#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1z95 h PHE 673 N 0.00 -0.72 -0.51 1.39 3.57 -2.04 -0.53 116.94 118.11 1z95 h PHE 673 Ca 0.00 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.48 1z95 h PHE 673 Cb 0.00 0.33 -0.02 0.00 2.79 0.00 0.00 35.95 39.04 1z95 h PHE 673 CO 0.00 -0.35 0.11 -0.07 -2.23 0.00 0.00 178.31 175.76 1z95 h LEU 674 N -0.37 0.73 -0.38 0.59 3.38 -2.00 -1.35 115.31 115.91 1z95 h LEU 674 Ca 0.08 -0.13 0.06 0.00 0.09 0.00 0.00 57.88 57.98 1z95 h LEU 674 Cb 0.49 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.00 1z95 h LEU 674 CO -0.28 0.73 0.06 0.78 0.09 0.00 0.00 178.44 179.83 1z95 h ASN 675 N 0.75 -0.02 -0.11 -0.43 2.35 -1.82 -1.12 115.58 115.18 1z95 h ASN 675 Ca 0.16 0.07 -0.00 0.00 -0.55 0.00 0.00 56.30 55.98 1z95 h ASN 675 Cb 0.30 0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 1z95 h ASN 675 CO 0.00 0.03 0.06 0.58 -1.65 0.00 0.00 177.43 176.45 1z95 h VAL 676 N 0.18 1.10 -0.93 2.81 2.07 -0.46 -1.65 116.25 119.38 1z95 h VAL 676 Ca 0.18 -0.30 0.04 0.00 0.82 0.00 0.00 66.70 67.44 1z95 h VAL 676 Cb 0.22 1.10 -0.05 0.00 -1.52 0.00 0.00 31.29 31.04 1z95 h VAL 676 CO -0.25 0.09 0.61 -0.07 0.02 0.00 0.00 177.57 177.97 1z95 h LEU 677 N 0.07 0.99 -0.51 2.57 3.38 -0.92 -1.41 115.31 119.48 1z95 h LEU 677 Ca 0.04 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.84 1z95 h LEU 677 Cb 0.10 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 1z95 h LEU 677 CO -0.01 0.67 -0.50 -0.33 0.09 0.00 0.00 178.44 178.36 1z95 h GLU 678 N 1.14 0.63 -0.31 1.13 5.08 -1.07 -2.64 114.58 118.55 1z95 h GLU 678 Ca 0.38 -0.37 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 1z95 h GLU 678 Cb 0.05 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1z95 h GLU 678 CO -0.12 0.99 -0.28 0.00 -1.00 0.00 0.00 179.01 178.59 1z95 h ALA 679 N 0.95 0.93 -0.01 3.43 0.00 -0.63 -3.17 119.26 120.76 1z95 h ALA 679 Ca 0.02 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1z95 h ALA 679 Cb 1.05 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1z95 h ALA 679 CO 0.10 0.61 -0.30 0.44 0.00 0.00 0.00 179.25 180.10 1z95 n ILE 680 N -4.09 0.00 -1.68 0.00 -5.35 -0.59 -4.94 119.36 102.70 1z95 n ILE 680 Ca -0.01 -0.16 -0.44 0.00 -0.27 0.00 0.00 62.75 61.88 1z95 n ILE 680 Cb 0.45 0.58 -0.04 0.00 -1.74 0.00 0.00 39.64 38.89 1z95 n ILE 680 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1z95 n GLU 681 N -0.50 2.60 -1.75 6.28 4.07 -1.00 -4.77 120.64 125.57 1z95 n GLU 681 Ca 0.12 0.95 -0.38 0.00 -0.06 0.00 0.00 57.16 57.79 1z95 n GLU 681 Cb 0.37 -2.83 0.05 0.00 -0.06 0.00 0.00 31.44 28.98 1z95 n GLU 681 CO 0.00 0.00 0.00 -2.14 -0.06 0.00 0.00 177.13 174.93 1z95 s PRO 682 N 3.02 2.91 0.00 5.31 0.02 -1.26 -5.03 135.00 139.97 1z95 s PRO 682 Ca 0.85 2.20 0.00 0.00 0.02 0.00 0.00 61.00 64.07 1z95 s PRO 682 Cb -0.54 -2.11 0.00 0.00 0.02 0.00 0.00 34.50 31.87 1z95 s PRO 682 CO 0.41 -1.36 0.00 0.41 -0.33 0.00 0.00 177.00 176.13 1z95 n GLY 683 N 0.80 0.02 3.77 0.52 0.00 -1.26 -5.02 105.19 104.01 1z95 n GLY 683 Ca 0.12 -1.81 -0.41 0.00 0.00 0.00 0.00 46.02 43.92 1z95 n GLY 683 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1z95 s VAL 684 N 0.02 2.46 -0.11 1.61 1.01 -1.26 -5.03 120.40 119.10 1z95 s VAL 684 Ca 0.00 0.44 0.01 0.00 0.00 0.00 0.00 61.98 62.43 1z95 s VAL 684 Cb 0.00 -3.28 0.02 0.00 0.00 0.00 0.00 36.38 33.12 1z95 s VAL 684 CO 0.00 0.10 -0.11 -0.69 0.00 0.00 0.00 175.10 174.39 1z95 s VAL 685 N -0.88 1.27 0.25 2.92 1.01 -1.26 -5.14 120.40 118.56 1z95 s VAL 685 Ca 0.53 -0.47 -0.09 0.00 0.00 0.00 0.00 61.98 61.94 1z95 s VAL 685 Cb -0.43 -1.21 -0.07 0.00 0.00 0.00 0.00 36.38 34.68 1z95 s VAL 685 CO 0.54 0.40 0.56 0.00 0.00 0.00 0.00 175.10 176.60 1z95 h ALA 687 N 2.37 0.65 0.00 0.00 0.00 -1.91 -3.46 119.26 116.90 1z95 h ALA 687 Ca -0.47 -0.70 0.00 0.00 0.00 0.00 0.00 54.91 53.74 1z95 h ALA 687 Cb 1.17 0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1z95 h ALA 687 CO 0.68 0.80 0.00 0.41 0.00 0.00 0.00 179.25 181.14 1z95 n GLY 688 N 1.34 0.47 3.75 0.00 0.00 -1.26 -4.53 105.19 104.96 1z95 n GLY 688 Ca -0.06 -0.86 -0.41 0.00 0.00 0.00 0.00 46.02 44.69 1z95 n GLY 688 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1z95 s HIS 689 N -2.00 3.29 -0.81 1.61 5.04 -1.26 -4.96 115.29 116.20 1z95 s HIS 689 Ca 0.00 1.35 -0.23 0.00 -1.54 0.00 0.00 55.06 54.65 1z95 s HIS 689 Cb 0.00 -3.54 0.07 0.00 0.04 0.00 0.00 32.58 29.15 1z95 s HIS 689 CO 0.00 -1.58 1.17 0.34 -2.34 0.00 0.00 174.74 172.34 1z95 s ASP 690 N 0.00 6.33 0.25 9.88 3.68 -1.26 -4.89 116.67 130.68 1z95 s ASP 690 Ca 0.53 -1.18 0.21 0.00 2.13 0.00 0.00 52.55 54.24 1z95 s ASP 690 Cb -0.36 -2.48 0.98 0.00 -1.45 0.00 0.00 42.92 39.62 1z95 s ASP 690 CO 0.41 -1.47 1.64 0.59 0.13 0.00 0.00 175.17 176.47 1z95 n ASN 691 N 8.10 0.56 -0.57 -0.34 3.02 -1.26 -2.42 115.26 122.34 1z95 n ASN 691 Ca 0.11 0.68 0.12 0.00 -0.03 0.00 0.00 54.58 55.46 1z95 n ASN 691 Cb 0.48 -0.79 0.41 0.00 -0.61 0.00 0.00 39.78 39.27 1z95 n ASN 691 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1z95 n ASN 692 N -2.17 1.74 -4.90 6.41 6.94 -1.26 -4.87 115.26 117.16 1z95 n ASN 692 Ca 0.01 -1.66 -0.31 0.00 -0.02 0.00 0.00 54.58 52.59 1z95 n ASN 692 Cb 0.14 -0.08 -0.04 0.00 -2.36 0.00 0.00 39.78 37.44 1z95 n ASN 692 CO 0.00 0.00 0.00 -1.58 -1.03 0.00 0.00 177.26 174.65 1z95 s GLN 693 N -1.85 3.63 0.53 -3.83 2.00 -1.02 -5.05 119.66 114.08 1z95 s GLN 693 Ca 0.34 -0.07 -0.21 0.00 -2.00 0.00 0.00 55.36 53.42 1z95 s GLN 693 Cb 0.19 -2.81 -0.07 0.00 0.80 0.00 0.00 33.01 31.12 1z95 s GLN 693 CO 0.29 0.42 1.04 -2.30 -0.50 0.00 0.00 175.29 174.24 1z95 n PRO 694 N -0.10 1.19 -2.43 1.67 -0.02 -1.26 -4.86 135.00 129.20 1z95 n PRO 694 Ca -0.02 0.44 -0.38 0.00 -2.02 0.00 0.00 63.50 61.52 1z95 n PRO 694 Cb 0.52 -2.19 -0.02 0.00 -0.02 0.00 0.00 33.50 31.79 1z95 n PRO 694 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1z95 s ASP 695 N -1.01 6.27 0.21 2.55 -0.00 -1.26 -4.89 116.67 118.54 1z95 s ASP 695 Ca 0.71 -2.04 0.06 0.00 -0.00 0.00 0.00 52.55 51.27 1z95 s ASP 695 Cb -0.46 -2.58 -0.04 0.00 -0.00 0.00 0.00 42.92 39.85 1z95 s ASP 695 CO 0.51 -1.76 0.22 -0.94 -0.00 0.00 0.00 175.17 173.20 1z95 s SER 696 N 5.07 5.78 0.13 0.27 1.04 -1.26 -4.89 113.70 119.83 1z95 s SER 696 Ca 0.57 -0.10 -0.21 0.00 0.48 0.00 0.00 55.95 56.69 1z95 s SER 696 Cb 0.02 -1.57 -0.03 0.00 0.10 0.00 0.00 66.02 64.54 1z95 s SER 696 CO 0.06 -0.01 1.69 0.15 0.98 0.00 0.00 173.24 176.11 1z95 h PHE 697 N 1.75 -0.25 -0.25 5.02 3.57 -1.93 -0.75 116.94 124.10 1z95 h PHE 697 Ca -0.49 0.02 0.05 0.00 3.53 0.00 0.00 57.97 61.08 1z95 h PHE 697 Cb 1.22 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 40.05 1z95 h PHE 697 CO 0.54 -0.16 -0.02 0.00 -2.23 0.00 0.00 178.31 176.44 1z95 h ALA 698 N 1.01 0.20 -0.47 2.41 0.00 -1.86 -1.32 119.26 119.23 1z95 h ALA 698 Ca 0.09 0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1z95 h ALA 698 Cb 0.24 0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1z95 h ALA 698 CO -0.21 -0.44 0.00 0.00 0.00 0.00 0.00 179.25 178.60 1z95 h ALA 699 N 1.23 0.63 -0.29 0.00 0.00 -1.81 -1.92 119.26 117.10 1z95 h ALA 699 Ca 0.12 -0.28 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 1z95 h ALA 699 Cb 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1z95 h ALA 699 CO -0.22 0.43 -0.03 -0.07 0.00 0.00 0.00 179.25 179.37 1z95 h LEU 700 N 0.68 0.53 -0.38 0.00 3.38 -0.96 -2.63 115.31 115.94 1z95 h LEU 700 Ca 0.13 -0.33 -0.06 0.00 0.09 0.00 0.00 57.88 57.71 1z95 h LEU 700 Cb 0.50 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1z95 h LEU 700 CO 0.02 0.73 -0.30 -0.07 0.09 0.00 0.00 178.44 178.92 1z95 h LEU 701 N 0.32 0.00 -0.68 1.67 4.07 -1.27 -0.58 115.31 118.84 1z95 h LEU 701 Ca 0.08 0.00 -0.13 0.00 0.08 0.00 0.00 57.88 57.91 1z95 h LEU 701 Cb 0.48 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 1z95 h LEU 701 CO 0.02 0.30 -0.34 0.28 -1.08 0.00 0.00 178.44 177.62 1z95 h SER 702 N 0.00 0.67 -0.17 -0.43 0.02 -1.33 -0.16 113.55 112.15 1z95 h SER 702 Ca -0.00 -0.28 -0.19 0.00 -0.84 0.00 0.00 61.79 60.48 1z95 h SER 702 Cb 1.09 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1z95 h SER 702 CO 0.04 0.95 -0.62 0.28 -1.14 0.00 0.00 176.83 176.34 1z95 h SER 703 N 0.54 0.89 -0.32 3.07 0.02 -1.24 -1.73 113.55 114.77 1z95 h SER 703 Ca 0.06 -0.51 -0.08 0.00 -0.84 0.00 0.00 61.79 60.42 1z95 h SER 703 Cb 0.85 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.11 1z95 h SER 703 CO 0.07 1.30 -0.07 -0.07 -1.14 0.00 0.00 176.83 176.92 1z95 h LEU 704 N 0.58 0.70 -0.30 5.07 3.38 -0.89 -0.37 115.31 123.48 1z95 h LEU 704 Ca -0.01 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.73 1z95 h LEU 704 Cb 1.23 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1z95 h LEU 704 CO 0.13 0.81 0.03 0.78 0.09 0.00 0.00 178.44 180.28 1z95 h ASN 705 N 0.66 0.50 -0.67 -0.43 2.35 -0.95 -1.05 115.58 115.99 1z95 h ASN 705 Ca 0.12 -0.28 -0.02 0.00 -0.55 0.00 0.00 56.30 55.57 1z95 h ASN 705 Cb 0.51 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.72 1z95 h ASN 705 CO 0.03 0.66 0.33 -0.08 -1.65 0.00 0.00 177.43 176.71 1z95 h GLU 706 N 0.32 0.95 -0.83 0.81 4.57 -1.06 -1.54 114.58 117.80 1z95 h GLU 706 Ca 0.09 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.12 1z95 h GLU 706 Cb 0.38 -0.17 -0.04 0.00 -0.16 0.00 0.00 28.75 28.76 1z95 h GLU 706 CO 0.01 0.75 0.46 1.25 -1.18 0.00 0.00 179.01 180.30 1z95 h LEU 707 N 0.92 1.02 -0.60 1.64 5.85 -0.89 -0.17 115.31 123.08 1z95 h LEU 707 Ca 0.23 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1z95 h LEU 707 Cb 0.10 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 40.85 1z95 h LEU 707 CO -0.03 0.81 0.31 1.23 -0.34 0.00 0.00 178.44 180.42 1z95 h GLY 708 N 1.17 0.90 0.97 3.75 0.00 -0.63 0.28 103.07 109.50 1z95 h GLY 708 Ca 0.29 -0.42 0.01 0.00 0.00 0.00 0.00 47.33 47.22 1z95 h GLY 708 CO -0.05 0.40 0.48 -2.09 0.00 0.00 0.00 176.54 175.29 1z95 h GLU 709 N 0.81 0.95 -0.34 4.80 4.57 -0.38 -0.32 114.58 124.66 1z95 h GLU 709 Ca 0.21 -0.06 -0.17 0.00 -1.18 0.00 0.00 59.36 58.16 1z95 h GLU 709 Cb 0.07 -0.21 -0.00 0.00 -0.16 0.00 0.00 28.75 28.44 1z95 h GLU 709 CO -0.03 0.63 -0.46 0.00 -1.18 0.00 0.00 179.01 177.97 1z95 h ARG 710 N 0.98 0.90 -0.06 1.92 3.08 -0.40 -3.13 114.38 117.66 1z95 h ARG 710 Ca 0.28 -0.51 -0.13 0.00 0.07 0.00 0.00 59.98 59.69 1z95 h ARG 710 Cb -0.08 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 1z95 h ARG 710 CO -0.07 1.16 -0.54 1.96 -1.07 0.00 0.00 179.97 181.41 1z95 h GLN 711 N 0.72 0.18 -0.73 0.04 4.20 -0.20 -3.01 115.11 116.31 1z95 h GLN 711 Ca 0.04 -0.11 0.03 0.00 0.06 0.00 0.00 58.65 58.67 1z95 h GLN 711 Cb 1.05 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.80 1z95 h GLN 711 CO 0.11 0.67 0.46 1.25 -0.67 0.00 0.00 178.83 180.65 1z95 h LEU 712 N 0.14 0.75 -0.82 1.46 5.85 -1.03 0.75 115.31 122.41 1z95 h LEU 712 Ca 0.00 -0.00 0.10 0.00 0.84 0.00 0.00 57.88 58.81 1z95 h LEU 712 Cb 1.00 -0.16 -0.07 0.00 0.37 0.00 0.00 40.66 41.79 1z95 h LEU 712 CO 0.08 0.52 0.47 0.58 -0.34 0.00 0.00 178.44 179.75 1z95 h VAL 713 N 0.89 0.90 -0.06 1.05 2.07 -1.48 -0.58 116.25 119.05 1z95 h VAL 713 Ca 0.29 -0.27 -0.19 0.00 0.82 0.00 0.00 66.70 67.35 1z95 h VAL 713 Cb 0.02 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 29.84 1z95 h VAL 713 CO -0.11 0.14 -0.78 0.45 0.02 0.00 0.00 177.57 177.30 1z95 h HIS 714 N 0.78 0.54 -0.53 1.57 3.86 -1.34 -3.09 115.15 116.94 1z95 h HIS 714 Ca 0.40 -0.25 -0.10 0.00 -1.16 0.00 0.00 60.37 59.26 1z95 h HIS 714 Cb 0.37 -0.08 -0.02 0.00 1.06 0.00 0.00 27.41 28.74 1z95 h HIS 714 CO -0.06 1.02 -0.05 0.28 0.86 0.00 0.00 177.93 179.98 1z95 h VAL 715 N 0.26 1.26 -0.13 2.45 2.07 -0.20 -0.89 116.25 121.07 1z95 h VAL 715 Ca -0.04 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.32 1z95 h VAL 715 Cb 1.36 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 1z95 h VAL 715 CO 0.13 0.41 0.06 0.58 0.02 0.00 0.00 177.57 178.77 1z95 h VAL 716 N 0.86 1.13 -0.49 2.57 2.07 -1.13 0.34 116.25 121.61 1z95 h VAL 716 Ca 0.15 -0.39 -0.06 0.00 0.82 0.00 0.00 66.70 67.22 1z95 h VAL 716 Cb 0.57 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.48 1z95 h VAL 716 CO 0.03 0.12 0.06 0.11 0.02 0.00 0.00 177.57 177.91 1z95 h LYS 717 N 0.07 0.77 0.55 1.57 1.57 -1.46 -1.95 116.57 117.69 1z95 h LYS 717 Ca 0.04 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.62 1z95 h LYS 717 Cb 0.14 -0.10 0.01 0.00 0.08 0.00 0.00 32.23 32.35 1z95 h LYS 717 CO -0.00 0.74 -0.26 2.35 -0.57 0.00 0.00 179.45 181.70 1z95 h TRP 718 N 0.73 -0.69 -0.53 -1.35 7.01 -0.88 -2.95 115.95 117.30 1z95 h TRP 718 Ca 0.15 -0.02 0.02 0.00 2.11 0.00 0.00 58.89 61.16 1z95 h TRP 718 Cb 0.37 0.23 -0.03 0.00 -2.10 0.00 0.00 29.16 27.62 1z95 h TRP 718 CO 0.02 -0.40 0.32 0.00 -2.79 0.00 0.00 178.44 175.59 1z95 h ALA 719 N -0.39 0.68 0.00 2.65 0.00 -0.81 -2.07 119.26 119.32 1z95 h ALA 719 Ca -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1z95 h ALA 719 Cb 0.60 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1z95 h ALA 719 CO 0.12 0.03 0.00 1.63 0.00 0.00 0.00 179.25 181.03 1z95 n LYS 720 N -4.78 0.17 -0.06 0.00 5.02 -0.74 -1.45 118.16 116.32 1z95 n LYS 720 Ca 0.04 0.49 0.12 0.00 -2.02 0.00 0.00 58.31 56.94 1z95 n LYS 720 Cb 0.07 -1.89 0.17 0.00 -0.02 0.00 0.00 35.03 33.37 1z95 n LYS 720 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1z95 n ALA 721 N -1.77 2.46 -1.77 7.82 0.00 -0.80 -4.65 120.51 121.80 1z95 n ALA 721 Ca 0.01 -0.76 -0.38 0.00 0.00 0.00 0.00 53.44 52.31 1z95 n ALA 721 Cb 0.16 -0.86 -0.04 0.00 0.00 0.00 0.00 19.45 18.72 1z95 n ALA 721 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1z95 s LEU 722 N -1.84 4.32 0.13 0.00 2.96 -0.53 -4.95 118.68 118.77 1z95 s LEU 722 Ca 0.32 2.19 -0.34 0.00 -0.22 0.00 0.00 54.13 56.09 1z95 s LEU 722 Cb 0.21 -3.92 -0.13 0.00 0.50 0.00 0.00 46.19 42.85 1z95 s LEU 722 CO 0.31 -0.38 1.65 -2.65 -1.32 0.00 0.00 176.35 173.96 1z95 n PRO 723 N 0.48 2.25 -0.39 0.98 -0.02 -1.26 -2.20 135.00 134.85 1z95 n PRO 723 Ca 0.02 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 1z95 n PRO 723 Cb 0.47 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.34 1z95 n PRO 723 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1z95 n GLY 724 N 3.66 1.37 0.37 -1.23 0.00 -1.26 -4.88 105.19 103.22 1z95 n GLY 724 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.17 1z95 n GLY 724 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1z95 h PHE 725 N 0.00 1.23 0.00 1.61 3.57 -1.73 -1.80 116.94 119.82 1z95 h PHE 725 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1z95 h PHE 725 Cb 0.00 -0.42 0.00 0.00 2.79 0.00 0.00 35.95 38.32 1z95 h PHE 725 CO 0.00 0.78 0.00 0.54 -2.23 0.00 0.00 178.31 177.40 1z95 n ARG 726 N -4.40 0.02 0.25 1.11 5.12 -1.26 -1.39 116.66 116.11 1z95 n ARG 726 Ca 0.11 0.40 0.13 0.00 -1.93 0.00 0.00 57.85 56.57 1z95 n ARG 726 Cb 0.02 -1.55 0.53 0.00 -1.16 0.00 0.00 32.46 30.30 1z95 n ARG 726 CO 0.00 0.00 0.00 -0.91 -1.93 0.00 0.00 177.63 174.79 1z95 h ASN 727 N 0.00 0.00 -4.03 0.55 -0.26 -1.72 -3.44 115.58 106.68 1z95 h ASN 727 Ca 0.00 0.00 -0.48 0.00 -0.56 0.00 0.00 56.30 55.26 1z95 h ASN 727 Cb 0.13 0.00 0.03 0.00 -1.06 0.00 0.00 38.32 37.42 1z95 h ASN 727 CO 0.00 0.11 0.41 -0.76 -1.06 0.00 0.00 177.43 176.12 1z95 s LEU 728 N -6.46 3.96 0.35 1.61 1.43 -0.48 -4.98 118.68 114.11 1z95 s LEU 728 Ca 0.01 2.02 -0.29 0.00 -1.03 0.00 0.00 54.13 54.85 1z95 s LEU 728 Cb 0.09 -4.40 -0.11 0.00 0.03 0.00 0.00 46.19 41.80 1z95 s LEU 728 CO 0.60 -0.73 1.48 1.57 0.23 0.00 0.00 176.35 179.50 1z95 n HIS 729 N -0.63 2.82 -0.28 0.29 -0.00 -1.26 -4.73 115.22 111.42 1z95 n HIS 729 Ca 0.08 0.42 0.06 0.00 -0.00 0.00 0.00 57.72 58.27 1z95 n HIS 729 Cb 0.51 -2.53 0.16 0.00 -0.00 0.00 0.00 29.99 28.13 1z95 n HIS 729 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.34 176.62 1z95 h VAL 730 N 2.99 0.22 -0.23 3.57 2.07 -1.93 0.30 116.25 123.24 1z95 h VAL 730 Ca -0.49 -0.02 -0.07 0.00 0.82 0.00 0.00 66.70 66.94 1z95 h VAL 730 Cb 1.25 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1z95 h VAL 730 CO 0.68 0.01 -0.18 0.44 0.02 0.00 0.00 177.57 178.54 1z95 h ASP 731 N 0.04 0.38 0.38 0.57 3.45 -2.01 -2.60 116.42 116.63 1z95 h ASP 731 Ca 0.44 -0.11 -0.11 0.00 0.43 0.00 0.00 57.03 57.68 1z95 h ASP 731 Cb 0.76 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 39.41 1z95 h ASP 731 CO -0.78 0.59 -0.49 0.44 -1.57 0.00 0.00 179.24 177.43 1z95 h ASP 732 N 0.36 0.14 0.17 6.45 3.32 -0.82 -2.27 116.42 123.78 1z95 h ASP 732 Ca 0.06 -0.07 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1z95 h ASP 732 Cb 0.53 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1z95 h ASP 732 CO 0.03 0.61 -0.08 1.56 -1.72 0.00 0.00 179.24 179.64 1z95 h GLN 733 N 0.11 -0.22 -0.45 3.56 4.20 -0.72 -0.69 115.11 120.89 1z95 h GLN 733 Ca 0.00 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 1z95 h GLN 733 Cb 0.90 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 28.71 1z95 h GLN 733 CO 0.07 -0.07 0.20 1.98 -0.67 0.00 0.00 178.83 180.34 1z95 h MET 734 N -0.33 0.66 0.06 1.46 4.05 -1.48 -2.19 114.93 117.16 1z95 h MET 734 Ca -0.02 -0.11 0.01 0.00 -0.28 0.00 0.00 59.70 59.30 1z95 h MET 734 Cb 0.25 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 30.93 1z95 h MET 734 CO 0.04 0.58 -0.08 0.00 0.23 0.00 0.00 176.91 177.68 1z95 h ALA 735 N 1.05 -0.14 -0.79 0.39 0.00 -1.32 -1.45 119.26 117.00 1z95 h ALA 735 Ca 0.15 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.10 1z95 h ALA 735 Cb 0.15 0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 1z95 h ALA 735 CO -0.02 -0.59 0.49 0.28 0.00 0.00 0.00 179.25 179.41 1z95 h VAL 736 N -0.17 1.07 -0.35 0.00 2.07 -1.04 -0.43 116.25 117.39 1z95 h VAL 736 Ca 0.01 -0.32 -0.02 0.00 0.82 0.00 0.00 66.70 67.20 1z95 h VAL 736 Cb 0.18 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 1z95 h VAL 736 CO -0.04 0.17 0.14 0.40 0.02 0.00 0.00 177.57 178.26 1z95 h ILE 737 N 0.92 1.19 -0.53 4.57 2.04 -1.15 -1.95 117.51 122.60 1z95 h ILE 737 Ca 0.33 -0.57 -0.12 0.00 1.00 0.00 0.00 64.86 65.51 1z95 h ILE 737 Cb 0.10 0.90 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 1z95 h ILE 737 CO -0.15 0.20 -0.13 1.56 0.00 0.00 0.00 178.15 179.64 1z95 h GLN 738 N 0.42 1.03 -0.44 2.37 4.20 -0.89 -0.66 115.11 121.14 1z95 h GLN 738 Ca 0.12 -0.39 -0.11 0.00 0.06 0.00 0.00 58.65 58.33 1z95 h GLN 738 Cb 0.18 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 1z95 h GLN 738 CO -0.01 1.08 -0.15 1.88 -0.67 0.00 0.00 178.83 180.96 1z95 h TYR 739 N 0.90 0.93 -0.01 2.96 0.05 -1.03 -3.19 116.97 117.57 1z95 h TYR 739 Ca 0.14 -0.19 0.00 0.00 0.05 0.00 0.00 58.73 58.73 1z95 h TYR 739 Cb 0.70 -0.23 0.00 0.00 1.01 0.00 0.00 36.73 38.21 1z95 h TYR 739 CO 0.05 0.92 -0.24 -1.13 -1.05 0.00 0.00 178.16 176.71 1z95 n SER 740 N -4.14 1.50 -0.16 3.88 3.41 -0.74 -4.48 113.62 112.90 1z95 n SER 740 Ca 0.01 -1.24 -0.03 0.00 -0.26 0.00 0.00 58.87 57.35 1z95 n SER 740 Cb 0.40 0.18 0.03 0.00 -0.26 0.00 0.00 64.21 64.55 1z95 n SER 740 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 1z95 h LEU 741 N 1.99 -0.56 -0.08 1.04 5.85 -1.10 -0.97 115.31 121.49 1z95 h LEU 741 Ca 0.00 0.16 0.03 0.00 0.84 0.00 0.00 57.88 58.91 1z95 h LEU 741 Cb 0.60 0.34 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 1z95 h LEU 741 CO 0.00 -0.19 -0.13 -0.03 -0.34 0.00 0.00 178.44 177.75 1z95 h MET 742 N -0.04 -0.17 -0.74 1.25 4.05 -1.81 -0.65 114.93 116.81 1z95 h MET 742 Ca 0.24 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.64 1z95 h MET 742 Cb 0.40 0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.21 1z95 h MET 742 CO -0.53 -0.12 0.37 0.78 0.23 0.00 0.00 176.91 177.65 1z95 h GLY 743 N -0.18 1.13 0.89 1.39 0.00 -1.77 -0.86 103.07 103.67 1z95 h GLY 743 Ca 0.07 -0.54 0.02 0.00 0.00 0.00 0.00 47.33 46.88 1z95 h GLY 743 CO -0.18 0.52 0.33 1.41 0.00 0.00 0.00 176.54 178.62 1z95 h LEU 744 N 1.03 0.55 -0.72 3.11 3.38 -0.84 -0.48 115.31 121.34 1z95 h LEU 744 Ca 0.26 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.12 1z95 h LEU 744 Cb 0.09 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1z95 h LEU 744 CO -0.04 0.39 -0.19 0.24 0.09 0.00 0.00 178.44 178.93 1z95 h MET 745 N 0.67 0.78 -0.17 1.13 2.86 -0.79 -1.95 114.93 117.47 1z95 h MET 745 Ca 0.22 -0.30 -0.02 0.00 -2.06 0.00 0.00 59.70 57.54 1z95 h MET 745 Cb 0.01 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 1z95 h MET 745 CO -0.09 0.91 0.02 0.28 1.06 0.00 0.00 176.91 179.09 1z95 h VAL 746 N 0.69 1.23 0.04 -2.22 2.07 -0.73 -0.68 116.25 116.64 1z95 h VAL 746 Ca 0.10 -0.75 -0.00 0.00 0.82 0.00 0.00 66.70 66.87 1z95 h VAL 746 Cb 0.69 1.40 0.00 0.00 -1.52 0.00 0.00 31.29 31.87 1z95 h VAL 746 CO 0.05 0.23 -0.02 0.15 0.02 0.00 0.00 177.57 178.00 1z95 h PHE 747 N 0.06 -0.04 -0.82 1.57 3.57 -1.05 -0.16 116.94 120.06 1z95 h PHE 747 Ca 0.05 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 1z95 h PHE 747 Cb 0.32 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.04 1z95 h PHE 747 CO 0.02 0.04 0.41 0.00 -2.23 0.00 0.00 178.31 176.56 1z95 h ALA 748 N 0.84 1.18 -0.66 2.41 0.00 -1.36 -2.22 119.26 119.46 1z95 h ALA 748 Ca -0.00 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1z95 h ALA 748 Cb 0.10 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.54 1z95 h ALA 748 CO 0.01 0.64 0.23 1.98 0.00 0.00 0.00 179.25 182.10 1z95 h MET 749 N 1.16 1.00 -0.21 0.00 1.85 -0.81 -1.32 114.93 116.61 1z95 h MET 749 Ca 0.29 -0.20 -0.05 0.00 -0.61 0.00 0.00 59.70 59.12 1z95 h MET 749 Cb 0.08 -0.15 -0.01 0.00 0.43 0.00 0.00 31.60 31.95 1z95 h MET 749 CO -0.04 0.86 -0.09 0.78 -0.40 0.00 0.00 176.91 178.03 1z95 h GLY 750 N 0.94 0.36 1.35 1.39 0.00 -0.63 -0.86 103.07 105.61 1z95 h GLY 750 Ca 0.21 -0.22 -0.22 0.00 0.00 0.00 0.00 47.33 47.11 1z95 h GLY 750 CO -0.01 0.20 -0.82 -0.25 0.00 0.00 0.00 176.54 175.67 1z95 h TRP 751 N 0.32 0.87 -0.42 5.60 2.91 -0.99 -2.29 115.95 121.94 1z95 h TRP 751 Ca 0.07 -0.40 -0.07 0.00 1.13 0.00 0.00 58.89 59.61 1z95 h TRP 751 Cb 0.36 -0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 28.87 1z95 h TRP 751 CO 0.01 1.21 -0.01 0.00 -1.03 0.00 0.00 178.44 178.62 1z95 h ARG 752 N 0.41 0.76 -0.61 2.65 3.08 -0.84 -1.37 114.38 118.45 1z95 h ARG 752 Ca -0.06 -0.25 -0.03 0.00 0.07 0.00 0.00 59.98 59.71 1z95 h ARG 752 Cb 1.43 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 31.39 1z95 h ARG 752 CO 0.16 0.84 0.26 0.77 -1.07 0.00 0.00 179.97 180.93 1z95 h SER 753 N 0.59 0.80 -0.33 7.04 0.02 -1.19 0.14 113.55 120.62 1z95 h SER 753 Ca 0.12 -0.10 -0.12 0.00 -0.84 0.00 0.00 61.79 60.85 1z95 h SER 753 Cb 0.51 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.83 1z95 h SER 753 CO 0.02 0.71 -0.25 0.15 -1.14 0.00 0.00 176.83 176.32 1z95 h PHE 754 N 0.87 0.89 0.00 3.45 3.57 -1.17 0.43 116.94 124.98 1z95 h PHE 754 Ca 0.21 -0.25 -0.13 0.00 3.53 0.00 0.00 57.97 61.33 1z95 h PHE 754 Cb 0.14 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 1z95 h PHE 754 CO 0.01 1.00 -0.62 1.79 -2.23 0.00 0.00 178.31 178.26 1z95 h THR 755 N 0.52 1.08 0.00 4.41 1.35 -0.99 -2.92 112.91 116.35 1z95 h THR 755 Ca 0.06 -2.50 0.00 0.00 -0.55 0.00 0.00 66.41 63.42 1z95 h THR 755 Cb 0.82 2.51 0.00 0.00 -1.73 0.00 0.00 68.15 69.75 1z95 h THR 755 CO 0.07 0.61 -0.25 0.59 -0.25 0.00 0.00 175.52 176.29 1z95 n ASN 756 N -3.27 0.67 -1.41 5.36 4.13 0.45 -4.65 115.26 116.54 1z95 n ASN 756 Ca 0.01 0.29 0.11 0.00 1.68 0.00 0.00 54.58 56.67 1z95 n ASN 756 Cb 0.78 -0.62 0.33 0.00 -1.54 0.00 0.00 39.78 38.73 1z95 n ASN 756 CO 0.00 0.00 0.00 1.33 0.28 0.00 0.00 177.26 178.87 1z95 n VAL 757 N -3.14 1.28 -3.20 2.41 0.24 -0.92 -4.95 118.33 110.04 1z95 n VAL 757 Ca -0.03 -1.07 -0.23 0.00 -2.04 0.00 0.00 64.34 60.97 1z95 n VAL 757 Cb 0.13 0.38 0.05 0.00 -1.47 0.00 0.00 33.84 32.93 1z95 n VAL 757 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 1z95 n ASN 758 N 1.45 -6.17 0.00 -1.34 4.13 -0.16 -1.76 115.26 111.40 1z95 n ASN 758 Ca 0.25 -0.37 0.00 0.00 1.68 0.00 0.00 54.58 56.14 1z95 n ASN 758 Cb 0.71 -4.95 0.00 0.00 -1.54 0.00 0.00 39.78 34.00 1z95 n ASN 758 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1z95 n SER 759 N -2.67 -4.43 -0.00 6.41 7.64 0.13 -4.84 113.62 115.86 1z95 n SER 759 Ca -0.08 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.69 1z95 n SER 759 Cb 0.60 -2.02 -0.07 0.00 -1.01 0.00 0.00 64.21 61.72 1z95 n SER 759 CO 0.00 0.00 0.00 -0.09 -3.01 0.00 0.00 175.04 171.94 1z95 h ARG 760 N 0.51 0.09 -5.14 1.43 2.43 -1.57 -3.46 114.38 108.67 1z95 h ARG 760 Ca 0.00 -0.02 -0.54 0.00 -0.81 0.00 0.00 59.98 58.61 1z95 h ARG 760 Cb 0.50 -0.01 -0.13 0.00 -0.42 0.00 0.00 29.97 29.90 1z95 h ARG 760 CO 0.00 0.22 -0.55 -1.64 -1.51 0.00 0.00 179.97 176.49 1z95 s MET 761 N -5.56 1.86 -0.39 0.20 -1.94 -1.26 -5.01 119.30 107.19 1z95 s MET 761 Ca -0.14 -2.10 -0.18 0.00 -1.71 0.00 0.00 55.69 51.56 1z95 s MET 761 Cb 0.05 -0.84 0.01 0.00 2.01 0.00 0.00 34.83 36.06 1z95 s MET 761 CO 0.68 -0.34 0.47 -0.51 -0.01 0.00 0.00 175.02 175.30 1z95 s LEU 762 N -3.60 4.63 -1.30 -0.03 1.43 -0.95 -4.83 118.68 114.03 1z95 s LEU 762 Ca 0.27 -0.41 -0.12 0.00 -1.03 0.00 0.00 54.13 52.84 1z95 s LEU 762 Cb 0.05 -2.47 0.14 0.00 0.03 0.00 0.00 46.19 43.94 1z95 s LEU 762 CO 0.14 -0.55 1.83 0.00 0.23 0.00 0.00 176.35 178.00 1z95 n TYR 763 N 5.69 3.58 -0.22 0.29 9.36 -1.26 -0.84 117.16 133.76 1z95 n TYR 763 Ca -0.06 -2.94 -0.07 0.00 3.32 0.00 0.00 57.90 58.15 1z95 n TYR 763 Cb 0.48 -2.14 0.03 0.00 -0.63 0.00 0.00 39.34 37.08 1z95 n TYR 763 CO 0.00 0.00 0.00 0.74 0.22 0.00 0.00 176.86 177.82 1z95 h PHE 764 N 6.20 0.85 -3.10 2.98 -1.00 -1.86 -3.42 116.94 117.59 1z95 h PHE 764 Ca 0.41 -0.03 -0.01 0.00 2.81 0.00 0.00 57.97 61.15 1z95 h PHE 764 Cb 0.70 -0.27 -0.11 0.00 3.61 0.00 0.00 35.95 39.88 1z95 h PHE 764 CO 1.26 0.62 0.15 0.00 -1.61 0.00 0.00 178.31 178.73 1z95 s ALA 765 N -5.80 -1.35 0.43 2.45 0.00 -1.13 -4.98 121.76 111.38 1z95 s ALA 765 Ca -0.13 0.19 0.13 0.00 0.00 0.00 0.00 51.96 52.15 1z95 s ALA 765 Cb 0.13 0.85 1.02 0.00 0.00 0.00 0.00 23.12 25.12 1z95 s ALA 765 CO 0.78 -0.80 1.98 -1.35 0.00 0.00 0.00 175.76 176.38 1z95 h PRO 766 N 2.08 0.40 -0.65 0.00 0.11 -1.89 -1.25 132.00 130.80 1z95 h PRO 766 Ca -0.31 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.78 1z95 h PRO 766 Cb 1.29 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1z95 h PRO 766 CO 0.37 0.27 0.00 -0.40 -0.21 0.00 0.00 178.00 178.03 1z95 n ASP 767 N -4.47 4.62 -3.05 -2.05 5.75 -1.26 -4.59 116.55 111.51 1z95 n ASP 767 Ca 0.09 -2.39 -0.17 0.00 -0.01 0.00 0.00 54.79 52.31 1z95 n ASP 767 Cb 0.35 -0.56 -0.03 0.00 -1.03 0.00 0.00 41.12 39.85 1z95 n ASP 767 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1z95 n LEU 768 N 1.15 -1.33 -4.72 -2.12 7.94 -0.47 -4.53 117.00 112.92 1z95 n LEU 768 Ca 0.25 -3.99 -0.35 0.00 -1.11 0.00 0.00 56.01 50.81 1z95 n LEU 768 Cb 0.85 0.70 -0.08 0.00 0.53 0.00 0.00 43.42 45.41 1z95 n LEU 768 CO 0.23 1.99 -0.20 -0.69 -1.11 0.00 0.00 177.39 177.61 1z95 s VAL 769 N -0.13 5.22 -0.20 1.96 1.01 -1.24 -2.80 120.40 124.22 1z95 s VAL 769 Ca 0.33 0.12 -0.15 0.00 0.00 0.00 0.00 61.98 62.28 1z95 s VAL 769 Cb 0.14 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 1z95 s VAL 769 CO -0.16 0.47 0.35 -0.36 0.00 0.00 0.00 175.10 175.40 1z95 s PHE 770 N 0.17 3.38 0.32 5.22 0.40 -0.02 -4.96 117.98 122.48 1z95 s PHE 770 Ca 0.08 0.55 0.04 0.00 -0.60 0.00 0.00 56.93 57.00 1z95 s PHE 770 Cb -0.11 -2.46 0.04 0.00 0.51 0.00 0.00 43.02 40.99 1z95 s PHE 770 CO -0.01 0.03 0.35 0.27 0.70 0.00 0.00 175.22 176.57 1z95 n ASN 771 N 4.33 1.56 -0.21 1.36 0.23 -1.26 -2.25 115.26 119.03 1z95 n ASN 771 Ca -0.10 -1.96 0.01 0.00 -0.53 0.00 0.00 54.58 52.00 1z95 n ASN 771 Cb 0.51 -0.14 0.26 0.00 -2.08 0.00 0.00 39.78 38.33 1z95 n ASN 771 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1z95 h GLU 772 N 0.00 0.95 -0.07 -3.83 4.39 -1.98 -1.41 114.58 112.64 1z95 h GLU 772 Ca -0.17 -0.06 -0.00 0.00 0.34 0.00 0.00 59.36 59.47 1z95 h GLU 772 Cb 0.71 -0.22 -0.00 0.00 -0.10 0.00 0.00 28.75 29.14 1z95 h GLU 772 CO 0.26 0.63 0.03 -0.92 -1.16 0.00 0.00 179.01 177.85 1z95 h TYR 773 N 0.98 0.10 -0.64 4.33 3.20 -2.00 -2.31 116.97 120.63 1z95 h TYR 773 Ca 0.28 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.10 1z95 h TYR 773 Cb -0.08 -0.03 -0.03 0.00 1.54 0.00 0.00 36.73 38.13 1z95 h TYR 773 CO -0.00 0.19 0.25 0.00 -1.64 0.00 0.00 178.16 176.96 1z95 h ARG 774 N -0.02 0.94 -0.94 1.82 -0.00 -1.87 0.67 114.38 114.98 1z95 h ARG 774 Ca 0.02 -0.15 0.07 0.00 -0.50 0.00 0.00 59.98 59.42 1z95 h ARG 774 Cb 0.13 -0.16 -0.07 0.00 0.00 0.00 0.00 29.97 29.87 1z95 h ARG 774 CO -0.00 0.77 0.60 0.52 0.00 0.00 0.00 179.97 181.86 1z95 h MET 775 N 0.92 1.05 -0.05 0.04 2.86 -1.00 -0.31 114.93 118.44 1z95 h MET 775 Ca 0.22 -0.06 -0.12 0.00 -2.06 0.00 0.00 59.70 57.67 1z95 h MET 775 Cb 0.19 -0.24 0.01 0.00 0.06 0.00 0.00 31.60 31.62 1z95 h MET 775 CO -0.02 0.69 -0.45 1.25 1.06 0.00 0.00 176.91 179.45 1z95 h HIS 776 N 1.08 0.54 0.00 -0.22 -0.00 -0.80 -2.53 115.15 113.22 1z95 h HIS 776 Ca 0.41 -0.26 -0.03 0.00 -0.00 0.00 0.00 60.37 60.50 1z95 h HIS 776 Cb 0.18 -0.07 -0.00 0.00 -0.00 0.00 0.00 27.41 27.52 1z95 h HIS 776 CO -0.02 1.04 -0.12 0.87 -0.00 0.00 0.00 177.93 179.70 1z95 h LYS 777 N -0.12 0.00 -0.00 5.26 1.79 -0.63 -1.64 116.57 121.23 1z95 h LYS 777 Ca -0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 1z95 h LYS 777 Cb 1.13 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.78 1z95 h LYS 777 CO 0.09 0.12 -0.05 -1.13 -1.08 0.00 0.00 179.45 177.41 1z95 n SER 778 N -3.64 0.06 -1.90 0.86 3.41 -0.15 -3.71 113.62 108.55 1z95 n SER 778 Ca -0.02 0.30 -0.20 0.00 -0.26 0.00 0.00 58.87 58.70 1z95 n SER 778 Cb 0.25 -0.39 -0.05 0.00 -0.26 0.00 0.00 64.21 63.76 1z95 n SER 778 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1z95 n ARG 779 N -1.45 -1.48 -0.62 4.33 1.74 -0.62 -4.83 116.66 113.72 1z95 n ARG 779 Ca 0.08 1.08 0.06 0.00 -0.77 0.00 0.00 57.85 58.30 1z95 n ARG 779 Cb 0.32 -5.55 0.16 0.00 -1.02 0.00 0.00 32.46 26.36 1z95 n ARG 779 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 1z95 n MET 780 N -2.67 1.20 -0.00 5.56 2.81 -1.20 -4.88 117.12 117.93 1z95 n MET 780 Ca -0.22 -2.84 -0.09 0.00 -1.81 0.00 0.00 57.70 52.74 1z95 n MET 780 Cb 0.67 -1.29 -0.03 0.00 -0.71 0.00 0.00 33.22 31.86 1z95 n MET 780 CO 0.00 0.00 0.00 -0.92 1.51 0.00 0.00 175.97 176.56 1z95 h TYR 781 N 0.74 -0.38 -0.88 2.03 5.03 -1.76 0.26 116.97 122.01 1z95 h TYR 781 Ca -0.03 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.33 1z95 h TYR 781 Cb 1.16 0.19 -0.05 0.00 1.55 0.00 0.00 36.73 39.58 1z95 h TYR 781 CO 0.48 -0.22 0.57 0.66 -1.32 0.00 0.00 178.16 178.33 1z95 h SER 782 N -0.19 0.95 -0.51 -2.11 4.64 -1.90 -0.92 113.55 113.52 1z95 h SER 782 Ca 0.09 -0.01 -0.11 0.00 -0.47 0.00 0.00 61.79 61.29 1z95 h SER 782 Cb 0.32 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.18 1z95 h SER 782 CO -0.24 0.66 -0.11 1.56 -0.87 0.00 0.00 176.83 177.82 1z95 h GLN 783 N 1.11 0.99 -0.36 4.77 7.50 -1.85 -2.63 115.11 124.65 1z95 h GLN 783 Ca 0.35 -0.37 -0.03 0.00 0.50 0.00 0.00 58.65 59.10 1z95 h GLN 783 Cb -0.01 -0.06 -0.02 0.00 0.05 0.00 0.00 27.48 27.44 1z95 h GLN 783 CO -0.11 1.04 0.09 0.00 -1.50 0.00 0.00 178.83 178.35 1z95 h VAL 785 N 0.52 1.20 -0.85 0.00 2.07 -0.90 -0.52 116.25 117.77 1z95 h VAL 785 Ca 0.12 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 1z95 h VAL 785 Cb 0.19 1.26 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 1z95 h VAL 785 CO -0.00 0.20 0.50 0.03 0.02 0.00 0.00 177.57 178.31 1z95 h ARG 786 N 0.12 1.16 -0.28 1.57 3.08 -1.07 -0.89 114.38 118.07 1z95 h ARG 786 Ca 0.06 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 59.91 1z95 h ARG 786 Cb 0.26 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1z95 h ARG 786 CO -0.00 0.82 -0.21 0.52 -1.07 0.00 0.00 179.97 180.03 1z95 h MET 787 N 1.17 0.52 -0.04 0.04 2.86 -0.85 -1.19 114.93 117.43 1z95 h MET 787 Ca 0.30 -0.18 -0.13 0.00 -2.06 0.00 0.00 59.70 57.63 1z95 h MET 787 Cb -0.03 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.57 1z95 h MET 787 CO -0.06 0.70 -0.58 0.07 1.06 0.00 0.00 176.91 178.11 1z95 h ARG 788 N 0.46 0.14 -0.30 1.72 0.11 -0.46 -1.01 114.38 115.04 1z95 h ARG 788 Ca 0.07 -0.09 -0.01 0.00 0.10 0.00 0.00 59.98 60.05 1z95 h ARG 788 Cb 0.62 0.01 -0.01 0.00 1.11 0.00 0.00 29.97 31.70 1z95 h ARG 788 CO 0.04 0.67 0.14 0.45 0.10 0.00 0.00 179.97 181.38 1z95 h HIS 789 N 0.10 0.44 0.00 4.08 3.86 -0.46 -0.45 115.15 122.73 1z95 h HIS 789 Ca -0.00 -0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1z95 h HIS 789 Cb 1.05 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 29.37 1z95 h HIS 789 CO 0.01 0.40 -0.03 1.25 0.86 0.00 0.00 177.93 180.42 1z95 h LEU 790 N 0.35 -0.10 -0.85 2.43 6.46 -1.00 -1.75 115.31 120.86 1z95 h LEU 790 Ca 0.10 0.01 0.14 0.00 -0.12 0.00 0.00 57.88 58.02 1z95 h LEU 790 Cb 0.13 0.04 -0.09 0.00 -0.73 0.00 0.00 40.66 40.01 1z95 h LEU 790 CO -0.01 -0.05 0.44 -1.28 -0.62 0.00 0.00 178.44 176.92 1z95 h SER 791 N -0.06 0.55 0.14 1.25 0.87 -0.92 0.48 113.55 115.86 1z95 h SER 791 Ca 0.01 0.09 -0.06 0.00 -1.23 0.00 0.00 61.79 60.60 1z95 h SER 791 Cb 0.08 -0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 1z95 h SER 791 CO -0.03 0.24 -0.22 1.56 -0.53 0.00 0.00 176.83 177.85 1z95 h GLN 792 N 0.65 0.16 -0.45 2.24 4.20 -0.54 -2.58 115.11 118.79 1z95 h GLN 792 Ca 0.46 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 59.15 1z95 h GLN 792 Cb 0.62 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.36 1z95 h GLN 792 CO -0.35 0.38 0.30 0.93 -0.67 0.00 0.00 178.83 179.43 1z95 h GLU 793 N 0.15 0.48 -0.64 1.46 4.39 -0.02 -0.11 114.58 120.29 1z95 h GLU 793 Ca 0.03 -0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.75 1z95 h GLU 793 Cb 0.48 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.99 1z95 h GLU 793 CO 0.03 0.32 0.42 0.74 -1.16 0.00 0.00 179.01 179.36 1z95 h PHE 794 N 0.49 0.67 0.01 4.33 0.04 -1.39 0.19 116.94 121.29 1z95 h PHE 794 Ca 0.18 0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.97 1z95 h PHE 794 Cb 0.11 -0.22 0.00 0.00 2.20 0.00 0.00 35.95 38.04 1z95 h PHE 794 CO -0.00 0.37 -0.01 0.78 -0.60 0.00 0.00 178.31 178.86 1z95 h GLY 795 N 0.68 -0.02 1.17 -1.45 0.00 -1.19 -1.45 103.07 100.81 1z95 h GLY 795 Ca 0.27 0.01 0.07 0.00 0.00 0.00 0.00 47.33 47.67 1z95 h GLY 795 CO -0.08 -0.01 0.38 1.49 0.00 0.00 0.00 176.54 178.33 1z95 h TRP 796 N -0.95 0.50 -0.01 5.60 6.55 -0.93 -0.65 115.95 126.05 1z95 h TRP 796 Ca -0.00 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.85 1z95 h TRP 796 Cb 0.79 -0.16 0.00 0.00 -0.86 0.00 0.00 29.16 28.92 1z95 h TRP 796 CO 0.21 0.26 -0.23 1.28 -1.05 0.00 0.00 178.44 178.92 1z95 n LEU 797 N -4.47 1.55 -3.84 -4.49 4.77 0.65 -4.96 117.00 106.21 1z95 n LEU 797 Ca 0.08 -0.50 -0.26 0.00 -0.03 0.00 0.00 56.01 55.30 1z95 n LEU 797 Cb 0.28 -0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.34 1z95 n LEU 797 CO 0.34 0.28 0.00 0.00 -1.33 0.00 0.00 177.39 176.68 1z95 n GLN 798 N -0.13 -5.03 -1.81 3.23 6.02 -0.25 -4.88 117.38 114.54 1z95 n GLN 798 Ca 0.13 0.58 -0.42 0.00 -0.01 0.00 0.00 57.00 57.29 1z95 n GLN 798 Cb 0.40 -5.27 -0.02 0.00 1.02 0.00 0.00 30.24 26.37 1z95 n GLN 798 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1z95 s ILE 799 N -3.51 2.20 0.51 5.09 -1.09 -0.59 -5.00 121.20 118.82 1z95 s ILE 799 Ca 0.34 0.16 -0.05 0.00 -2.23 0.00 0.00 60.65 58.87 1z95 s ILE 799 Cb -0.17 -3.10 -0.02 0.00 -1.58 0.00 0.00 42.46 37.59 1z95 s ILE 799 CO 0.83 0.02 0.81 0.42 -1.23 0.00 0.00 174.94 175.78 1z95 s THR 800 N 0.66 4.41 0.33 2.92 -4.23 -1.26 -4.90 115.64 113.57 1z95 s THR 800 Ca 0.69 0.05 0.02 0.00 -1.18 0.00 0.00 61.69 61.26 1z95 s THR 800 Cb -0.47 -3.69 0.28 0.00 1.34 0.00 0.00 72.50 69.95 1z95 s THR 800 CO 0.38 -0.67 1.95 -0.65 -0.54 0.00 0.00 174.62 175.10 1z95 h PRO 801 N 0.12 0.91 -0.55 3.99 0.11 -1.99 -0.00 132.00 134.59 1z95 h PRO 801 Ca -0.46 -0.05 -0.11 0.00 0.11 0.00 0.00 66.00 65.48 1z95 h PRO 801 Cb 1.23 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 32.11 1z95 h PRO 801 CO 0.61 0.60 -0.08 1.96 -0.21 0.00 0.00 178.00 180.88 1z95 h GLN 802 N 0.94 1.03 -0.47 1.05 7.50 -1.99 -0.49 115.11 122.68 1z95 h GLN 802 Ca 0.33 -0.37 -0.08 0.00 0.50 0.00 0.00 58.65 59.02 1z95 h GLN 802 Cb 0.12 -0.07 -0.02 0.00 0.05 0.00 0.00 27.48 27.56 1z95 h GLN 802 CO -0.10 1.06 -0.03 0.93 -1.50 0.00 0.00 178.83 179.19 1z95 h GLU 803 N 0.91 0.84 -0.37 1.46 5.08 -1.77 -1.80 114.58 118.94 1z95 h GLU 803 Ca 0.15 -0.28 0.02 0.00 -1.00 0.00 0.00 59.36 58.24 1z95 h GLU 803 Cb 0.65 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 1z95 h GLU 803 CO 0.04 0.91 0.21 0.35 -1.00 0.00 0.00 179.01 179.52 1z95 h PHE 804 N 0.69 0.39 -0.43 4.33 3.57 -0.80 0.14 116.94 124.83 1z95 h PHE 804 Ca 0.13 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 1z95 h PHE 804 Cb 0.54 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 1z95 h PHE 804 CO 0.04 0.22 0.21 -0.07 -2.23 0.00 0.00 178.31 176.48 1z95 h LEU 805 N 0.42 0.57 -0.45 0.59 3.38 -0.92 -0.77 115.31 118.13 1z95 h LEU 805 Ca 0.15 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.93 1z95 h LEU 805 Cb 0.03 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1z95 h LEU 805 CO -0.08 0.54 0.04 0.00 0.09 0.00 0.00 178.44 179.02 1z95 h MET 807 N 0.61 1.14 -0.40 0.00 2.86 -0.81 -1.47 114.93 116.86 1z95 h MET 807 Ca 0.13 -0.17 -0.12 0.00 -2.06 0.00 0.00 59.70 57.48 1z95 h MET 807 Cb 0.44 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.89 1z95 h MET 807 CO 0.02 0.88 -0.24 -0.22 1.06 0.00 0.00 176.91 178.41 1z95 h LYS 808 N 1.12 0.83 -0.48 1.72 3.64 -1.02 -1.46 116.57 120.92 1z95 h LYS 808 Ca 0.27 -0.35 -0.03 0.00 -1.27 0.00 0.00 60.65 59.27 1z95 h LYS 808 Cb 0.14 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1z95 h LYS 808 CO -0.03 0.98 0.19 0.00 -2.27 0.00 0.00 179.45 178.32 1z95 h ALA 809 N 1.01 0.63 -0.77 5.00 0.00 -1.14 -2.45 119.26 121.53 1z95 h ALA 809 Ca 0.09 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1z95 h ALA 809 Cb 0.77 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1z95 h ALA 809 CO 0.06 0.24 0.51 1.25 0.00 0.00 0.00 179.25 181.31 1z95 h LEU 810 N 0.64 0.85 -1.88 0.00 6.46 -0.95 -2.09 115.31 118.34 1z95 h LEU 810 Ca 0.16 -0.02 0.07 0.00 -0.12 0.00 0.00 57.88 57.98 1z95 h LEU 810 Cb 0.20 -0.20 -0.02 0.00 -0.73 0.00 0.00 40.66 39.91 1z95 h LEU 810 CO -0.01 0.60 0.25 -0.07 -0.62 0.00 0.00 178.44 178.58 1z95 h LEU 811 N 0.99 0.13 -1.69 2.25 3.38 -0.77 -0.29 115.31 119.30 1z95 h LEU 811 Ca 0.30 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.23 1z95 h LEU 811 Cb -0.03 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1z95 h LEU 811 CO -0.08 0.08 -0.17 0.25 0.09 0.00 0.00 178.44 178.61 1z95 h LEU 812 N 0.14 0.00 -3.88 1.67 5.85 -1.31 -2.65 115.31 115.13 1z95 h LEU 812 Ca 0.16 0.00 -0.55 0.00 0.84 0.00 0.00 57.88 58.33 1z95 h LEU 812 Cb 0.46 0.00 -0.29 0.00 0.37 0.00 0.00 40.66 41.20 1z95 h LEU 812 CO -0.02 0.17 0.47 0.49 -0.34 0.00 0.00 178.44 179.21 1z95 n PHE 813 N -4.23 2.83 -0.56 1.25 3.72 -0.12 -4.58 117.46 115.76 1z95 n PHE 813 Ca -0.02 -2.41 0.05 0.00 -0.05 0.00 0.00 57.45 55.02 1z95 n PHE 813 Cb 0.24 -1.04 0.08 0.00 -0.94 0.00 0.00 39.48 37.82 1z95 n PHE 813 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1z95 n SER 814 N -0.99 2.25 -3.66 4.37 7.64 -1.00 -4.95 113.62 117.28 1z95 n SER 814 Ca 0.56 -2.57 -0.09 0.00 1.01 0.00 0.00 58.87 57.78 1z95 n SER 814 Cb 1.03 -0.23 -0.10 0.00 -1.01 0.00 0.00 64.21 63.90 1z95 n SER 814 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 1z95 s ILE 815 N -1.99 -0.52 0.16 0.44 2.07 -1.26 0.75 121.20 120.85 1z95 s ILE 815 Ca 0.18 0.15 -0.08 0.00 -1.41 0.00 0.00 60.65 59.49 1z95 s ILE 815 Cb 0.15 -0.66 -0.01 0.00 0.13 0.00 0.00 42.46 42.07 1z95 s ILE 815 CO 0.02 0.06 0.26 0.27 -1.91 0.00 0.00 174.94 173.65 1z95 s ILE 816 N 2.36 0.07 0.32 2.00 -4.36 -0.87 -4.82 121.20 115.90 1z95 s ILE 816 Ca -0.03 -1.43 -0.29 0.00 -0.26 0.00 0.00 60.65 58.64 1z95 s ILE 816 Cb -0.11 -1.85 -0.10 0.00 1.25 0.00 0.00 42.46 41.64 1z95 s ILE 816 CO -0.13 -0.32 1.39 -2.84 0.24 0.00 0.00 174.94 173.28 1z95 s PRO 817 N -3.97 4.27 0.49 0.37 0.02 -1.26 -1.41 135.00 133.51 1z95 s PRO 817 Ca 0.18 2.32 0.15 0.00 0.02 0.00 0.00 61.00 63.67 1z95 s PRO 817 Cb 0.04 -3.06 1.14 0.00 0.02 0.00 0.00 34.50 32.64 1z95 s PRO 817 CO -0.00 -0.33 2.08 0.28 -0.33 0.00 0.00 177.00 178.70 1z95 h VAL 818 N 3.15 1.05 -0.10 3.83 2.07 -1.19 -0.36 116.25 124.70 1z95 h VAL 818 Ca -0.49 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1z95 h VAL 818 Cb 1.23 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 1z95 h VAL 818 CO 0.68 0.07 0.00 0.47 0.02 0.00 0.00 177.57 178.82 1z95 n ASP 819 N -4.46 0.94 0.00 0.57 10.43 -1.26 -5.03 116.55 117.74 1z95 n ASP 819 Ca -0.02 -1.62 0.00 0.00 2.57 0.00 0.00 54.79 55.71 1z95 n ASP 819 Cb 0.15 -0.07 0.00 0.00 1.84 0.00 0.00 41.12 43.04 1z95 n ASP 819 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1z95 n GLY 820 N 0.96 -1.43 3.96 0.44 0.00 -0.15 -5.03 105.19 103.94 1z95 n GLY 820 Ca 0.14 -1.56 -0.26 0.00 0.00 0.00 0.00 46.02 44.34 1z95 n GLY 820 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1z95 s LEU 821 N -3.09 2.86 0.13 0.99 1.43 -1.26 -4.73 118.68 115.02 1z95 s LEU 821 Ca 0.00 0.06 -0.21 0.00 -1.03 0.00 0.00 54.13 52.95 1z95 s LEU 821 Cb 0.00 -2.41 -0.01 0.00 0.03 0.00 0.00 46.19 43.80 1z95 s LEU 821 CO 0.00 -2.04 1.68 0.11 0.23 0.00 0.00 176.35 176.33 1z95 h LYS 822 N -0.87 -0.11 -3.10 1.70 1.79 -1.96 -3.26 116.57 110.75 1z95 h LYS 822 Ca -0.41 0.01 -0.62 0.00 -2.18 0.00 0.00 60.65 57.44 1z95 h LYS 822 Cb 1.27 0.02 -0.41 0.00 -1.58 0.00 0.00 32.23 31.53 1z95 h LYS 822 CO 0.45 -0.07 -0.61 -0.80 -1.08 0.00 0.00 179.45 177.34 1z95 s ASN 823 N -5.12 4.48 0.26 0.86 -0.87 -1.26 -4.95 114.94 108.34 1z95 s ASN 823 Ca -0.14 -3.58 0.00 0.00 -1.57 0.00 0.00 52.86 47.57 1z95 s ASN 823 Cb 0.11 -1.55 0.34 0.00 -0.02 0.00 0.00 41.25 40.13 1z95 s ASN 823 CO 0.68 -0.13 1.69 -0.61 -2.57 0.00 0.00 177.10 176.17 1z95 h GLN 824 N 5.70 0.58 -0.90 -0.60 5.75 -1.94 -3.10 115.11 120.59 1z95 h GLN 824 Ca 0.10 -0.22 -0.01 0.00 -0.15 0.00 0.00 58.65 58.36 1z95 h GLN 824 Cb 0.80 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 29.27 1z95 h GLN 824 CO 0.68 0.77 0.52 0.87 -2.65 0.00 0.00 178.83 179.02 1z95 h LYS 825 N 0.51 1.24 -0.41 1.69 1.57 -1.93 0.59 116.57 119.84 1z95 h LYS 825 Ca 0.08 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.67 1z95 h LYS 825 Cb 0.68 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 1z95 h LYS 825 CO 0.05 0.89 0.05 0.74 -0.57 0.00 0.00 179.45 180.60 1z95 h PHE 826 N 1.25 0.74 -0.12 -1.35 0.04 -1.95 -1.62 116.94 113.93 1z95 h PHE 826 Ca 0.32 -0.11 0.02 0.00 2.80 0.00 0.00 57.97 61.00 1z95 h PHE 826 Cb -0.01 -0.20 -0.02 0.00 2.20 0.00 0.00 35.95 37.92 1z95 h PHE 826 CO 0.01 0.73 0.01 0.35 -0.60 0.00 0.00 178.31 178.80 1z95 h PHE 827 N 0.53 0.01 -1.01 -0.55 3.57 -1.38 -0.78 116.94 117.33 1z95 h PHE 827 Ca 0.12 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.70 1z95 h PHE 827 Cb 0.40 0.01 -0.07 0.00 2.79 0.00 0.00 35.95 39.09 1z95 h PHE 827 CO 0.03 -0.01 0.65 -0.44 -2.23 0.00 0.00 178.31 176.32 1z95 h ASP 828 N 0.05 1.04 -0.07 0.41 3.32 -0.77 0.11 116.42 120.51 1z95 h ASP 828 Ca 0.05 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.11 1z95 h ASP 828 Cb 0.06 -0.21 -0.00 0.00 0.22 0.00 0.00 39.33 39.39 1z95 h ASP 828 CO -0.09 0.67 0.03 -0.08 -1.72 0.00 0.00 179.24 178.05 1z95 h GLU 829 N 1.18 0.10 -0.24 3.56 4.22 -0.89 -2.03 114.58 120.48 1z95 h GLU 829 Ca 0.43 -0.02 -0.01 0.00 0.08 0.00 0.00 59.36 59.84 1z95 h GLU 829 Cb 0.17 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1z95 h GLU 829 CO -0.17 0.23 0.10 1.25 -2.18 0.00 0.00 179.01 178.24 1z95 h LEU 830 N -0.05 0.33 -0.65 1.64 5.85 -0.63 -1.88 115.31 119.92 1z95 h LEU 830 Ca 0.02 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.64 1z95 h LEU 830 Cb 0.17 -0.09 -0.06 0.00 0.37 0.00 0.00 40.66 41.06 1z95 h LEU 830 CO -0.00 0.40 0.35 -0.09 -0.34 0.00 0.00 178.44 178.76 1z95 h ARG 831 N 0.24 0.62 -0.98 1.25 2.43 -0.77 -0.85 114.38 116.33 1z95 h ARG 831 Ca 0.08 -0.04 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 1z95 h ARG 831 Cb 0.17 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 29.53 1z95 h ARG 831 CO -0.01 0.41 0.65 1.98 -1.51 0.00 0.00 179.97 181.50 1z95 h MET 832 N 0.64 1.29 -0.50 0.20 4.05 -1.13 -1.24 114.93 118.25 1z95 h MET 832 Ca 0.30 -0.08 -0.01 0.00 -0.28 0.00 0.00 59.70 59.62 1z95 h MET 832 Cb 0.21 -0.29 -0.02 0.00 -0.80 0.00 0.00 31.60 30.69 1z95 h MET 832 CO -0.19 0.86 0.26 -0.91 0.23 0.00 0.00 176.91 177.15 1z95 h ASN 833 N 1.33 0.64 0.27 1.39 -0.26 -0.37 -1.02 115.58 117.56 1z95 h ASN 833 Ca 0.36 -0.11 -0.07 0.00 -0.56 0.00 0.00 56.30 55.92 1z95 h ASN 833 Cb -0.15 -0.16 -0.01 0.00 -1.06 0.00 0.00 38.32 36.94 1z95 h ASN 833 CO -0.08 0.57 -0.32 1.88 -1.06 0.00 0.00 177.43 178.42 1z95 h TYR 834 N 0.66 0.09 -0.45 1.19 0.05 -0.79 -0.92 116.97 116.80 1z95 h TYR 834 Ca 0.17 -0.02 -0.13 0.00 0.05 0.00 0.00 58.73 58.80 1z95 h TYR 834 Cb 0.08 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 1z95 h TYR 834 CO -0.01 0.40 -0.25 0.82 -1.05 0.00 0.00 178.16 178.07 1z95 h ILE 835 N 0.08 1.27 -0.59 -2.88 2.04 -0.79 -2.24 117.51 114.40 1z95 h ILE 835 Ca 0.01 -1.41 0.00 0.00 1.00 0.00 0.00 64.86 64.47 1z95 h ILE 835 Cb 0.60 1.18 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 1z95 h ILE 835 CO 0.04 0.48 0.39 0.11 0.00 0.00 0.00 178.15 179.17 1z95 h LYS 836 N 0.81 0.79 -0.51 2.37 1.79 -0.32 -1.69 116.57 119.80 1z95 h LYS 836 Ca 0.10 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.49 1z95 h LYS 836 Cb 0.82 -0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.27 1z95 h LYS 836 CO 0.07 0.53 0.20 0.93 -1.08 0.00 0.00 179.45 180.10 1z95 h GLU 837 N 0.80 0.73 -0.45 3.15 4.39 -0.97 -0.10 114.58 122.13 1z95 h GLU 837 Ca 0.22 -0.10 -0.10 0.00 0.34 0.00 0.00 59.36 59.72 1z95 h GLU 837 Cb -0.08 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.42 1z95 h GLU 837 CO -0.05 0.60 -0.11 1.25 -1.16 0.00 0.00 179.01 179.55 1z95 h LEU 838 N 0.72 0.81 -0.62 1.33 5.85 -0.87 -1.62 115.31 120.92 1z95 h LEU 838 Ca 0.18 -0.25 -0.09 0.00 0.84 0.00 0.00 57.88 58.56 1z95 h LEU 838 Cb 0.14 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 1z95 h LEU 838 CO -0.02 0.94 0.04 -0.78 -0.34 0.00 0.00 178.44 178.29 1z95 h ASP 839 N 0.74 1.04 -0.55 1.25 -0.00 -0.39 -2.14 116.42 116.37 1z95 h ASP 839 Ca 0.12 -0.29 -0.10 0.00 -0.00 0.00 0.00 57.03 56.76 1z95 h ASP 839 Cb 0.60 -0.28 -0.02 0.00 -0.00 0.00 0.00 39.33 39.63 1z95 h ASP 839 CO 0.04 1.07 -0.05 0.03 -0.00 0.00 0.00 179.24 180.33 1z95 h ARG 840 N 0.97 1.03 -0.42 0.28 3.08 -0.77 -0.91 114.38 117.64 1z95 h ARG 840 Ca 0.18 -0.35 -0.10 0.00 0.07 0.00 0.00 59.98 59.79 1z95 h ARG 840 Cb 0.51 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.46 1z95 h ARG 840 CO 0.02 1.03 -0.13 0.97 -1.07 0.00 0.00 179.97 180.79 1z95 h ILE 841 N 0.93 1.26 -0.30 2.04 2.10 -1.15 -2.69 117.51 119.70 1z95 h ILE 841 Ca 0.16 -1.21 -0.05 0.00 1.08 0.00 0.00 64.86 64.84 1z95 h ILE 841 Cb 0.61 1.08 -0.01 0.00 -1.09 0.00 0.00 36.82 37.41 1z95 h ILE 841 CO 0.04 0.41 -0.02 0.40 -1.08 0.00 0.00 178.15 177.90 1z95 h ILE 842 N 0.70 1.27 -3.65 2.19 2.04 -1.19 -3.50 117.51 115.37 1z95 h ILE 842 Ca 0.11 -0.99 -0.58 0.00 1.00 0.00 0.00 64.86 64.40 1z95 h ILE 842 Cb 0.62 1.32 -0.09 0.00 -0.74 0.00 0.00 36.82 37.93 1z95 h ILE 842 CO 0.04 0.32 0.77 0.00 0.00 0.00 0.00 178.15 179.28 1z95 s ALA 843 N -4.92 3.18 0.00 1.87 0.00 -0.36 -5.11 121.76 116.41 1z95 s ALA 843 Ca -0.13 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.17 1z95 s ALA 843 Cb 0.08 -3.79 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1z95 s ALA 843 CO 0.77 -2.21 0.00 0.00 0.00 0.00 0.00 175.76 174.32 1z95 h SER 853 N 0.00 1.02 -0.43 0.00 0.02 -1.99 -0.28 113.55 111.89 1z95 h SER 853 Ca 0.00 -0.22 -0.06 0.00 -0.84 0.00 0.00 61.79 60.68 1z95 h SER 853 Cb 0.00 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.25 1z95 h SER 853 CO 0.00 0.97 0.04 -0.09 -1.14 0.00 0.00 176.83 176.62 1z95 h ARG 854 N 1.03 0.73 -0.51 3.45 2.43 -2.05 -1.26 114.38 118.20 1z95 h ARG 854 Ca 0.22 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1z95 h ARG 854 Cb 0.33 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 1z95 h ARG 854 CO -0.00 0.78 0.31 -0.09 -1.51 0.00 0.00 179.97 179.45 1z95 h ARG 855 N 0.58 0.69 -0.69 0.20 9.65 -1.93 -0.50 114.38 122.38 1z95 h ARG 855 Ca 0.13 -0.06 -0.05 0.00 -1.10 0.00 0.00 59.98 58.90 1z95 h ARG 855 Cb 0.42 -0.15 -0.03 0.00 -1.39 0.00 0.00 29.97 28.82 1z95 h ARG 855 CO 0.01 0.50 0.23 0.35 2.80 0.00 0.00 179.97 183.86 1z95 h PHE 856 N 0.68 1.08 -0.13 2.20 3.57 -0.88 0.13 116.94 123.58 1z95 h PHE 856 Ca 0.18 -0.09 -0.00 0.00 3.53 0.00 0.00 57.97 61.59 1z95 h PHE 856 Cb -0.02 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.40 1z95 h PHE 856 CO -0.03 0.85 0.08 -0.92 -2.23 0.00 0.00 178.31 176.06 1z95 h TYR 857 N 1.02 0.18 -0.38 0.41 3.20 -0.73 -1.09 116.97 119.57 1z95 h TYR 857 Ca 0.23 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.09 1z95 h TYR 857 Cb 0.26 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.46 1z95 h TYR 857 CO 0.02 0.16 0.21 1.96 -1.64 0.00 0.00 178.16 178.87 1z95 h GLN 858 N 0.14 0.54 -0.35 1.82 4.20 -0.71 -1.34 115.11 119.42 1z95 h GLN 858 Ca 0.05 -0.07 -0.14 0.00 0.06 0.00 0.00 58.65 58.56 1z95 h GLN 858 Cb 0.04 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 1z95 h GLN 858 CO -0.01 0.45 -0.33 -0.07 -0.67 0.00 0.00 178.83 178.20 1z95 h LEU 859 N 0.49 0.81 -0.82 1.46 3.38 -0.90 -1.27 115.31 118.46 1z95 h LEU 859 Ca 0.13 -0.34 -0.12 0.00 0.09 0.00 0.00 57.88 57.64 1z95 h LEU 859 Cb 0.07 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1z95 h LEU 859 CO -0.02 1.07 -0.54 0.71 0.09 0.00 0.00 178.44 179.75 1z95 h THR 860 N 0.65 1.37 -0.42 0.22 1.35 -1.13 -1.36 112.91 113.59 1z95 h THR 860 Ca 0.07 -1.84 -0.09 0.00 -0.55 0.00 0.00 66.41 64.00 1z95 h THR 860 Cb 0.87 1.94 -0.01 0.00 -1.73 0.00 0.00 68.15 69.22 1z95 h THR 860 CO 0.08 0.54 -0.09 0.50 -0.25 0.00 0.00 175.52 176.30 1z95 h LYS 861 N 0.11 0.80 -0.28 4.72 1.63 -1.04 -1.29 116.57 121.23 1z95 h LYS 861 Ca -0.00 -0.30 -0.01 0.00 -0.85 0.00 0.00 60.65 59.49 1z95 h LYS 861 Cb 0.99 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 32.56 1z95 h LYS 861 CO 0.08 0.92 0.12 1.25 -3.45 0.00 0.00 179.45 178.37 1z95 h LEU 862 N 0.63 0.37 -0.66 5.20 5.85 -1.01 -1.83 115.31 123.86 1z95 h LEU 862 Ca 0.11 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.72 1z95 h LEU 862 Cb 0.61 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.50 1z95 h LEU 862 CO 0.04 0.41 0.40 -0.07 -0.34 0.00 0.00 178.44 178.88 1z95 h LEU 863 N 0.31 0.64 -1.09 2.25 3.38 -1.13 -1.85 115.31 117.81 1z95 h LEU 863 Ca 0.09 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.08 1z95 h LEU 863 Cb 0.14 -0.13 -0.05 0.00 0.09 0.00 0.00 40.66 40.72 1z95 h LEU 863 CO -0.01 0.44 0.61 0.44 0.09 0.00 0.00 178.44 180.01 1z95 h ASP 864 N 0.78 1.06 0.08 -0.43 3.32 -0.96 -2.45 116.42 117.82 1z95 h ASP 864 Ca 0.27 -0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1z95 h ASP 864 Cb 0.06 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1z95 h ASP 864 CO -0.12 0.77 0.00 0.77 -1.72 0.00 0.00 179.24 178.93 1z95 h SER 865 N 1.25 0.00 0.16 6.45 4.64 -0.47 -2.23 113.55 123.36 1z95 h SER 865 Ca 0.34 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.48 1z95 h SER 865 Cb -0.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 61.95 1z95 h SER 865 CO -0.07 0.00 -0.68 0.58 -0.87 0.00 0.00 176.83 175.78 1z95 h VAL 866 N 0.00 1.35 0.00 0.95 2.07 -1.40 -3.35 116.25 115.88 1z95 h VAL 866 Ca 0.00 -2.03 0.01 0.00 0.82 0.00 0.00 66.70 65.50 1z95 h VAL 866 Cb 0.04 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1z95 h VAL 866 CO 0.00 0.62 -0.04 1.56 0.02 0.00 0.00 177.57 179.73 1z95 h GLN 867 N 0.34 -0.07 -0.76 1.57 1.08 -1.54 -0.59 115.11 115.13 1z95 h GLN 867 Ca -0.02 0.00 0.07 0.00 -1.45 0.00 0.00 58.65 57.25 1z95 h GLN 867 Cb 1.25 0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 28.65 1z95 h GLN 867 CO 0.12 -0.05 0.50 -1.35 -0.95 0.00 0.00 178.83 177.10 1z95 h PRO 868 N -0.07 0.77 -0.02 1.46 0.11 -1.72 0.30 132.00 132.82 1z95 h PRO 868 Ca 0.02 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 1z95 h PRO 868 Cb 0.09 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 31.03 1z95 h PRO 868 CO -0.04 0.51 -0.00 0.82 -0.21 0.00 0.00 178.00 179.08 1z95 h ILE 869 N 0.79 1.25 -0.90 4.15 2.04 -1.58 -2.43 117.51 120.83 1z95 h ILE 869 Ca 0.33 -0.76 0.08 0.00 1.00 0.00 0.00 64.86 65.52 1z95 h ILE 869 Cb 0.27 1.73 -0.07 0.00 -0.74 0.00 0.00 36.82 38.01 1z95 h ILE 869 CO -0.11 0.20 0.55 0.00 0.00 0.00 0.00 178.15 178.79 1z95 h ALA 870 N 0.69 1.27 -0.54 1.87 0.00 -0.49 -1.93 119.26 120.14 1z95 h ALA 870 Ca 0.01 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.95 1z95 h ALA 870 Cb 0.32 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 1z95 h ALA 870 CO 0.00 0.25 0.32 -0.09 0.00 0.00 0.00 179.25 179.73 1z95 h ARG 871 N 0.96 0.61 -0.59 0.00 9.65 -0.83 0.15 114.38 124.33 1z95 h ARG 871 Ca 0.41 -0.04 -0.08 0.00 -1.10 0.00 0.00 59.98 59.18 1z95 h ARG 871 Cb 0.28 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.69 1z95 h ARG 871 CO -0.21 0.41 0.06 0.93 2.80 0.00 0.00 179.97 183.96 1z95 h GLU 872 N 0.63 0.98 -0.47 0.20 5.08 -0.87 -1.19 114.58 118.95 1z95 h GLU 872 Ca 0.22 -0.27 -0.10 0.00 -1.00 0.00 0.00 59.36 58.21 1z95 h GLU 872 Cb 0.03 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1z95 h GLU 872 CO -0.10 0.93 -0.13 -0.07 -1.00 0.00 0.00 179.01 178.64 1z95 h LEU 873 N 0.92 0.87 -0.40 1.33 3.38 -0.91 -0.92 115.31 119.59 1z95 h LEU 873 Ca 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 1z95 h LEU 873 Cb 0.45 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 1z95 h LEU 873 CO 0.02 1.01 0.21 0.45 0.09 0.00 0.00 178.44 180.21 1z95 h HIS 874 N 0.78 0.56 -0.24 1.13 3.86 -0.33 0.14 115.15 121.06 1z95 h HIS 874 Ca 0.12 -0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 1z95 h HIS 874 Cb 0.64 -0.18 -0.01 0.00 1.06 0.00 0.00 27.41 28.93 1z95 h HIS 874 CO 0.04 0.45 0.10 0.37 0.86 0.00 0.00 177.93 179.74 1z95 h GLN 875 N 0.51 0.35 -0.50 2.45 5.75 -1.03 -0.76 115.11 121.88 1z95 h GLN 875 Ca 0.14 -0.06 -0.01 0.00 -0.15 0.00 0.00 58.65 58.56 1z95 h GLN 875 Cb 0.09 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.55 1z95 h GLN 875 CO -0.02 0.40 0.26 0.35 -2.65 0.00 0.00 178.83 177.17 1z95 h PHE 876 N 0.23 0.70 -0.62 3.99 3.04 -1.01 -1.81 116.94 121.47 1z95 h PHE 876 Ca 0.08 -0.02 -0.03 0.00 3.98 0.00 0.00 57.97 61.97 1z95 h PHE 876 Cb 0.17 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 38.43 1z95 h PHE 876 CO -0.01 0.53 0.27 1.15 -2.02 0.00 0.00 178.31 178.23 1z95 h THR 877 N 0.67 1.23 0.29 4.41 2.02 -0.58 -0.67 112.91 120.28 1z95 h THR 877 Ca 0.18 -0.68 -0.01 0.00 0.77 0.00 0.00 66.41 66.66 1z95 h THR 877 Cb 0.07 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1z95 h THR 877 CO -0.03 0.27 -0.14 0.15 0.37 0.00 0.00 175.52 176.15 1z95 h PHE 878 N 0.86 -0.36 -0.98 3.16 3.57 -0.98 -1.08 116.94 121.13 1z95 h PHE 878 Ca 0.21 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.76 1z95 h PHE 878 Cb 0.17 0.12 -0.06 0.00 2.79 0.00 0.00 35.95 38.97 1z95 h PHE 878 CO 0.01 -0.16 0.63 -0.44 -2.23 0.00 0.00 178.31 176.13 1z95 h ASP 879 N -0.49 1.01 -0.57 0.41 3.32 -1.23 -2.10 116.42 116.76 1z95 h ASP 879 Ca -0.04 0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.97 1z95 h ASP 879 Cb 0.37 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.68 1z95 h ASP 879 CO 0.07 0.65 0.17 0.25 -1.72 0.00 0.00 179.24 178.66 1z95 h LEU 880 N 1.15 0.84 -0.17 1.55 5.85 -0.90 -2.51 115.31 121.12 1z95 h LEU 880 Ca 0.42 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 1z95 h LEU 880 Cb 0.15 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 40.96 1z95 h LEU 880 CO -0.16 0.83 0.10 0.25 -0.34 0.00 0.00 178.44 179.12 1z95 h LEU 881 N 0.81 0.20 -1.14 2.25 5.85 -0.64 0.31 115.31 122.94 1z95 h LEU 881 Ca 0.18 -0.04 0.13 0.00 0.84 0.00 0.00 57.88 58.99 1z95 h LEU 881 Cb 0.29 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.19 1z95 h LEU 881 CO -0.00 0.19 0.60 0.40 -0.34 0.00 0.00 178.44 179.28 1z95 h ILE 882 N 0.20 0.87 -0.43 4.05 1.08 -1.22 -2.04 117.51 120.02 1z95 h ILE 882 Ca 0.06 -0.29 0.00 0.00 -0.39 0.00 0.00 64.86 64.24 1z95 h ILE 882 Cb 0.02 -0.05 0.00 0.00 -3.07 0.00 0.00 36.82 33.72 1z95 h ILE 882 CO -0.01 0.15 0.00 2.29 -0.69 0.00 0.00 178.15 179.89 1z95 n LYS 883 N -4.60 3.23 -0.11 2.37 2.85 -0.96 -4.68 118.16 116.26 1z95 n LYS 883 Ca 0.18 -2.61 0.08 0.00 -1.05 0.00 0.00 58.31 54.92 1z95 n LYS 883 Cb 0.42 -1.68 0.43 0.00 -0.65 0.00 0.00 35.03 33.55 1z95 n LYS 883 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 1z95 h SER 884 N 2.69 0.50 0.76 -5.58 4.64 0.37 -1.72 113.55 115.21 1z95 h SER 884 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1z95 h SER 884 Cb 1.23 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 1z95 h SER 884 CO 0.16 0.32 0.00 1.12 -0.87 0.00 0.00 176.83 177.56 1z95 h HIS 885 N 0.57 0.00 0.00 4.77 2.07 -1.82 -2.47 115.15 118.28 1z95 h HIS 885 Ca 0.27 0.00 -0.02 0.00 -2.85 0.00 0.00 60.37 57.77 1z95 h HIS 885 Cb 0.33 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.31 1z95 h HIS 885 CO -0.00 0.00 -1.72 -1.33 -3.07 0.00 0.00 177.93 171.81 1z95 n MET 886 N -2.83 0.64 -0.28 5.12 2.00 -0.66 -4.31 117.12 116.80 1z95 n MET 886 Ca 0.00 -0.09 0.07 0.00 0.00 0.00 0.00 57.70 57.69 1z95 n MET 886 Cb 0.24 -1.62 0.21 0.00 0.00 0.00 0.00 33.22 32.05 1z95 n MET 886 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 175.97 177.30 1z95 n VAL 887 N -2.42 1.32 -3.73 2.03 0.24 -1.12 -4.99 118.33 109.66 1z95 n VAL 887 Ca -0.05 -1.19 -0.26 0.00 -2.04 0.00 0.00 64.34 60.81 1z95 n VAL 887 Cb 0.60 0.32 0.05 0.00 -1.47 0.00 0.00 33.84 33.35 1z95 n VAL 887 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1z95 n SER 888 N 0.47 -5.16 -4.51 -1.34 7.64 -0.98 -4.55 113.62 105.18 1z95 n SER 888 Ca 0.16 -0.66 -0.34 0.00 1.01 0.00 0.00 58.87 59.04 1z95 n SER 888 Cb 0.57 -4.49 -0.12 0.00 -1.01 0.00 0.00 64.21 59.16 1z95 n SER 888 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1z95 s VAL 889 N -3.34 4.00 -0.14 0.44 1.01 -0.97 -4.76 120.40 116.64 1z95 s VAL 889 Ca 0.55 -0.32 -0.09 0.00 0.00 0.00 0.00 61.98 62.13 1z95 s VAL 889 Cb -0.26 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 1z95 s VAL 889 CO 0.78 0.49 0.16 -1.81 0.00 0.00 0.00 175.10 174.72 1z95 s ASP 890 N 0.38 6.37 -0.14 3.32 1.11 -1.26 -4.62 116.67 121.82 1z95 s ASP 890 Ca -0.03 0.43 0.02 0.00 0.18 0.00 0.00 52.55 53.15 1z95 s ASP 890 Cb -0.14 -2.09 0.00 0.00 1.07 0.00 0.00 42.92 41.76 1z95 s ASP 890 CO 0.03 0.32 -0.19 -0.36 1.18 0.00 0.00 175.17 176.15 1z95 s PHE 891 N -0.55 2.71 0.91 4.23 0.40 -1.26 -4.58 117.98 119.85 1z95 s PHE 891 Ca 0.14 -1.12 -0.11 0.00 -0.60 0.00 0.00 56.93 55.24 1z95 s PHE 891 Cb -0.12 -1.83 0.14 0.00 0.51 0.00 0.00 43.02 41.72 1z95 s PHE 891 CO 0.03 -0.50 1.12 -2.14 0.70 0.00 0.00 175.22 174.43 1z95 s PRO 892 N 0.72 1.06 0.11 0.24 0.02 -1.26 -4.74 135.00 131.15 1z95 s PRO 892 Ca -0.08 1.34 -0.32 0.00 0.02 0.00 0.00 61.00 61.96 1z95 s PRO 892 Cb -0.16 -1.75 -0.10 0.00 0.02 0.00 0.00 34.50 32.51 1z95 s PRO 892 CO 0.01 -2.53 1.58 1.49 -0.33 0.00 0.00 177.00 177.21 1z95 h GLU 893 N -1.79 -0.63 -0.59 5.54 4.81 -1.99 -1.63 114.58 118.30 1z95 h GLU 893 Ca -0.46 0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 58.81 1z95 h GLU 893 Cb 1.27 0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.76 1z95 h GLU 893 CO 0.45 -0.42 0.33 0.52 -0.73 0.00 0.00 179.01 179.16 1z95 h MET 894 N -0.65 0.80 -0.29 1.92 2.86 -2.00 -1.67 114.93 115.91 1z95 h MET 894 Ca 0.02 -0.08 -0.07 0.00 -2.06 0.00 0.00 59.70 57.51 1z95 h MET 894 Cb 0.69 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 32.18 1z95 h MET 894 CO -0.29 0.59 -0.11 0.52 1.06 0.00 0.00 176.91 178.68 1z95 h MET 895 N 0.81 0.59 -0.71 1.72 2.86 -1.89 -1.59 114.93 116.72 1z95 h MET 895 Ca 0.21 -0.24 0.02 0.00 -2.06 0.00 0.00 59.70 57.63 1z95 h MET 895 Cb 0.01 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 31.61 1z95 h MET 895 CO -0.04 0.80 0.47 0.00 1.06 0.00 0.00 176.91 179.21 1z95 h ALA 896 N 0.77 1.56 -0.13 6.32 0.00 -0.91 0.57 119.26 127.43 1z95 h ALA 896 Ca 0.07 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1z95 h ALA 896 Cb 0.61 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 1z95 h ALA 896 CO 0.04 0.38 -0.11 1.49 0.00 0.00 0.00 179.25 181.05 1z95 h GLU 897 N 0.90 0.30 -0.70 0.00 4.81 -1.14 -2.60 114.58 116.14 1z95 h GLU 897 Ca 0.28 -0.15 -0.06 0.00 -0.13 0.00 0.00 59.36 59.29 1z95 h GLU 897 Cb 0.00 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 1z95 h GLU 897 CO -0.07 0.68 0.19 0.82 -0.73 0.00 0.00 179.01 179.90 1z95 h ILE 898 N -0.08 1.26 -0.21 2.32 2.04 -0.80 0.17 117.51 122.21 1z95 h ILE 898 Ca 0.02 -0.94 -0.10 0.00 1.00 0.00 0.00 64.86 64.85 1z95 h ILE 898 Cb 0.62 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 1z95 h ILE 898 CO 0.03 0.36 -0.30 0.40 0.00 0.00 0.00 178.15 178.64 1z95 h ILE 899 N 1.06 1.28 0.00 -0.67 2.04 -0.93 -0.98 117.51 119.30 1z95 h ILE 899 Ca 0.22 -1.34 0.00 0.00 1.00 0.00 0.00 64.86 64.75 1z95 h ILE 899 Cb 0.34 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.87 1z95 h ILE 899 CO -0.00 0.42 -1.15 -1.54 0.00 0.00 0.00 178.15 175.88 1z95 n SER 900 N -4.10 0.61 -0.09 1.72 3.41 -0.98 -3.89 113.62 110.30 1z95 n SER 900 Ca -0.01 0.05 -0.15 0.00 -0.26 0.00 0.00 58.87 58.50 1z95 n SER 900 Cb 0.43 0.81 -0.07 0.00 -0.26 0.00 0.00 64.21 65.12 1z95 n SER 900 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1z95 n VAL 901 N -2.29 0.99 -0.10 -3.33 0.31 0.03 -4.68 118.33 109.27 1z95 n VAL 901 Ca 0.00 -0.32 -0.24 0.00 -0.01 0.00 0.00 64.34 63.78 1z95 n VAL 901 Cb 0.50 -1.40 -0.12 0.00 -0.91 0.00 0.00 33.84 31.91 1z95 n VAL 901 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1z95 n GLN 902 N -3.38 0.61 -0.22 5.55 1.13 -0.48 -4.40 117.38 116.20 1z95 n GLN 902 Ca -0.33 0.39 0.06 0.00 -1.94 0.00 0.00 57.00 55.18 1z95 n GLN 902 Cb 0.79 -1.65 0.32 0.00 0.11 0.00 0.00 30.24 29.81 1z95 n GLN 902 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1z95 h VAL 903 N -0.71 1.03 0.00 5.09 2.07 -1.41 -1.24 116.25 121.07 1z95 h VAL 903 Ca -0.49 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 66.71 1z95 h VAL 903 Cb 1.58 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.46 1z95 h VAL 903 CO -0.21 0.15 -0.18 -0.65 0.02 0.00 0.00 177.57 176.70 1z95 h PRO 904 N 0.84 0.00 -0.35 1.57 0.11 -1.79 -0.75 132.00 131.62 1z95 h PRO 904 Ca 0.34 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.37 1z95 h PRO 904 Cb 0.26 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.36 1z95 h PRO 904 CO -0.12 0.18 -0.13 0.87 -0.21 0.00 0.00 178.00 178.59 1z95 h LYS 905 N 0.00 0.61 -0.01 1.05 1.57 -1.43 0.13 116.57 118.49 1z95 h LYS 905 Ca -0.00 -0.20 -0.03 0.00 -1.87 0.00 0.00 60.65 58.55 1z95 h LYS 905 Cb 0.44 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1z95 h LYS 905 CO 0.02 0.73 -0.12 0.82 -0.57 0.00 0.00 179.45 180.33 1z95 h ILE 906 N 0.56 1.53 0.00 1.86 2.04 -1.21 0.13 117.51 122.42 1z95 h ILE 906 Ca 0.10 -1.74 -0.02 0.00 1.00 0.00 0.00 64.86 64.19 1z95 h ILE 906 Cb 0.56 2.64 -0.00 0.00 -0.74 0.00 0.00 36.82 39.28 1z95 h ILE 906 CO 0.04 0.47 -0.10 -0.07 0.00 0.00 0.00 178.15 178.48 1z95 h LEU 907 N -0.55 0.00 -1.15 1.44 3.38 -1.03 -1.91 115.31 115.49 1z95 h LEU 907 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1z95 h LEU 907 Cb 0.83 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1z95 h LEU 907 CO 0.02 0.10 -0.02 -1.54 0.09 0.00 0.00 178.44 177.10 1z95 n SER 908 N -3.54 1.81 0.00 -0.43 3.41 0.45 -4.95 113.62 110.36 1z95 n SER 908 Ca -0.02 -1.58 0.00 0.00 -0.26 0.00 0.00 58.87 57.02 1z95 n SER 908 Cb 0.24 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 1z95 n SER 908 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1z95 n GLY 909 N 1.22 0.66 0.10 5.00 0.00 -0.72 -4.94 105.19 106.52 1z95 n GLY 909 Ca 0.17 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.17 1z95 n GLY 909 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1z95 h LYS 910 N 2.01 0.00 -4.83 1.61 1.57 -1.01 -3.44 116.57 112.49 1z95 h LYS 910 Ca 0.00 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.18 1z95 h LYS 910 Cb 0.00 0.00 -0.34 0.00 0.08 0.00 0.00 32.23 31.97 1z95 h LYS 910 CO 0.00 0.68 -0.84 0.08 -0.57 0.00 0.00 179.45 178.80 1z95 s VAL 911 N -2.83 1.60 0.04 0.50 1.01 -0.66 -0.63 120.40 119.44 1z95 s VAL 911 Ca 0.02 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.32 1z95 s VAL 911 Cb 0.09 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.99 1z95 s VAL 911 CO 0.79 0.46 -0.10 -0.54 0.00 0.00 0.00 175.10 175.70 1z95 s LYS 912 N 0.96 0.68 0.76 2.72 1.02 -0.50 -4.27 119.74 121.10 1z95 s LYS 912 Ca -0.07 -0.74 -0.12 0.00 0.02 0.00 0.00 55.97 55.06 1z95 s LYS 912 Cb -0.15 -0.58 0.05 0.00 -0.52 0.00 0.00 37.83 36.63 1z95 s LYS 912 CO -0.02 0.13 1.11 -1.25 -0.92 0.00 0.00 175.35 174.41 1z95 s PRO 913 N -1.36 2.22 -0.47 -1.68 0.04 -1.26 -2.06 135.00 130.44 1z95 s PRO 913 Ca -0.04 1.34 -0.13 0.00 0.04 0.00 0.00 61.00 62.21 1z95 s PRO 913 Cb -0.09 -1.88 0.09 0.00 0.04 0.00 0.00 34.50 32.66 1z95 s PRO 913 CO 0.01 -1.69 0.36 0.42 0.04 0.00 0.00 177.00 176.14 1z95 s ILE 914 N -2.63 4.78 0.34 0.56 1.01 0.23 -4.88 121.20 120.60 1z95 s ILE 914 Ca 0.65 -1.33 -0.14 0.00 0.00 0.00 0.00 60.65 59.83 1z95 s ILE 914 Cb -0.20 -3.94 -0.08 0.00 0.01 0.00 0.00 42.46 38.25 1z95 s ILE 914 CO 0.51 -0.62 0.74 -0.31 0.00 0.00 0.00 174.94 175.26 1z95 s TYR 915 N 1.53 3.40 -0.14 3.97 1.51 -1.26 -4.90 117.35 121.46 1z95 s TYR 915 Ca 0.04 1.16 -0.23 0.00 -1.01 0.00 0.00 57.07 57.04 1z95 s TYR 915 Cb -0.25 -2.50 -0.25 0.00 -0.11 0.00 0.00 41.96 38.85 1z95 s TYR 915 CO 0.04 0.05 0.57 0.74 -1.11 0.00 0.00 175.55 175.84 1z95 h PHE 916 N 2.02 0.19 -0.03 2.71 0.04 -1.98 -3.52 116.94 116.37 1z95 h PHE 916 Ca -0.48 -0.14 0.00 0.00 2.80 0.00 0.00 57.97 60.16 1z95 h PHE 916 Cb 1.18 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 39.32 1z95 h PHE 916 CO 0.61 1.32 0.00 0.72 -0.60 0.00 0.00 178.31 180.37