1.41 -2.46 114.93 115.05 1m14 h MET 923 Ca 0.06 0.03 0.16 0.00 -2.06 0.00 0.00 59.70 57.90 1m14 h MET 923 Cb 0.29 0.11 -0.10 0.00 0.06 0.00 0.00 31.60 31.96 1m14 h MET 923 CO 0.00 -0.33 0.40 0.28 1.06 0.00 0.00 176.91 178.31 1m14 h VAL 924 N -0.52 0.65 0.00 -2.22 2.07 -1.22 0.69 116.25 115.70 1m14 h VAL 924 Ca 0.00 -0.18 -0.05 0.00 0.82 0.00 0.00 66.70 67.29 1m14 h VAL 924 Cb 0.50 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1m14 h VAL 924 CO -0.08 0.10 -0.25 0.11 0.02 0.00 0.00 177.57 177.47 1m14 h LYS 925 N 0.53 0.00 0.00 1.57 1.57 -0.83 -1.06 116.57 118.35 1m14 h LYS 925 Ca 0.48 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.26 1m14 h LYS 925 Cb 0.75 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.06 1m14 h LYS 925 CO -0.42 0.25 0.00 0.00 -0.57 0.00 0.00 179.45 178.71 1m14 n TRP 927 N -2.64 1.75 -2.87 0.00 8.01 -0.40 -3.78 117.44 117.51 1m14 n TRP 927 Ca 0.02 -1.06 -0.41 0.00 -1.31 0.00 0.00 57.50 54.73 1m14 n TRP 927 Cb 0.29 -0.52 -0.04 0.00 -2.01 0.00 0.00 31.31 29.04 1m14 n TRP 927 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 1m14 s MET 928 N -2.94 4.34 0.40 -0.99 -1.94 -1.20 -4.94 119.30 112.04 1m14 s MET 928 Ca 0.50 1.07 0.26 0.00 -1.71 0.00 0.00 55.69 55.80 1m14 s MET 928 Cb 0.40 -3.55 1.40 0.00 2.01 0.00 0.00 34.83 35.09 1m14 s MET 928 CO 0.11 -0.26 1.59 0.82 -0.01 0.00 0.00 175.02 177.26 1m14 h ILE 929 N 5.10 0.02 -3.39 2.53 5.03 -1.94 -3.35 117.51 121.52 1m14 h ILE 929 Ca -0.32 -0.01 -0.57 0.00 -0.12 0.00 0.00 64.86 63.85 1m14 h ILE 929 Cb 1.15 -0.00 -0.06 0.00 -3.03 0.00 0.00 36.82 34.87 1m14 h ILE 929 CO 0.82 0.00 0.88 -0.62 -0.68 0.00 0.00 178.15 178.56 1m14 s ASP 930 N -4.44 6.83 0.21 1.72 3.68 -1.26 -4.92 116.67 118.48 1m14 s ASP 930 Ca -0.08 0.92 -0.09 0.00 2.13 0.00 0.00 52.55 55.42 1m14 s ASP 930 Cb 0.32 -2.54 0.20 0.00 -1.45 0.00 0.00 42.92 39.45 1m14 s ASP 930 CO 0.80 -1.00 1.85 0.00 0.13 0.00 0.00 175.17 176.96 1m14 h ALA 931 N 8.52 0.96 0.00 3.66 0.00 -1.96 -2.11 119.26 128.33 1m14 h ALA 931 Ca -0.22 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1m14 h ALA 931 Cb 1.06 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1m14 h ALA 931 CO 1.06 0.25 0.00 -0.44 0.00 0.00 0.00 179.25 180.12 1m14 h ASP 932 N 0.91 0.00 0.89 0.00 3.45 -1.92 -2.75 116.42 116.99 1m14 h ASP 932 Ca 0.29 0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.60 1m14 h ASP 932 Cb 0.01 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.76 1m14 h ASP 932 CO -0.11 0.00 -0.71 0.28 -1.57 0.00 0.00 179.24 177.13 1m14 h SER 933 N 0.00 0.00 -4.29 6.45 0.02 -1.72 -3.46 113.55 110.55 1m14 h SER 933 Ca 0.00 0.00 -0.52 0.00 -0.84 0.00 0.00 61.79 60.43 1m14 h SER 933 Cb 0.49 0.00 0.15 0.00 0.14 0.00 0.00 62.40 63.18 1m14 h SER 933 CO 0.00 0.71 0.30 -0.13 -1.14 0.00 0.00 176.83 176.57 1m14 s ARG 934 N -3.20 1.94 0.54 3.45 0.52 -1.04 -4.99 118.95 116.17 1m14 s ARG 934 Ca 0.00 1.31 -0.17 0.00 -0.52 0.00 0.00 55.73 56.35 1m14 s ARG 934 Cb 0.11 -1.85 -0.06 0.00 0.52 0.00 0.00 34.95 33.67 1m14 s ARG 934 CO 0.77 -1.90 1.03 -1.25 0.02 0.00 0.00 175.30 173.97 1m14 s PRO 935 N -4.75 3.62 0.18 3.54 0.04 -1.26 -5.04 135.00 131.34 1m14 s PRO 935 Ca 0.64 1.17 -0.17 0.00 0.04 0.00 0.00 61.00 62.67 1m14 s PRO 935 Cb -0.19 -2.08 -0.08 0.00 0.04 0.00 0.00 34.50 32.19 1m14 s PRO 935 CO 0.55 -0.56 0.64 0.15 0.04 0.00 0.00 177.00 177.83 1m14 s LYS 936 N -3.85 4.12 0.44 4.56 1.02 -1.26 -4.93 119.74 119.85 1m14 s LYS 936 Ca 0.63 0.69 0.24 0.00 0.02 0.00 0.00 55.97 57.55 1m14 s LYS 936 Cb -0.14 -2.91 1.24 0.00 -0.52 0.00 0.00 37.83 35.50 1m14 s LYS 936 CO 0.31 0.44 1.79 0.74 -0.92 0.00 0.00 175.35 177.71 1m14 h PHE 937 N 3.50 0.45 0.00 3.18 0.04 -1.95 0.34 116.94 122.50 1m14 h PHE 937 Ca -0.48 0.02 -0.06 0.00 2.80 0.00 0.00 57.97 60.24 1m14 h PHE 937 Cb 1.19 -0.13 -0.01 0.00 2.20 0.00 0.00 35.95 39.20 1m14 h PHE 937 CO 0.64 0.04 -0.30 0.07 -0.60 0.00 0.00 178.31 178.17 1m14 h ARG 938 N 0.27 0.00 0.09 1.51 0.11 -1.93 -1.97 114.38 112.45 1m14 h ARG 938 Ca 0.57 0.00 -0.27 0.00 0.10 0.00 0.00 59.98 60.38 1m14 h ARG 938 Cb 1.68 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.77 1m14 h ARG 938 CO -0.20 0.30 -1.15 0.93 0.10 0.00 0.00 179.97 179.95 1m14 h GLU 939 N 0.00 0.45 -0.41 0.08 5.08 -0.76 -3.07 114.58 115.94 1m14 h GLU 939 Ca -0.00 -0.60 -0.03 0.00 -1.00 0.00 0.00 59.36 57.73 1m14 h GLU 939 Cb 0.53 0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.96 1m14 h GLU 939 CO 0.04 1.24 0.13 -0.07 -1.00 0.00 0.00 179.01 179.36 1m14 h LEU 940 N 0.20 0.54 -0.02 1.33 -0.00 -0.84 -0.81 115.31 115.71 1m14 h LEU 940 Ca -0.14 -0.07 -0.00 0.00 -0.00 0.00 0.00 57.88 57.68 1m14 h LEU 940 Cb 1.83 -0.14 -0.00 0.00 -0.00 0.00 0.00 40.66 42.35 1m14 h LEU 940 CO 0.20 0.52 0.01 0.40 -0.00 0.00 0.00 178.44 179.57 1m14 h ILE 941 N 0.59 1.12 0.62 1.22 2.04 -1.37 -1.30 117.51 120.43 1m14 h ILE 941 Ca 0.14 -0.34 -0.03 0.00 1.00 0.00 0.00 64.86 65.63 1m14 h ILE 941 Cb 0.17 1.30 0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1m14 h ILE 941 CO -0.01 0.09 -0.30 0.40 0.00 0.00 0.00 178.15 178.34 1m14 h ILE 942 N -0.10 0.39 -0.19 -0.67 2.04 -1.37 0.27 117.51 117.88 1m14 h ILE 942 Ca 0.01 -0.02 0.05 0.00 1.00 0.00 0.00 64.86 65.90 1m14 h ILE 942 Cb 0.14 0.40 -0.06 0.00 -0.74 0.00 0.00 36.82 36.56 1m14 h ILE 942 CO -0.00 0.00 -0.17 -0.33 0.00 0.00 0.00 178.15 177.65 1m14 h GLU 943 N -0.85 -0.18 -0.03 2.37 4.39 -1.18 -0.44 114.58 118.67 1m14 h GLU 943 Ca -0.08 0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.55 1m14 h GLU 943 Cb 0.64 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.32 1m14 h GLU 943 CO 0.14 -0.12 -0.37 0.74 -1.16 0.00 0.00 179.01 178.24 1m14 h PHE 944 N -0.19 0.06 -0.34 4.33 0.04 -1.25 -2.61 116.94 116.98 1m14 h PHE 944 Ca 0.12 -0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.83 1m14 h PHE 944 Cb 0.36 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.48 1m14 h PHE 944 CO -0.31 0.41 0.06 0.77 -0.60 0.00 0.00 178.31 178.64 1m14 h SER 945 N 0.04 0.54 -0.56 2.17 0.02 -0.02 -0.20 113.55 115.55 1m14 h SER 945 Ca 0.00 -0.25 0.06 0.00 -0.84 0.00 0.00 61.79 60.76 1m14 h SER 945 Cb 0.67 -0.14 -0.05 0.00 0.14 0.00 0.00 62.40 63.02 1m14 h SER 945 CO 0.05 0.65 0.26 0.11 -1.14 0.00 0.00 176.83 176.76 1m14 h LYS 946 N 0.40 0.47 -0.34 3.45 1.57 -0.81 -2.21 116.57 119.09 1m14 h LYS 946 Ca 0.10 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 1m14 h LYS 946 Cb 0.34 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1m14 h LYS 946 CO 0.01 0.31 -0.10 0.52 -0.57 0.00 0.00 179.45 179.62 1m14 h MET 947 N 0.49 0.58 0.00 3.15 2.86 -1.27 -2.43 114.93 118.31 1m14 h MET 947 Ca 0.26 -0.17 0.00 0.00 -2.06 0.00 0.00 59.70 57.73 1m14 h MET 947 Cb 0.22 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1m14 h MET 947 CO -0.21 0.68 0.00 0.00 1.06 0.00 0.00 176.91 178.44 1m14 h ALA 948 N 1.36 1.00 0.00 6.32 0.00 -0.39 -2.16 119.26 125.40 1m14 h ALA 948 Ca 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1m14 h ALA 948 Cb 0.49 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 1m14 h ALA 948 CO 0.03 0.00 -0.05 0.00 0.00 0.00 0.00 179.25 179.22 1m14 h ARG 949 N 0.00 0.00 -1.29 0.00 3.08 -1.30 -3.36 114.38 111.51 1m14 h ARG 949 Ca 0.00 0.00 -0.43 0.00 0.07 0.00 0.00 59.98 59.62 1m14 h ARG 949 Cb 0.24 0.00 -0.29 0.00 0.08 0.00 0.00 29.97 30.00 1m14 h ARG 949 CO 0.00 0.05 -0.86 -3.47 -1.07 0.00 0.00 179.97 174.62 1m14 n ASP 950 N -3.12 -1.10 -0.18 7.04 4.64 -0.84 -5.04 116.55 117.95 1m14 n ASP 950 Ca 0.03 -2.89 -0.01 0.00 -1.38 0.00 0.00 54.79 50.54 1m14 n ASP 950 Cb 0.48 0.33 0.08 0.00 -1.04 0.00 0.00 41.12 40.98 1m14 n ASP 950 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 1m14 h PRO 951 N 4.15 0.13 0.00 -0.67 0.11 -1.65 -2.24 132.00 131.83 1m14 h PRO 951 Ca 0.01 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1m14 h PRO 951 Cb 0.94 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1m14 h PRO 951 CO 0.39 0.09 0.00 1.96 -0.21 0.00 0.00 178.00 180.23 1m14 h GLN 952 N 0.13 0.00 0.00 1.05 4.20 -1.89 -1.43 115.11 117.18 1m14 h GLN 952 Ca 0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.00 1m14 h GLN 952 Cb 0.45 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1m14 h GLN 952 CO -0.46 0.00 0.00 -0.09 -0.67 0.00 0.00 178.83 177.61 1m14 h ARG 953 N 0.00 0.00 0.00 1.46 2.43 -1.76 -3.38 114.38 113.13 1m14 h ARG 953 Ca 0.00 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.16 1m14 h ARG 953 Cb 0.18 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1m14 h ARG 953 CO 0.00 0.00 -1.21 0.66 -1.51 0.00 0.00 179.97 177.91 1m14 n TYR 954 N -2.83 0.00 -4.28 2.20 4.02 -0.62 -4.96 117.16 110.68 1m14 n TYR 954 Ca 0.04 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.69 1m14 n TYR 954 Cb 0.50 -0.11 -0.17 0.00 -0.02 0.00 0.00 39.34 39.53 1m14 n TYR 954 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1m14 s LEU 955 N -3.49 1.43 -0.42 7.72 1.43 -0.70 -2.60 118.68 122.05 1m14 s LEU 955 Ca -0.02 -0.27 -0.11 0.00 -1.03 0.00 0.00 54.13 52.70 1m14 s LEU 955 Cb 0.02 -0.77 0.06 0.00 0.03 0.00 0.00 46.19 45.53 1m14 s LEU 955 CO 0.17 -0.03 0.28 -0.69 0.23 0.00 0.00 176.35 176.30 1m14 s VAL 956 N 1.08 4.56 -0.09 -1.59 1.01 0.46 -4.45 120.40 121.38 1m14 s VAL 956 Ca -0.07 -1.17 0.02 0.00 0.00 0.00 0.00 61.98 60.76 1m14 s VAL 956 Cb -0.14 -3.70 0.01 0.00 0.00 0.00 0.00 36.38 32.54 1m14 s VAL 956 CO -0.01 -0.45 -0.15 -0.63 0.00 0.00 0.00 175.10 173.87 1m14 s ILE 957 N 1.51 1.41 0.23 2.22 1.01 -1.26 -4.45 121.20 121.86 1m14 s ILE 957 Ca 0.03 -0.61 -0.09 0.00 0.00 0.00 0.00 60.65 59.98 1m14 s ILE 957 Cb -0.22 -1.28 0.24 0.00 0.01 0.00 0.00 42.46 41.21 1m14 s ILE 957 CO 0.04 0.42 1.65 1.56 0.00 0.00 0.00 174.94 178.61 1m14 h GLN 958 N 7.16 0.11 0.00 2.79 4.20 -1.98 -3.33 115.11 124.05 1m14 h GLN 958 Ca -0.29 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.41 1m14 h GLN 958 Cb 1.19 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.94 1m14 h GLN 958 CO 0.48 0.07 0.00 0.41 -0.67 0.00 0.00 178.83 179.12 1m14 n GLY 959 N -1.39 -0.10 2.09 3.46 0.00 -1.26 -5.25 105.19 102.74 1m14 n GLY 959 Ca 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.10 1m14 n GLY 959 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1m14 n ASP 960 N 0.00 -2.18 -0.51 1.61 8.00 -1.25 -5.14 116.55 117.08 1m14 n ASP 960 Ca 0.00 0.07 0.00 0.00 0.71 0.00 0.00 54.79 55.57 1m14 n ASP 960 Cb 0.00 -1.81 0.00 0.00 -0.02 0.00 0.00 41.12 39.29 1m14 n ASP 960 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1m14 n ASP 979 N 0.98 -0.68 0.00 -2.24 8.00 -1.26 -5.10 116.55 116.26 1m14 n ASP 979 Ca -0.03 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.47 1m14 n ASP 979 Cb 0.21 -0.34 0.00 0.00 -0.02 0.00 0.00 41.12 40.97 1m14 n ASP 979 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1m14 n GLU 980 N 0.43 0.00 -2.05 -1.24 0.00 -1.26 -4.78 120.64 111.74 1m14 n GLU 980 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 57.16 56.74 1m14 n GLU 980 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 31.44 31.41 1m14 n GLU 980 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 1m14 s GLU 981 N 0.00 4.25 0.00 3.44 2.02 -1.26 -4.88 118.70 122.26 1m14 s GLU 981 Ca 0.00 2.20 0.00 0.00 0.02 0.00 0.00 54.97 57.19 1m14 s GLU 981 Cb 0.00 -3.44 0.00 0.00 0.10 0.00 0.00 34.13 30.79 1m14 s GLU 981 CO 0.00 -0.61 0.00 -3.47 0.02 0.00 0.00 175.26 171.20 1m14 n ASP 982 N 4.92 0.00 -2.20 -0.19 2.03 -1.26 -5.20 116.55 114.64 1m14 n ASP 982 Ca 0.14 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.42 1m14 n ASP 982 Cb 0.41 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.81 1m14 n ASP 982 CO 0.00 0.00 0.00 0.80 -1.92 0.00 0.00 177.20 176.08 1m14 n MET 983 N 0.00 1.90 -0.98 -0.67 1.56 -1.26 -5.10 117.12 112.56 1m14 n MET 983 Ca 0.00 -0.29 -0.12 0.00 -0.27 0.00 0.00 57.70 57.02 1m14 n MET 983 Cb 0.00 0.08 0.20 0.00 2.15 0.00 0.00 33.22 35.64 1m14 n MET 983 CO 0.00 0.00 0.00 -0.40 -0.73 0.00 0.00 175.97 174.84 1m14 n ASP 984 N -1.03 3.08 -1.24 6.12 3.85 -1.26 -4.49 116.55 121.58 1m14 n ASP 984 Ca -0.02 -3.68 0.09 0.00 -0.71 0.00 0.00 54.79 50.47 1m14 n ASP 984 Cb 0.05 -0.72 0.29 0.00 -1.35 0.00 0.00 41.12 39.39 1m14 n ASP 984 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.20 176.66 1m14 n ASP 985 N -1.09 4.14 -4.75 -1.12 9.92 -1.26 -5.00 116.55 117.39 1m14 n ASP 985 Ca 0.44 -2.38 -0.41 0.00 -0.53 0.00 0.00 54.79 51.91 1m14 n ASP 985 Cb 1.30 -0.49 -0.03 0.00 -0.64 0.00 0.00 41.12 41.27 1m14 n ASP 985 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1m14 s VAL 986 N -1.71 3.13 -0.02 2.53 0.11 -1.26 -5.04 120.40 118.13 1m14 s VAL 986 Ca 0.43 1.01 -0.01 0.00 -2.93 0.00 0.00 61.98 60.48 1m14 s VAL 986 Cb 0.28 -3.65 0.01 0.00 -1.53 0.00 0.00 36.38 31.49 1m14 s VAL 986 CO 0.21 0.19 0.06 -0.69 -3.33 0.00 0.00 175.10 171.54 1m14 s VAL 987 N -0.46 -0.02 0.48 2.04 1.01 -1.26 -5.15 120.40 117.04 1m14 s VAL 987 Ca 0.52 0.07 -0.21 0.00 0.00 0.00 0.00 61.98 62.36 1m14 s VAL 987 Cb -0.36 -0.10 -0.08 0.00 0.00 0.00 0.00 36.38 35.84 1m14 s VAL 987 CO 0.43 0.03 1.08 -0.62 0.00 0.00 0.00 175.10 176.02 1m14 s ASP 988 N 0.39 6.26 0.38 3.32 2.15 -1.26 -4.93 116.67 122.98 1m14 s ASP 988 Ca -0.03 2.08 0.12 0.00 0.43 0.00 0.00 52.55 55.15 1m14 s ASP 988 Cb -0.04 -2.58 0.92 0.00 -0.30 0.00 0.00 42.92 40.92 1m14 s ASP 988 CO -0.01 -0.84 1.88 0.00 -0.17 0.00 0.00 175.17 176.02 1m14 h ALA 989 N 1.76 1.96 -0.04 3.66 0.00 -2.01 -0.60 119.26 123.99 1m14 h ALA 989 Ca -0.49 0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.44 1m14 h ALA 989 Cb 1.23 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 1m14 h ALA 989 CO 0.59 -0.21 0.10 -0.44 0.00 0.00 0.00 179.25 179.29 1m14 h ASP 990 N 0.57 0.00 -0.42 0.00 3.32 -2.06 -0.76 116.42 117.08 1m14 h ASP 990 Ca 0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.48 1m14 h ASP 990 Cb 0.83 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.38 1m14 h ASP 990 CO -0.18 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 176.72 1m14 n GLU 991 N -3.34 2.47 -3.72 3.56 4.71 -0.24 -4.81 120.64 119.27 1m14 n GLU 991 Ca -0.02 -2.17 -0.37 0.00 -0.01 0.00 0.00 57.16 54.59 1m14 n GLU 991 Cb 0.18 -1.40 -0.10 0.00 -1.01 0.00 0.00 31.44 29.10 1m14 n GLU 991 CO 0.00 0.00 0.00 -0.47 0.09 0.00 0.00 177.13 176.75 1m14 s TYR 992 N -1.11 3.48 -0.04 -0.32 6.14 -0.29 -4.96 117.35 120.25 1m14 s TYR 992 Ca 0.33 -2.53 -0.15 0.00 0.64 0.00 0.00 57.07 55.36 1m14 s TYR 992 Cb 0.18 -3.25 -0.05 0.00 0.42 0.00 0.00 41.96 39.26 1m14 s TYR 992 CO 0.24 -0.90 0.39 -0.51 0.64 0.00 0.00 175.55 175.41 1m14 s LEU 993 N 0.48 4.42 0.00 6.97 1.43 -1.26 -4.94 118.68 125.77 1m14 s LEU 993 Ca 0.13 0.87 0.00 0.00 -1.03 0.00 0.00 54.13 54.10 1m14 s LEU 993 Cb -0.21 -2.55 0.00 0.00 0.03 0.00 0.00 46.19 43.46 1m14 s LEU 993 CO -0.04 0.26 0.00 -0.38 0.23 0.00 0.00 176.35 176.43 1m14 n ILE 994 N 2.27 0.00 0.00 -0.59 5.41 -1.26 -4.98 119.36 120.20 1m14 n ILE 994 Ca -0.13 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.62 1m14 n ILE 994 Cb 0.52 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 39.45 1m14 n ILE 994 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 1m14 n PRO 995 N 0.00 0.00 0.00 0.38 -0.04 -1.26 -5.34 135.00 128.74 1m14 n PRO 995 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1m14 n PRO 995 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1m14 n PRO 995 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40