#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yrb h ARG 488 N 0.00 0.63 -0.00 0.03 3.08 -1.77 -1.14 114.38 115.22 1yrb h ARG 488 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1yrb h ARG 488 Cb 0.00 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 29.91 1yrb h ARG 488 CO 0.00 0.42 -0.02 0.41 -1.07 0.00 0.00 179.97 179.71 1yrb n GLY 489 N -1.47 -0.81 3.76 0.04 0.00 -1.26 -4.83 105.19 100.62 1yrb n GLY 489 Ca 0.05 -0.26 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 1yrb n GLY 489 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1yrb s SER 490 N -2.14 5.56 -0.80 1.61 0.01 -0.43 -4.96 113.70 112.55 1yrb s SER 490 Ca 0.41 2.38 -0.16 0.00 1.31 0.00 0.00 55.95 59.89 1yrb s SER 490 Cb 0.21 -2.60 0.18 0.00 0.21 0.00 0.00 66.02 64.02 1yrb s SER 490 CO 0.39 -1.34 0.82 -1.00 0.41 0.00 0.00 173.24 172.52 1yrb s HIS 491 N -1.58 3.48 0.43 2.43 3.76 -1.26 -4.98 115.29 117.58 1yrb s HIS 491 Ca 0.72 -1.67 -0.24 0.00 -0.15 0.00 0.00 55.06 53.71 1yrb s HIS 491 Cb -0.30 -3.95 -0.08 0.00 1.11 0.00 0.00 32.58 29.36 1yrb s HIS 491 CO 0.34 -1.15 1.20 -1.01 -0.85 0.00 0.00 174.74 173.28 1yrb s HIS 492 N 1.17 2.92 -0.15 1.40 3.76 -1.26 -5.01 115.29 118.12 1yrb s HIS 492 Ca 0.19 1.51 -0.05 0.00 -0.15 0.00 0.00 55.06 56.56 1yrb s HIS 492 Cb -0.12 -3.46 -0.04 0.00 1.11 0.00 0.00 32.58 30.07 1yrb s HIS 492 CO -0.06 -1.60 0.04 -1.58 -0.85 0.00 0.00 174.74 170.69 1yrb s HIS 493 N -1.42 3.23 -0.18 1.40 2.46 -1.26 -4.80 115.29 114.71 1yrb s HIS 493 Ca 0.60 0.09 -0.04 0.00 0.47 0.00 0.00 55.06 56.18 1yrb s HIS 493 Cb -0.32 -1.97 -0.02 0.00 -0.13 0.00 0.00 32.58 30.14 1yrb s HIS 493 CO 0.40 0.26 -0.03 -1.58 -2.47 0.00 0.00 174.74 171.32 1yrb s HIS 494 N -0.09 3.00 -0.39 3.88 2.46 -1.26 -4.93 115.29 117.96 1yrb s HIS 494 Ca 0.06 -0.49 -0.28 0.00 0.47 0.00 0.00 55.06 54.81 1yrb s HIS 494 Cb -0.12 -2.03 -0.02 0.00 -0.13 0.00 0.00 32.58 30.27 1yrb s HIS 494 CO 0.01 -0.22 1.88 -1.01 -2.47 0.00 0.00 174.74 172.93 1yrb s HIS 495 N 0.83 1.69 0.17 3.88 3.76 -1.26 -4.88 115.29 119.47 1yrb s HIS 495 Ca -0.00 0.72 -0.32 0.00 -0.15 0.00 0.00 55.06 55.30 1yrb s HIS 495 Cb -0.14 -4.07 -0.17 0.00 1.11 0.00 0.00 32.58 29.31 1yrb s HIS 495 CO 0.02 -2.87 0.96 1.58 -0.85 0.00 0.00 174.74 173.59 1yrb n HIS 496 N 11.27 0.73 0.00 1.40 -0.00 -1.26 -1.06 115.22 126.29 1yrb n HIS 496 Ca 0.24 0.82 0.00 0.00 0.46 0.00 0.00 57.72 59.24 1yrb n HIS 496 Cb 0.48 -2.16 0.00 0.00 -0.12 0.00 0.00 29.99 28.19 1yrb n HIS 496 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1yrb n GLY 497 N 1.82 3.04 3.72 1.57 0.00 -0.87 -4.98 105.19 109.50 1yrb n GLY 497 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1yrb n GLY 497 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1yrb s MET 498 N -0.12 4.16 0.43 1.61 0.00 -0.23 -4.86 119.30 120.30 1yrb s MET 498 Ca 0.00 2.51 -0.24 0.00 0.00 0.00 0.00 55.69 57.96 1yrb s MET 498 Cb 0.00 -3.10 -0.10 0.00 0.00 0.00 0.00 34.83 31.63 1yrb s MET 498 CO 0.00 -0.68 1.02 0.00 0.00 0.00 0.00 175.02 175.36 1yrb n ALA 499 N 3.81 0.25 -2.02 4.11 0.00 -1.26 -4.86 120.51 120.54 1yrb n ALA 499 Ca 0.14 0.22 -0.19 0.00 0.00 0.00 0.00 53.44 53.61 1yrb n ALA 499 Cb 0.37 -2.09 0.05 0.00 0.00 0.00 0.00 19.45 17.77 1yrb n ALA 499 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1yrb s SER 500 N -0.76 5.20 -0.24 0.00 0.01 -1.25 -4.95 113.70 111.72 1yrb s SER 500 Ca 0.64 -0.63 -0.07 0.00 1.31 0.00 0.00 55.95 57.20 1yrb s SER 500 Cb -0.54 -0.08 -0.03 0.00 0.21 0.00 0.00 66.02 65.58 1yrb s SER 500 CO 0.56 -1.21 0.07 -0.04 0.41 0.00 0.00 173.24 173.03 1yrb s MET 1 N -4.63 3.72 -0.25 12.44 1.00 0.11 -5.00 119.30 126.69 1yrb s MET 1 Ca 0.60 -0.45 -0.10 0.00 0.00 0.00 0.00 55.69 55.74 1yrb s MET 1 Cb -0.07 -3.32 -0.05 0.00 0.00 0.00 0.00 34.83 31.40 1yrb s MET 1 CO 0.38 -0.11 0.15 0.42 0.00 0.00 0.00 175.02 175.86 1yrb s ILE 2 N 1.41 5.12 -0.12 2.53 1.01 -1.26 -0.78 121.20 129.11 1yrb s ILE 2 Ca 0.05 0.10 0.03 0.00 0.00 0.00 0.00 60.65 60.83 1yrb s ILE 2 Cb -0.15 -3.41 0.01 0.00 0.01 0.00 0.00 42.46 38.92 1yrb s ILE 2 CO 0.04 0.31 -0.21 -0.69 0.00 0.00 0.00 174.94 174.39 1yrb s VAL 3 N 1.40 1.95 -0.18 2.92 1.01 -0.10 -1.16 120.40 126.25 1yrb s VAL 3 Ca 0.07 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.12 1yrb s VAL 3 Cb -0.15 -1.72 0.01 0.00 0.00 0.00 0.00 36.38 34.53 1yrb s VAL 3 CO 0.07 0.53 -0.17 -0.69 0.00 0.00 0.00 175.10 174.84 1yrb s VAL 4 N 0.68 2.33 -0.21 2.92 1.01 0.60 -0.59 120.40 127.15 1yrb s VAL 4 Ca -0.11 -0.86 -0.12 0.00 0.00 0.00 0.00 61.98 60.89 1yrb s VAL 4 Cb -0.16 -1.99 -0.05 0.00 0.00 0.00 0.00 36.38 34.18 1yrb s VAL 4 CO 0.02 0.52 0.24 -0.36 0.00 0.00 0.00 175.10 175.52 1yrb s PHE 5 N 1.23 3.38 0.04 5.22 0.08 -0.64 -0.36 117.98 126.93 1yrb s PHE 5 Ca 0.03 0.42 0.03 0.00 0.12 0.00 0.00 56.93 57.53 1yrb s PHE 5 Cb -0.14 -2.33 -0.02 0.00 -0.57 0.00 0.00 43.02 39.96 1yrb s PHE 5 CO -0.09 0.12 -0.10 0.08 -0.10 0.00 0.00 175.22 175.13 1yrb s VAL 6 N 0.88 0.75 0.00 -0.44 1.01 -0.29 -3.64 120.40 118.67 1yrb s VAL 6 Ca 0.12 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.18 1yrb s VAL 6 Cb -0.13 -0.73 0.00 0.00 0.00 0.00 0.00 36.38 35.52 1yrb s VAL 6 CO 0.04 -0.16 0.00 0.61 0.00 0.00 0.00 175.10 175.59 1yrb n GLY 7 N 1.84 1.48 3.72 4.51 0.00 -1.26 -0.89 105.19 114.59 1yrb n GLY 7 Ca -0.19 -0.85 -0.30 0.00 0.00 0.00 0.00 46.02 44.68 1yrb n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1yrb s THR 8 N -2.00 2.82 0.24 2.61 -1.32 -1.26 -3.70 115.64 113.04 1yrb s THR 8 Ca 0.00 0.27 -0.31 0.00 -1.21 0.00 0.00 61.69 60.43 1yrb s THR 8 Cb 0.00 -2.68 -0.12 0.00 -1.51 0.00 0.00 72.50 68.19 1yrb s THR 8 CO 0.00 -0.35 1.58 0.00 -2.21 0.00 0.00 174.62 173.64 1yrb n ALA 9 N -3.83 2.12 -0.44 11.08 0.00 -1.03 -1.62 120.51 126.79 1yrb n ALA 9 Ca 0.08 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.92 1yrb n ALA 9 Cb 0.54 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.57 1yrb n ALA 9 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yrb n GLY 10 N 2.75 1.05 0.22 0.00 0.00 -1.26 -4.94 105.19 103.01 1yrb n GLY 10 Ca 0.12 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.24 1yrb n GLY 10 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yrb h SER 11 N 0.00 0.00 0.00 1.61 4.64 -1.64 -3.47 113.55 114.69 1yrb h SER 11 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yrb h SER 11 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1yrb h SER 11 CO 0.00 0.20 0.00 0.61 -0.87 0.00 0.00 176.83 176.77 1yrb n GLY 12 N 0.44 1.63 0.13 -0.77 0.00 -1.26 -4.75 105.19 100.60 1yrb n GLY 12 Ca 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 1yrb n GLY 12 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1yrb h LYS 13 N 0.00 0.13 -0.31 1.61 1.57 -1.90 0.01 116.57 117.66 1yrb h LYS 13 Ca 0.00 -0.01 -0.16 0.00 -1.87 0.00 0.00 60.65 58.61 1yrb h LYS 13 Cb 0.00 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 1yrb h LYS 13 CO 0.00 0.08 -0.44 1.15 -0.57 0.00 0.00 179.45 179.67 1yrb h THR 14 N 0.13 1.28 -0.65 -0.16 2.02 -1.95 0.58 112.91 114.16 1yrb h THR 14 Ca 0.13 -1.63 -0.05 0.00 0.77 0.00 0.00 66.41 65.64 1yrb h THR 14 Cb 0.16 1.56 -0.03 0.00 -1.74 0.00 0.00 68.15 68.10 1yrb h THR 14 CO -0.20 0.53 0.20 0.74 0.37 0.00 0.00 175.52 177.17 1yrb h THR 15 N 0.64 1.25 -0.39 3.16 2.02 -1.92 -1.94 112.91 115.73 1yrb h THR 15 Ca 0.03 -0.86 -0.11 0.00 0.77 0.00 0.00 66.41 66.25 1yrb h THR 15 Cb 1.05 0.58 -0.01 0.00 -1.74 0.00 0.00 68.15 68.03 1yrb h THR 15 CO 0.10 0.33 -0.18 0.25 0.37 0.00 0.00 175.52 176.40 1yrb h LEU 16 N 0.94 0.82 -0.47 2.58 5.85 -0.85 -1.11 115.31 123.07 1yrb h LEU 16 Ca 0.21 -0.40 0.08 0.00 0.84 0.00 0.00 57.88 58.60 1yrb h LEU 16 Cb 0.30 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 1yrb h LEU 16 CO -0.01 1.04 0.10 0.74 -0.34 0.00 0.00 178.44 179.98 1yrb h THR 17 N 0.60 0.76 -0.16 1.05 2.02 -0.71 0.71 112.91 117.18 1yrb h THR 17 Ca 0.09 -0.08 -0.06 0.00 0.77 0.00 0.00 66.41 67.12 1yrb h THR 17 Cb 0.73 0.49 -0.00 0.00 -1.74 0.00 0.00 68.15 67.63 1yrb h THR 17 CO 0.05 0.04 -0.14 1.23 0.37 0.00 0.00 175.52 177.08 1yrb h GLY 18 N 0.24 0.41 1.22 2.16 0.00 -1.16 -2.10 103.07 103.85 1yrb h GLY 18 Ca 0.23 -0.41 -0.24 0.00 0.00 0.00 0.00 47.33 46.91 1yrb h GLY 18 CO -0.29 0.37 -0.87 -2.09 0.00 0.00 0.00 176.54 173.66 1yrb h GLU 19 N 0.02 0.75 -0.65 4.80 4.57 -1.11 -0.59 114.58 122.36 1yrb h GLU 19 Ca 0.03 -0.67 -0.03 0.00 -1.18 0.00 0.00 59.36 57.50 1yrb h GLU 19 Cb 0.67 0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 29.39 1yrb h GLU 19 CO 0.04 1.27 0.28 0.35 -1.18 0.00 0.00 179.01 179.77 1yrb h PHE 20 N 0.48 0.98 -0.59 0.92 3.57 -0.93 -1.23 116.94 120.14 1yrb h PHE 20 Ca -0.08 -0.06 0.01 0.00 3.53 0.00 0.00 57.97 61.37 1yrb h PHE 20 Cb 1.50 -0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.92 1yrb h PHE 20 CO 0.09 0.75 0.38 0.78 -2.23 0.00 0.00 178.31 178.09 1yrb h GLY 21 N 0.91 0.82 1.01 2.40 0.00 -1.30 -0.22 103.07 106.70 1yrb h GLY 21 Ca 0.22 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 1yrb h GLY 21 CO -0.02 0.29 0.47 -0.09 0.00 0.00 0.00 176.54 177.19 1yrb h ARG 22 N 0.78 1.03 -0.44 4.80 2.43 -0.77 0.66 114.38 122.86 1yrb h ARG 22 Ca 0.22 -0.09 0.06 0.00 -0.81 0.00 0.00 59.98 59.36 1yrb h ARG 22 Cb -0.08 -0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 29.21 1yrb h ARG 22 CO -0.05 0.72 0.16 -0.92 -1.51 0.00 0.00 179.97 178.36 1yrb h TYR 23 N 1.04 0.28 0.00 2.20 3.20 -0.87 -2.91 116.97 119.91 1yrb h TYR 23 Ca 0.27 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 62.06 1yrb h TYR 23 Cb -0.06 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.14 1yrb h TYR 23 CO -0.01 0.10 -0.51 -0.07 -1.64 0.00 0.00 178.16 176.03 1yrb h LEU 24 N 0.33 0.00 -2.60 2.82 3.38 -0.44 -3.24 115.31 115.56 1yrb h LEU 24 Ca 0.21 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.17 1yrb h LEU 24 Cb 0.20 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 1yrb h LEU 24 CO -0.21 0.51 -0.01 -0.33 0.09 0.00 0.00 178.44 178.49 1yrb h GLU 25 N 0.00 0.00 -0.97 1.13 5.08 -0.67 0.85 114.58 120.01 1yrb h GLU 25 Ca -0.01 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 58.46 1yrb h GLU 25 Cb 0.98 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 30.15 1yrb h GLU 25 CO 0.07 0.01 0.60 -0.44 -1.00 0.00 0.00 179.01 178.25 1yrb h ASP 26 N 0.00 0.90 0.00 1.42 3.32 -1.66 -3.32 116.42 117.07 1yrb h ASP 26 Ca -0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1yrb h ASP 26 Cb 0.07 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.48 1yrb h ASP 26 CO 0.00 0.50 -0.39 -3.20 -1.72 0.00 0.00 179.24 174.44 1yrb n ASN 27 N -4.62 1.94 -4.24 6.45 4.05 -0.57 -0.80 115.26 117.46 1yrb n ASN 27 Ca 0.17 -0.30 -0.17 0.00 0.45 0.00 0.00 54.58 54.73 1yrb n ASN 27 Cb 0.30 0.99 -0.11 0.00 1.23 0.00 0.00 39.78 42.20 1yrb n ASN 27 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 177.26 173.90 1yrb s TYR 28 N -1.38 1.35 -0.30 1.20 1.51 0.19 -5.02 117.35 114.90 1yrb s TYR 28 Ca 0.00 -0.61 -0.23 0.00 -1.01 0.00 0.00 57.07 55.22 1yrb s TYR 28 Cb 0.00 -0.70 -0.00 0.00 -0.11 0.00 0.00 41.96 41.15 1yrb s TYR 28 CO 0.00 0.13 0.77 0.21 -1.11 0.00 0.00 175.55 175.55 1yrb s LYS 29 N -3.00 3.97 -0.05 -0.62 2.20 -1.26 -4.33 119.74 116.65 1yrb s LYS 29 Ca 0.11 0.57 0.05 0.00 -0.36 0.00 0.00 55.97 56.34 1yrb s LYS 29 Cb -0.03 -3.72 -0.02 0.00 -1.51 0.00 0.00 37.83 32.55 1yrb s LYS 29 CO 0.02 -0.65 -0.19 0.08 -0.36 0.00 0.00 175.35 174.25 1yrb s VAL 30 N 2.90 2.59 0.15 4.02 1.01 -1.26 -0.73 120.40 129.08 1yrb s VAL 30 Ca 0.32 -0.89 0.11 0.00 0.00 0.00 0.00 61.98 61.52 1yrb s VAL 30 Cb -0.14 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 1yrb s VAL 30 CO 0.12 0.58 -0.26 0.00 0.00 0.00 0.00 175.10 175.54 1yrb s ALA 31 N -0.50 2.43 -0.05 5.51 0.00 -0.51 -4.99 121.76 123.65 1yrb s ALA 31 Ca 0.06 -1.52 0.06 0.00 0.00 0.00 0.00 51.96 50.56 1yrb s ALA 31 Cb -0.11 -0.36 -0.01 0.00 0.00 0.00 0.00 23.12 22.63 1yrb s ALA 31 CO 0.01 0.50 -0.24 0.71 0.00 0.00 0.00 175.76 176.74 1yrb s TYR 32 N -1.25 2.32 -0.17 0.00 2.02 -1.26 -1.01 117.35 118.00 1yrb s TYR 32 Ca 0.16 -0.63 0.01 0.00 -0.37 0.00 0.00 57.07 56.24 1yrb s TYR 32 Cb -0.09 -1.52 0.02 0.00 -0.40 0.00 0.00 41.96 39.96 1yrb s TYR 32 CO 0.07 -0.17 -0.20 0.08 -1.57 0.00 0.00 175.55 173.76 1yrb s VAL 33 N -0.25 2.08 -0.35 0.71 1.01 0.30 -0.16 120.40 123.75 1yrb s VAL 33 Ca -0.00 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 60.90 1yrb s VAL 33 Cb -0.13 -1.85 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 1yrb s VAL 33 CO 0.02 0.54 0.23 0.21 0.00 0.00 0.00 175.10 176.11 1yrb s ASN 34 N 1.14 5.98 0.00 3.32 3.04 0.24 -0.99 114.94 127.66 1yrb s ASN 34 Ca 0.01 -0.52 0.23 0.00 0.04 0.00 0.00 52.86 52.62 1yrb s ASN 34 Cb -0.14 -2.12 0.40 0.00 -1.54 0.00 0.00 41.25 37.86 1yrb s ASN 34 CO -0.09 -0.26 1.38 0.18 -3.04 0.00 0.00 177.10 175.26 1yrb n LEU 35 N 5.09 3.41 -4.63 3.21 4.77 -0.29 -1.87 117.00 126.69 1yrb n LEU 35 Ca -0.13 -1.48 -0.40 0.00 -0.03 0.00 0.00 56.01 53.97 1yrb n LEU 35 Cb 0.49 -0.23 -0.07 0.00 -2.33 0.00 0.00 43.42 41.28 1yrb n LEU 35 CO 0.37 0.73 0.33 -0.62 -1.33 0.00 0.00 177.39 176.87 1yrb s ASP 36 N -1.49 6.55 0.00 -1.43 2.15 -1.26 -4.11 116.67 117.09 1yrb s ASP 36 Ca 0.37 0.67 0.28 0.00 0.43 0.00 0.00 52.55 54.30 1yrb s ASP 36 Cb 0.22 -2.32 1.08 0.00 -0.30 0.00 0.00 42.92 41.60 1yrb s ASP 36 CO 0.31 -0.31 1.80 0.35 -0.17 0.00 0.00 175.17 177.15 1yrb n THR 37 N 5.04 0.00 -0.04 1.71 -2.24 -1.26 -4.24 114.28 113.24 1yrb n THR 37 Ca -0.02 -0.01 -0.16 0.00 -2.27 0.00 0.00 64.05 61.59 1yrb n THR 37 Cb 0.49 -0.26 -0.14 0.00 -2.10 0.00 0.00 70.33 68.32 1yrb n THR 37 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yrb n GLY 38 N 1.46 -0.67 3.77 3.38 0.00 -1.26 -1.28 105.19 110.58 1yrb n GLY 38 Ca 0.08 -0.21 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 1yrb n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yrb s VAL 39 N -2.55 2.72 -0.14 1.61 0.11 -1.26 -4.79 120.40 116.10 1yrb s VAL 39 Ca -0.19 0.59 -0.24 0.00 -2.93 0.00 0.00 61.98 59.20 1yrb s VAL 39 Cb 0.07 -3.32 -0.25 0.00 -1.53 0.00 0.00 36.38 31.35 1yrb s VAL 39 CO 0.75 0.04 0.61 0.11 -3.33 0.00 0.00 175.10 173.28 1yrb h LYS 40 N 2.22 0.08 -4.23 1.54 1.57 -1.96 -3.48 116.57 112.32 1yrb h LYS 40 Ca -0.50 -0.13 -0.46 0.00 -1.87 0.00 0.00 60.65 57.69 1yrb h LYS 40 Cb 1.26 0.05 -0.34 0.00 0.08 0.00 0.00 32.23 33.27 1yrb h LYS 40 CO 0.61 1.06 -0.79 -1.21 -0.57 0.00 0.00 179.45 178.55 1yrb s GLU 41 N -2.32 1.22 -0.04 3.15 0.41 -1.26 -5.14 118.70 114.72 1yrb s GLU 41 Ca -0.21 -0.23 -0.10 0.00 -0.41 0.00 0.00 54.97 54.03 1yrb s GLU 41 Cb 0.01 -1.14 -0.05 0.00 -1.78 0.00 0.00 34.13 31.17 1yrb s GLU 41 CO 0.70 -0.07 0.27 -0.51 -0.49 0.00 0.00 175.26 175.16 1yrb s LEU 42 N 0.96 4.41 0.00 1.80 1.43 -1.26 -4.98 118.68 121.04 1yrb s LEU 42 Ca -0.10 0.67 0.14 0.00 -1.03 0.00 0.00 54.13 53.81 1yrb s LEU 42 Cb -0.15 -2.44 0.52 0.00 0.03 0.00 0.00 46.19 44.16 1yrb s LEU 42 CO 0.00 0.33 1.38 -0.81 0.23 0.00 0.00 176.35 177.48 1yrb n PRO 43 N 1.65 1.55 -4.28 1.29 -0.04 -1.26 -4.86 135.00 129.05 1yrb n PRO 43 Ca -0.15 -0.84 -0.15 0.00 -0.04 0.00 0.00 63.50 62.32 1yrb n PRO 43 Cb 0.53 -1.27 -0.10 0.00 -0.04 0.00 0.00 33.50 32.62 1yrb n PRO 43 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1yrb s TYR 44 N -1.75 1.36 -0.42 0.54 -0.85 -1.26 -4.90 117.35 110.07 1yrb s TYR 44 Ca 0.23 -0.97 -0.19 0.00 -0.52 0.00 0.00 57.07 55.62 1yrb s TYR 44 Cb 0.12 -0.78 0.02 0.00 0.38 0.00 0.00 41.96 41.71 1yrb s TYR 44 CO 0.18 -0.14 0.54 -2.00 -1.52 0.00 0.00 175.55 172.61 1yrb s GLU 45 N -3.89 3.22 0.31 -3.49 2.12 -1.26 -5.05 118.70 110.66 1yrb s GLU 45 Ca 0.26 -0.54 -0.29 0.00 0.36 0.00 0.00 54.97 54.76 1yrb s GLU 45 Cb 0.06 -3.95 -0.10 0.00 0.26 0.00 0.00 34.13 30.40 1yrb s GLU 45 CO 0.06 -0.91 1.18 -1.25 -0.54 0.00 0.00 175.26 173.80 1yrb s PRO 46 N 2.47 4.47 0.02 4.30 0.04 -1.26 -4.60 135.00 140.44 1yrb s PRO 46 Ca 0.17 1.96 -0.00 0.00 0.04 0.00 0.00 61.00 63.17 1yrb s PRO 46 Cb -0.16 -3.09 -0.26 0.00 0.04 0.00 0.00 34.50 31.03 1yrb s PRO 46 CO 0.16 0.01 0.90 0.77 0.04 0.00 0.00 177.00 178.88 1yrb h SER 47 N 3.53 0.31 -3.70 6.66 0.02 -0.93 -3.45 113.55 115.98 1yrb h SER 47 Ca -0.48 -0.42 -0.51 0.00 -0.84 0.00 0.00 61.79 59.54 1yrb h SER 47 Cb 1.22 -0.10 -0.32 0.00 0.14 0.00 0.00 62.40 63.34 1yrb h SER 47 CO 0.66 1.35 -0.81 -0.63 -1.14 0.00 0.00 176.83 176.26 1yrb s ILE 48 N -2.63 1.14 -0.22 3.27 1.01 -1.06 -5.04 121.20 117.67 1yrb s ILE 48 Ca -0.07 -0.53 -0.05 0.00 0.00 0.00 0.00 60.65 60.00 1yrb s ILE 48 Cb 0.07 -1.01 0.08 0.00 0.01 0.00 0.00 42.46 41.61 1yrb s ILE 48 CO 0.85 0.34 0.11 -0.62 0.00 0.00 0.00 174.94 175.62 1yrb s ASP 49 N 0.31 2.87 0.41 3.58 2.15 -1.26 -0.60 116.67 124.14 1yrb s ASP 49 Ca -0.07 -0.91 0.28 0.00 0.43 0.00 0.00 52.55 52.28 1yrb s ASP 49 Cb -0.12 -0.30 1.44 0.00 -0.30 0.00 0.00 42.92 43.64 1yrb s ASP 49 CO 0.02 -0.39 1.86 -0.37 -0.17 0.00 0.00 175.17 176.13 1yrb h VAL 50 N 6.42 0.00 0.00 1.11 -1.51 -1.68 -1.94 116.25 118.65 1yrb h VAL 50 Ca -0.17 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.20 1yrb h VAL 50 Cb 1.09 0.79 0.00 0.00 -2.13 0.00 0.00 31.29 31.04 1yrb h VAL 50 CO 0.36 0.00 0.00 0.03 -1.23 0.00 0.00 177.57 176.73 1yrb h ARG 51 N 0.00 0.00 0.00 5.19 3.08 -1.80 -1.89 114.38 118.96 1yrb h ARG 51 Ca 0.00 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 1yrb h ARG 51 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1yrb h ARG 51 CO 0.00 0.00 -0.28 0.93 -1.07 0.00 0.00 179.97 179.55 1yrb h GLU 52 N 0.00 0.00 0.00 0.04 4.39 -1.77 -3.23 114.58 114.01 1yrb h GLU 52 Ca 0.00 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.63 1yrb h GLU 52 Cb 0.38 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.02 1yrb h GLU 52 CO 0.00 0.28 -0.40 0.35 -1.16 0.00 0.00 179.01 178.08 1yrb h PHE 53 N 0.00 0.00 -2.23 4.33 3.57 -1.56 -3.49 116.94 117.56 1yrb h PHE 53 Ca -0.00 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.45 1yrb h PHE 53 Cb 0.68 0.00 -0.17 0.00 2.79 0.00 0.00 35.95 39.25 1yrb h PHE 53 CO 0.00 1.09 0.21 0.54 -2.23 0.00 0.00 178.31 177.92 1yrb s VAL 54 N -2.24 0.00 0.21 1.41 0.11 -1.08 -5.12 120.40 113.69 1yrb s VAL 54 Ca -0.21 0.00 0.09 0.00 -2.93 0.00 0.00 61.98 58.93 1yrb s VAL 54 Cb -0.00 -1.00 -0.05 0.00 -1.53 0.00 0.00 36.38 33.80 1yrb s VAL 54 CO 0.62 0.00 -0.18 0.42 -3.33 0.00 0.00 175.10 172.63 1yrb s THR 55 N -1.82 1.98 0.15 5.04 -4.23 -1.26 -4.04 115.64 111.46 1yrb s THR 55 Ca -0.08 -2.15 -0.13 0.00 -1.18 0.00 0.00 61.69 58.15 1yrb s THR 55 Cb -0.00 -2.05 0.04 0.00 1.34 0.00 0.00 72.50 71.83 1yrb s THR 55 CO 0.04 -0.43 1.67 0.58 -0.54 0.00 0.00 174.62 175.94 1yrb h VAL 56 N 2.75 1.24 -0.65 2.29 2.07 -1.49 -2.41 116.25 120.05 1yrb h VAL 56 Ca -0.40 -0.82 0.05 0.00 0.82 0.00 0.00 66.70 66.35 1yrb h VAL 56 Cb 1.22 0.78 -0.05 0.00 -1.52 0.00 0.00 31.29 31.73 1yrb h VAL 56 CO 0.57 0.30 0.37 -0.33 0.02 0.00 0.00 177.57 178.50 1yrb h GLU 57 N 0.71 0.68 -0.53 1.57 5.08 -1.88 -0.06 114.58 120.16 1yrb h GLU 57 Ca 0.16 -0.04 0.04 0.00 -1.00 0.00 0.00 59.36 58.53 1yrb h GLU 57 Cb 0.30 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.36 1yrb h GLU 57 CO -0.00 0.45 0.28 1.49 -1.00 0.00 0.00 179.01 180.23 1yrb h GLU 58 N 0.70 0.52 -0.19 2.33 4.57 -1.91 -2.05 114.58 118.55 1yrb h GLU 58 Ca 0.28 -0.03 -0.07 0.00 -1.18 0.00 0.00 59.36 58.36 1yrb h GLU 58 Cb 0.13 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 28.59 1yrb h GLU 58 CO -0.16 0.35 -0.19 0.82 -1.18 0.00 0.00 179.01 178.65 1yrb h ILE 59 N 0.54 1.22 0.00 2.32 2.04 -0.79 -2.23 117.51 120.61 1yrb h ILE 59 Ca 0.23 -1.02 -0.10 0.00 1.00 0.00 0.00 64.86 64.97 1yrb h ILE 59 Cb 0.13 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1yrb h ILE 59 CO -0.15 0.32 -0.47 0.24 0.00 0.00 0.00 178.15 178.09 1yrb h MET 60 N 0.30 0.00 0.00 2.37 2.86 -0.69 -1.97 114.93 117.80 1yrb h MET 60 Ca 0.05 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 1yrb h MET 60 Cb 0.51 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.17 1yrb h MET 60 CO 0.03 0.47 -0.03 0.00 1.06 0.00 0.00 176.91 178.44 1yrb h ARG 61 N 0.00 0.00 -0.00 1.72 3.08 -0.74 -1.25 114.38 117.19 1yrb h ARG 61 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1yrb h ARG 61 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.93 1yrb h ARG 61 CO 0.06 0.03 -0.06 0.39 -1.07 0.00 0.00 179.97 179.32 1yrb n GLU 62 N -3.27 0.32 0.00 0.04 1.02 -0.74 -4.92 120.64 113.09 1yrb n GLU 62 Ca -0.02 -0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 1yrb n GLU 62 Cb 0.17 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1yrb n GLU 62 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1yrb n GLY 63 N 1.37 1.00 3.80 0.62 0.00 -0.47 -5.11 105.19 106.40 1yrb n GLY 63 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1yrb n GLY 63 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1yrb s TYR 64 N -2.00 3.16 0.93 1.61 2.02 -1.23 -5.03 117.35 116.81 1yrb s TYR 64 Ca 0.00 1.61 -0.12 0.00 -0.37 0.00 0.00 57.07 58.18 1yrb s TYR 64 Cb 0.00 -3.01 0.15 0.00 -0.40 0.00 0.00 41.96 38.70 1yrb s TYR 64 CO 0.00 -0.54 1.13 0.20 -1.57 0.00 0.00 175.55 174.77 1yrb s GLY 65 N -1.95 1.57 0.17 0.71 0.00 -1.26 -4.46 107.32 102.10 1yrb s GLY 65 Ca 0.63 -0.51 -0.11 0.00 0.00 0.00 0.00 44.72 44.74 1yrb s GLY 65 CO 0.19 0.07 1.65 -0.56 0.00 0.00 0.00 173.10 174.45 1yrb h PRO 66 N -1.59 0.99 -0.12 2.90 0.13 -1.97 0.13 132.00 132.47 1yrb h PRO 66 Ca -0.51 -0.28 -0.20 0.00 -0.87 0.00 0.00 66.00 64.14 1yrb h PRO 66 Cb 1.33 -0.11 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1yrb h PRO 66 CO 0.61 0.95 -0.74 -0.91 -0.23 0.00 0.00 178.00 177.68 1yrb h ASN 67 N 0.88 0.68 -0.95 1.44 2.35 -1.99 -0.98 115.58 117.01 1yrb h ASN 67 Ca 0.17 -0.44 0.03 0.00 -0.55 0.00 0.00 56.30 55.51 1yrb h ASN 67 Cb 0.46 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.57 1yrb h ASN 67 CO 0.02 1.20 0.62 1.23 -1.65 0.00 0.00 177.43 178.85 1yrb h GLY 68 N 0.98 1.38 1.08 2.83 0.00 -1.90 -2.34 103.07 105.10 1yrb h GLY 68 Ca -0.04 -0.48 -0.13 0.00 0.00 0.00 0.00 47.33 46.68 1yrb h GLY 68 CO 0.14 0.42 -0.25 0.00 0.00 0.00 0.00 176.54 176.85 1yrb h ALA 69 N 1.38 0.61 0.16 3.60 0.00 -0.58 -1.71 119.26 122.72 1yrb h ALA 69 Ca 0.37 -0.40 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1yrb h ALA 69 Cb -0.03 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1yrb h ALA 69 CO -0.11 0.62 -0.22 0.82 0.00 0.00 0.00 179.25 180.36 1yrb h ILE 70 N 0.76 0.52 -0.13 0.00 2.04 -0.89 0.29 117.51 120.11 1yrb h ILE 70 Ca 0.09 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.95 1yrb h ILE 70 Cb 0.83 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1yrb h ILE 70 CO 0.07 0.00 0.08 0.58 0.00 0.00 0.00 178.15 178.88 1yrb h VAL 71 N -0.43 1.05 -0.91 1.67 2.07 -1.42 -2.44 116.25 115.84 1yrb h VAL 71 Ca 0.01 -0.11 0.08 0.00 0.82 0.00 0.00 66.70 67.50 1yrb h VAL 71 Cb 0.43 0.89 -0.06 0.00 -1.52 0.00 0.00 31.29 31.03 1yrb h VAL 71 CO -0.09 0.05 0.59 -0.08 0.02 0.00 0.00 177.57 178.06 1yrb h GLU 72 N 0.16 0.95 -0.60 1.57 4.57 -1.11 -1.32 114.58 118.80 1yrb h GLU 72 Ca 0.05 -0.06 0.04 0.00 -1.18 0.00 0.00 59.36 58.21 1yrb h GLU 72 Cb 0.00 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 28.35 1yrb h GLU 72 CO -0.01 0.63 0.40 0.66 -1.18 0.00 0.00 179.01 179.50 1yrb h SER 73 N 0.97 0.60 0.82 1.04 4.64 0.09 -1.09 113.55 120.61 1yrb h SER 73 Ca 0.41 -0.01 -0.24 0.00 -0.47 0.00 0.00 61.79 61.48 1yrb h SER 73 Cb 0.30 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 62.23 1yrb h SER 73 CO -0.17 0.41 -1.17 1.88 -0.87 0.00 0.00 176.83 176.91 1yrb h TYR 74 N 0.69 0.15 -0.70 4.77 0.05 -1.18 -1.92 116.97 118.83 1yrb h TYR 74 Ca 0.24 -0.11 0.05 0.00 0.05 0.00 0.00 58.73 58.96 1yrb h TYR 74 Cb 0.10 -0.01 -0.05 0.00 1.01 0.00 0.00 36.73 37.79 1yrb h TYR 74 CO -0.00 1.10 0.42 -0.44 -1.05 0.00 0.00 178.16 178.18 1yrb h ASP 75 N 0.02 0.65 -0.04 3.88 3.32 -0.84 -2.41 116.42 121.01 1yrb h ASP 75 Ca -0.09 0.02 -0.16 0.00 0.02 0.00 0.00 57.03 56.82 1yrb h ASP 75 Cb 1.86 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 41.29 1yrb h ASP 75 CO 0.14 0.43 -0.52 0.03 -1.72 0.00 0.00 179.24 177.61 1yrb h ARG 76 N 0.78 0.61 0.00 3.56 3.08 -1.17 -2.86 114.38 118.38 1yrb h ARG 76 Ca 0.30 -0.37 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 1yrb h ARG 76 Cb 0.12 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.20 1yrb h ARG 76 CO -0.15 0.98 -0.10 1.25 -1.07 0.00 0.00 179.97 180.87 1yrb h LEU 77 N 0.48 0.00 -2.41 3.04 5.85 -1.06 -2.81 115.31 118.40 1yrb h LEU 77 Ca 0.02 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 1yrb h LEU 77 Cb 1.07 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.09 1yrb h LEU 77 CO 0.10 0.10 -0.01 0.24 -0.34 0.00 0.00 178.44 178.53 1yrb h MET 78 N 0.00 0.00 0.00 1.25 2.86 -1.19 0.04 114.93 117.88 1yrb h MET 78 Ca -0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1yrb h MET 78 Cb 0.30 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.96 1yrb h MET 78 CO 0.01 0.01 0.00 -0.85 1.06 0.00 0.00 176.91 177.15 1yrb n GLU 79 N -3.17 0.09 -0.20 1.72 0.00 -1.06 -2.38 120.64 115.64 1yrb n GLU 79 Ca -0.02 0.24 0.07 0.00 0.00 0.00 0.00 57.16 57.45 1yrb n GLU 79 Cb 0.16 -1.64 0.16 0.00 0.00 0.00 0.00 31.44 30.12 1yrb n GLU 79 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1yrb n LYS 80 N -1.80 2.37 0.06 3.44 4.01 -0.02 -4.81 118.16 121.40 1yrb n LYS 80 Ca 0.04 -2.41 -0.11 0.00 -0.51 0.00 0.00 58.31 55.32 1yrb n LYS 80 Cb 0.26 -1.50 -0.05 0.00 -0.51 0.00 0.00 35.03 33.24 1yrb n LYS 80 CO 0.00 0.00 0.00 0.35 -1.11 0.00 0.00 177.40 176.64 1yrb h PHE 81 N 0.92 -0.44 -0.62 2.13 3.57 -1.28 -0.91 116.94 120.31 1yrb h PHE 81 Ca 0.00 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.46 1yrb h PHE 81 Cb 1.02 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.93 1yrb h PHE 81 CO 0.20 -0.25 0.17 -0.91 -2.23 0.00 0.00 178.31 175.29 1yrb h ASN 82 N -0.28 0.89 -0.38 0.41 -0.26 -1.87 0.13 115.58 114.20 1yrb h ASN 82 Ca 0.05 -0.16 0.01 0.00 -0.56 0.00 0.00 56.30 55.64 1yrb h ASN 82 Cb 0.35 -0.23 -0.02 0.00 -1.06 0.00 0.00 38.32 37.35 1yrb h ASN 82 CO -0.15 0.85 0.25 -0.08 -1.06 0.00 0.00 177.43 177.23 1yrb h GLU 83 N 0.91 0.49 -0.36 0.81 4.81 -1.83 0.33 114.58 119.74 1yrb h GLU 83 Ca 0.20 -0.03 -0.15 0.00 -0.13 0.00 0.00 59.36 59.25 1yrb h GLU 83 Cb 0.30 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1yrb h GLU 83 CO -0.00 0.32 -0.36 1.88 -0.73 0.00 0.00 179.01 180.12 1yrb h TYR 84 N 0.50 1.05 0.06 0.92 0.05 -0.72 -1.89 116.97 116.94 1yrb h TYR 84 Ca 0.14 -0.32 0.01 0.00 0.05 0.00 0.00 58.73 58.61 1yrb h TYR 84 Cb -0.05 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 37.46 1yrb h TYR 84 CO -0.05 1.12 -0.07 1.25 -1.05 0.00 0.00 178.16 179.36 1yrb h LEU 85 N 0.68 -0.19 -1.23 3.88 5.85 -0.63 -0.43 115.31 123.24 1yrb h LEU 85 Ca 0.06 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.79 1yrb h LEU 85 Cb 0.94 0.07 -0.03 0.00 0.37 0.00 0.00 40.66 42.02 1yrb h LEU 85 CO 0.09 -0.11 0.34 0.78 -0.34 0.00 0.00 178.44 179.19 1yrb h ASN 86 N -0.15 0.77 -0.67 1.25 2.35 -0.94 -0.19 115.58 117.99 1yrb h ASN 86 Ca 0.01 -0.06 -0.04 0.00 -0.55 0.00 0.00 56.30 55.66 1yrb h ASN 86 Cb 0.16 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 1yrb h ASN 86 CO -0.03 0.63 0.27 0.11 -1.65 0.00 0.00 177.43 176.76 1yrb h LYS 87 N 0.87 1.01 -0.48 0.81 1.57 -0.97 -0.68 116.57 118.70 1yrb h LYS 87 Ca 0.22 -0.18 -0.13 0.00 -1.87 0.00 0.00 60.65 58.69 1yrb h LYS 87 Cb 0.03 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 1yrb h LYS 87 CO -0.04 0.84 -0.20 0.82 -0.57 0.00 0.00 179.45 180.31 1yrb h ILE 88 N 0.95 1.27 -0.69 1.86 2.04 -0.41 -1.75 117.51 120.78 1yrb h ILE 88 Ca 0.22 -1.35 -0.05 0.00 1.00 0.00 0.00 64.86 64.68 1yrb h ILE 88 Cb 0.21 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.36 1yrb h ILE 88 CO -0.02 0.47 0.24 -0.07 0.00 0.00 0.00 178.15 178.77 1yrb h LEU 89 N 0.85 0.98 -0.54 1.44 3.38 -0.83 -1.35 115.31 119.23 1yrb h LEU 89 Ca 0.11 -0.19 0.05 0.00 0.09 0.00 0.00 57.88 57.94 1yrb h LEU 89 Cb 0.76 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.21 1yrb h LEU 89 CO 0.06 0.91 0.27 -0.09 0.09 0.00 0.00 178.44 179.67 1yrb h ARG 90 N 0.99 0.50 -0.84 1.13 2.43 -0.96 -2.39 114.38 115.24 1yrb h ARG 90 Ca 0.23 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.40 1yrb h ARG 90 Cb 0.26 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.65 1yrb h ARG 90 CO -0.01 0.33 0.55 -0.07 -1.51 0.00 0.00 179.97 179.26 1yrb h LEU 91 N 0.51 0.89 -1.79 3.80 3.38 -0.39 -1.68 115.31 120.04 1yrb h LEU 91 Ca 0.24 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1yrb h LEU 91 Cb 0.17 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1yrb h LEU 91 CO -0.18 0.61 0.00 -0.08 0.09 0.00 0.00 178.44 178.88 1yrb h GLU 92 N 1.04 0.00 0.00 1.13 4.22 -0.76 -1.97 114.58 118.24 1yrb h GLU 92 Ca 0.34 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.78 1yrb h GLU 92 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 1yrb h GLU 92 CO -0.10 0.00 -0.65 0.87 -2.18 0.00 0.00 179.01 176.95 1yrb h LYS 93 N 0.00 0.00 -0.01 1.92 6.56 -1.16 -3.32 116.57 120.56 1yrb h LYS 93 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1yrb h LYS 93 Cb 0.39 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.05 1yrb h LYS 93 CO 0.00 0.00 -0.15 0.39 -2.06 0.00 0.00 179.45 177.63 1yrb n GLU 94 N -2.57 1.62 -4.15 3.15 1.02 -0.79 -2.04 120.64 116.88 1yrb n GLU 94 Ca 0.02 -0.75 -0.14 0.00 -0.02 0.00 0.00 57.16 56.27 1yrb n GLU 94 Cb 0.51 -1.11 -0.11 0.00 -0.02 0.00 0.00 31.44 30.70 1yrb n GLU 94 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1yrb s ASN 95 N -1.21 1.32 0.06 1.62 0.01 -0.91 -4.61 114.94 111.23 1yrb s ASN 95 Ca 0.09 -0.73 -0.17 0.00 -0.71 0.00 0.00 52.86 51.35 1yrb s ASN 95 Cb 0.08 0.01 -0.16 0.00 0.41 0.00 0.00 41.25 41.60 1yrb s ASN 95 CO 0.21 -0.23 1.28 0.44 -1.51 0.00 0.00 177.10 177.30 1yrb h ASP 96 N 3.88 0.66 -4.27 -1.22 3.32 -1.27 -3.40 116.42 114.11 1yrb h ASP 96 Ca -0.37 -0.60 -0.57 0.00 0.02 0.00 0.00 57.03 55.51 1yrb h ASP 96 Cb 1.19 -0.19 -0.30 0.00 0.22 0.00 0.00 39.33 40.25 1yrb h ASP 96 CO 0.48 1.14 -0.84 -0.31 -1.72 0.00 0.00 179.24 177.99 1yrb s TYR 97 N -3.86 1.70 -0.18 4.55 1.51 -0.89 -0.71 117.35 119.48 1yrb s TYR 97 Ca -0.13 -0.35 0.01 0.00 -1.01 0.00 0.00 57.07 55.59 1yrb s TYR 97 Cb 0.06 -1.10 0.02 0.00 -0.11 0.00 0.00 41.96 40.84 1yrb s TYR 97 CO 0.83 -0.06 -0.18 0.08 -1.11 0.00 0.00 175.55 175.11 1yrb s VAL 98 N -0.35 1.94 -0.19 0.71 1.01 0.04 -1.43 120.40 122.13 1yrb s VAL 98 Ca 0.05 -0.89 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 1yrb s VAL 98 Cb -0.08 -1.78 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 1yrb s VAL 98 CO -0.00 0.49 0.06 -0.76 0.00 0.00 0.00 175.10 174.89 1yrb s LEU 99 N 1.33 3.69 -0.21 3.92 1.43 -0.18 -0.92 118.68 127.75 1yrb s LEU 99 Ca 0.04 0.01 -0.01 0.00 -1.03 0.00 0.00 54.13 53.14 1yrb s LEU 99 Cb -0.13 -1.94 0.01 0.00 0.03 0.00 0.00 46.19 44.16 1yrb s LEU 99 CO -0.12 0.13 -0.13 -0.63 0.23 0.00 0.00 176.35 175.84 1yrb s ILE 100 N 0.60 2.60 -0.24 -0.59 1.01 0.25 -0.54 121.20 124.29 1yrb s ILE 100 Ca 0.03 -0.84 -0.11 0.00 0.00 0.00 0.00 60.65 59.73 1yrb s ILE 100 Cb -0.13 -2.18 -0.05 0.00 0.01 0.00 0.00 42.46 40.11 1yrb s ILE 100 CO 0.01 0.43 0.17 -0.62 0.00 0.00 0.00 174.94 174.93 1yrb s ASP 101 N 1.35 6.12 0.51 3.58 2.15 -0.16 -1.62 116.67 128.59 1yrb s ASP 101 Ca 0.04 0.12 0.06 0.00 0.43 0.00 0.00 52.55 53.20 1yrb s ASP 101 Cb -0.14 -2.11 0.04 0.00 -0.30 0.00 0.00 42.92 40.41 1yrb s ASP 101 CO -0.08 0.06 0.70 0.42 -0.17 0.00 0.00 175.17 176.09 1yrb s THR 102 N 1.10 2.65 0.45 1.71 -4.23 -1.24 -1.14 115.64 114.94 1yrb s THR 102 Ca 0.08 -0.91 -0.22 0.00 -1.18 0.00 0.00 61.69 59.46 1yrb s THR 102 Cb -0.14 -2.75 -0.11 0.00 1.34 0.00 0.00 72.50 70.84 1yrb s THR 102 CO 0.05 0.00 0.64 -2.65 -0.54 0.00 0.00 174.62 172.12 1yrb n PRO 103 N -2.12 0.71 0.07 3.99 -0.02 -1.26 -4.35 135.00 132.04 1yrb n PRO 103 Ca 0.10 0.26 0.03 0.00 -2.02 0.00 0.00 63.50 61.87 1yrb n PRO 103 Cb 0.60 -1.66 0.40 0.00 -0.02 0.00 0.00 33.50 32.82 1yrb n PRO 103 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1yrb h GLY 104 N 0.83 0.38 -7.20 -1.23 0.00 -1.93 -3.36 103.07 90.57 1yrb h GLY 104 Ca -0.42 -0.20 -0.63 0.00 0.00 0.00 0.00 47.33 46.08 1yrb h GLY 104 CO 0.52 0.19 -0.17 1.20 0.00 0.00 0.00 176.54 178.28 1yrb s GLN 105 N -5.02 3.90 0.50 4.80 -1.52 -1.26 -2.45 119.66 118.61 1yrb s GLN 105 Ca -0.07 -0.00 0.24 0.00 -1.95 0.00 0.00 55.36 53.59 1yrb s GLN 105 Cb 0.16 -3.70 1.33 0.00 -0.22 0.00 0.00 33.01 30.58 1yrb s GLN 105 CO 0.73 -0.39 2.04 0.00 -0.25 0.00 0.00 175.29 177.42 1yrb h MET 106 N 8.23 0.00 0.00 2.91 -0.00 -1.71 -0.47 114.93 123.89 1yrb h MET 106 Ca -0.30 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.37 1yrb h MET 106 Cb 1.15 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.74 1yrb h MET 106 CO 0.69 0.15 -0.13 1.05 -0.00 0.00 0.00 176.91 178.66 1yrb h GLU 107 N 0.00 0.00 -0.01 -0.10 4.11 -1.92 0.96 114.58 117.62 1yrb h GLU 107 Ca -0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.36 59.35 1yrb h GLU 107 Cb 0.36 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1yrb h GLU 107 CO 0.02 0.13 -0.36 1.15 0.07 0.00 0.00 179.01 180.02 1yrb h THR 108 N 0.00 1.26 0.17 -1.06 2.02 -1.45 -0.58 112.91 113.28 1yrb h THR 108 Ca -0.00 -1.26 -0.32 0.00 0.77 0.00 0.00 66.41 65.60 1yrb h THR 108 Cb 0.28 1.66 0.01 0.00 -1.74 0.00 0.00 68.15 68.36 1yrb h THR 108 CO 0.02 0.36 -1.53 0.15 0.37 0.00 0.00 175.52 174.89 1yrb h PHE 109 N 0.02 0.65 0.00 3.16 3.57 -1.08 -3.08 116.94 120.19 1yrb h PHE 109 Ca -0.00 -0.48 -0.19 0.00 3.53 0.00 0.00 57.97 60.83 1yrb h PHE 109 Cb 0.65 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.33 1yrb h PHE 109 CO 0.00 1.48 -0.96 -0.07 -2.23 0.00 0.00 178.31 176.53 1yrb h LEU 110 N 0.10 0.00 -1.16 0.59 3.38 -0.77 -3.29 115.31 114.16 1yrb h LEU 110 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1yrb h LEU 110 Cb 2.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.82 1yrb h LEU 110 CO 0.20 0.86 -0.06 0.49 0.09 0.00 0.00 178.44 180.01 1yrb n PHE 111 N -3.27 0.00 -4.07 1.13 3.72 -0.24 -4.81 117.46 109.92 1yrb n PHE 111 Ca -0.02 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.07 1yrb n PHE 111 Cb 0.89 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 39.37 1yrb n PHE 111 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 1yrb s HIS 112 N -0.96 3.25 0.41 1.38 2.46 -1.16 -5.01 115.29 115.66 1yrb s HIS 112 Ca 0.10 0.15 0.09 0.00 0.47 0.00 0.00 55.06 55.87 1yrb s HIS 112 Cb 0.08 -1.69 0.89 0.00 -0.13 0.00 0.00 32.58 31.73 1yrb s HIS 112 CO 0.16 0.54 2.03 1.49 -2.47 0.00 0.00 174.74 176.48 1yrb h GLU 113 N 3.70 0.53 -0.21 2.88 4.81 -1.91 -2.76 114.58 121.62 1yrb h GLU 113 Ca -0.48 -0.03 0.04 0.00 -0.13 0.00 0.00 59.36 58.76 1yrb h GLU 113 Cb 1.17 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 30.39 1yrb h GLU 113 CO 0.65 0.35 -0.07 0.35 -0.73 0.00 0.00 179.01 179.55 1yrb h PHE 114 N 0.55 -0.17 -0.13 0.92 3.57 -1.91 0.20 116.94 119.97 1yrb h PHE 114 Ca 0.20 0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.65 1yrb h PHE 114 Cb 0.13 0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.98 1yrb h PHE 114 CO -0.00 -0.12 -0.21 0.78 -2.23 0.00 0.00 178.31 176.53 1yrb h GLY 115 N -0.04 0.41 0.93 2.40 0.00 -1.66 -1.67 103.07 103.45 1yrb h GLY 115 Ca 0.11 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 1yrb h GLY 115 CO -0.23 0.41 -0.12 -2.08 0.00 0.00 0.00 176.54 174.52 1yrb h VAL 116 N -0.03 0.75 -0.65 4.60 2.07 -1.32 -1.39 116.25 120.27 1yrb h VAL 116 Ca 0.01 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.47 1yrb h VAL 116 Cb 0.78 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1yrb h VAL 116 CO 0.05 0.00 0.16 0.03 0.02 0.00 0.00 177.57 177.83 1yrb h ARG 117 N -0.29 1.03 -0.16 1.57 3.08 -0.65 -1.60 114.38 117.36 1yrb h ARG 117 Ca -0.01 -0.24 0.02 0.00 0.07 0.00 0.00 59.98 59.82 1yrb h ARG 117 Cb 0.25 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 1yrb h ARG 117 CO 0.01 0.91 0.04 1.25 -1.07 0.00 0.00 179.97 181.11 1yrb h LEU 118 N 0.98 0.03 -0.97 3.04 5.85 -1.11 -2.68 115.31 120.45 1yrb h LEU 118 Ca 0.21 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.91 1yrb h LEU 118 Cb 0.35 0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 1yrb h LEU 118 CO 0.00 0.04 0.25 0.24 -0.34 0.00 0.00 178.44 178.63 1yrb h MET 119 N 0.11 1.00 -0.24 1.25 2.86 -0.78 -0.73 114.93 118.40 1yrb h MET 119 Ca 0.07 -0.17 0.04 0.00 -2.06 0.00 0.00 59.70 57.58 1yrb h MET 119 Cb 0.06 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 1yrb h MET 119 CO -0.09 0.82 0.16 0.93 1.06 0.00 0.00 176.91 179.80 1yrb h GLU 120 N 0.97 0.15 -0.06 1.72 5.08 -1.09 -3.03 114.58 118.32 1yrb h GLU 120 Ca 0.23 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1yrb h GLU 120 Cb 0.21 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1yrb h GLU 120 CO -0.02 0.10 0.00 0.09 -1.00 0.00 0.00 179.01 178.18 1yrb n ASN 121 N -4.49 2.98 -4.84 1.42 4.13 -0.32 -4.92 115.26 109.21 1yrb n ASN 121 Ca 0.02 -1.96 -0.37 0.00 1.68 0.00 0.00 54.58 53.95 1yrb n ASN 121 Cb 0.20 -0.02 -0.06 0.00 -1.54 0.00 0.00 39.78 38.36 1yrb n ASN 121 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1yrb s LEU 122 N -1.88 4.43 -0.42 3.41 1.43 -0.99 -5.04 118.68 119.62 1yrb s LEU 122 Ca 0.28 0.94 -0.28 0.00 -1.03 0.00 0.00 54.13 54.04 1yrb s LEU 122 Cb 0.20 -2.76 -0.01 0.00 0.03 0.00 0.00 46.19 43.64 1yrb s LEU 122 CO 0.29 0.26 1.69 -2.16 0.23 0.00 0.00 176.35 176.66 1yrb s PRO 123 N -1.38 3.26 -1.31 1.29 0.04 -1.26 -4.34 135.00 131.30 1yrb s PRO 123 Ca 0.28 1.08 -0.19 0.00 0.04 0.00 0.00 61.00 62.20 1yrb s PRO 123 Cb -0.16 -4.18 0.02 0.00 0.04 0.00 0.00 34.50 30.22 1yrb s PRO 123 CO 0.15 -1.95 0.51 0.66 0.04 0.00 0.00 177.00 176.41 1yrb n TYR 124 N 10.33 -1.49 -2.26 0.56 4.01 -1.26 -4.82 117.16 122.22 1yrb n TYR 124 Ca 0.20 0.36 -0.37 0.00 -0.16 0.00 0.00 57.90 57.93 1yrb n TYR 124 Cb 0.48 -3.05 -0.01 0.00 -0.31 0.00 0.00 39.34 36.45 1yrb n TYR 124 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 1yrb s PRO 125 N -7.03 3.85 -0.29 -0.72 0.04 -1.26 -4.71 135.00 124.89 1yrb s PRO 125 Ca 0.30 1.81 -0.11 0.00 0.04 0.00 0.00 61.00 63.04 1yrb s PRO 125 Cb -0.15 -2.50 -0.04 0.00 0.04 0.00 0.00 34.50 31.85 1yrb s PRO 125 CO 0.95 -0.48 0.20 -1.17 0.04 0.00 0.00 177.00 176.54 1yrb s LEU 126 N -2.84 4.10 -0.15 -3.56 2.96 -0.30 -4.03 118.68 114.85 1yrb s LEU 126 Ca 0.61 -0.07 -0.15 0.00 -0.22 0.00 0.00 54.13 54.30 1yrb s LEU 126 Cb -0.30 -2.13 -0.04 0.00 0.50 0.00 0.00 46.19 44.22 1yrb s LEU 126 CO 0.36 -0.08 0.35 -0.69 -1.32 0.00 0.00 176.35 174.97 1yrb s VAL 127 N 1.76 5.27 -0.28 1.68 1.01 0.11 -0.29 120.40 129.66 1yrb s VAL 127 Ca 0.07 0.68 -0.05 0.00 0.00 0.00 0.00 61.98 62.68 1yrb s VAL 127 Cb -0.16 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.54 1yrb s VAL 127 CO 0.11 0.37 0.04 -0.69 0.00 0.00 0.00 175.10 174.92 1yrb s VAL 128 N 0.53 3.58 -0.42 2.92 1.01 0.51 -0.21 120.40 128.32 1yrb s VAL 128 Ca 0.19 -0.85 -0.14 0.00 0.00 0.00 0.00 61.98 61.18 1yrb s VAL 128 Cb -0.14 -2.86 0.03 0.00 0.00 0.00 0.00 36.38 33.42 1yrb s VAL 128 CO 0.06 0.09 0.30 -0.47 0.00 0.00 0.00 175.10 175.08 1yrb s TYR 129 N 1.43 3.24 -0.13 5.22 5.04 -0.26 -1.14 117.35 130.75 1yrb s TYR 129 Ca 0.01 -0.74 -0.10 0.00 -2.44 0.00 0.00 57.07 53.80 1yrb s TYR 129 Cb -0.17 -2.69 -0.05 0.00 0.35 0.00 0.00 41.96 39.40 1yrb s TYR 129 CO 0.00 -0.65 0.20 0.96 -1.34 0.00 0.00 175.55 174.73 1yrb s ILE 130 N 1.65 5.38 0.12 3.14 -4.36 -0.07 -0.64 121.20 126.41 1yrb s ILE 130 Ca 0.04 0.35 0.08 0.00 -0.26 0.00 0.00 60.65 60.86 1yrb s ILE 130 Cb -0.20 -3.50 -0.04 0.00 1.25 0.00 0.00 42.46 39.96 1yrb s ILE 130 CO 0.09 0.53 -0.12 -0.44 0.24 0.00 0.00 174.94 175.23 1yrb s SER 131 N -0.40 4.25 -0.26 4.36 0.01 -0.20 -4.30 113.70 117.17 1yrb s SER 131 Ca 0.15 -0.45 -0.27 0.00 1.31 0.00 0.00 55.95 56.69 1yrb s SER 131 Cb -0.13 -0.75 0.00 0.00 0.21 0.00 0.00 66.02 65.36 1yrb s SER 131 CO 0.04 0.17 0.93 -0.62 0.41 0.00 0.00 173.24 174.17 1yrb s ASP 132 N -2.26 6.91 0.64 2.44 -1.08 -1.26 -1.20 116.67 120.85 1yrb s ASP 132 Ca 0.21 1.10 0.28 0.00 -0.52 0.00 0.00 52.55 53.62 1yrb s ASP 132 Cb -0.11 -2.48 1.49 0.00 -1.46 0.00 0.00 42.92 40.36 1yrb s ASP 132 CO 0.13 -0.64 1.86 -0.65 0.52 0.00 0.00 175.17 176.39 1yrb h PRO 133 N 7.73 0.00 0.00 4.34 0.11 -1.93 -1.91 132.00 140.34 1yrb h PRO 133 Ca -0.21 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.89 1yrb h PRO 133 Cb 1.08 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1yrb h PRO 133 CO 0.94 0.00 -0.04 1.49 -0.21 0.00 0.00 178.00 180.18 1yrb h GLU 134 N 0.00 0.00 0.00 1.05 4.57 -1.94 -0.91 114.58 117.34 1yrb h GLU 134 Ca 0.07 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 1yrb h GLU 134 Cb 0.91 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.50 1yrb h GLU 134 CO -0.00 0.04 -0.04 0.97 -1.18 0.00 0.00 179.01 178.80 1yrb h ILE 135 N 0.00 0.08 -2.81 2.32 6.09 -1.76 -3.41 117.51 118.02 1yrb h ILE 135 Ca -0.00 -0.87 -0.71 0.00 -1.37 0.00 0.00 64.86 61.91 1yrb h ILE 135 Cb 0.19 1.80 -0.20 0.00 0.47 0.00 0.00 36.82 39.09 1yrb h ILE 135 CO 0.00 0.04 0.55 -0.76 -3.07 0.00 0.00 178.15 174.92 1yrb s LEU 136 N -6.25 5.44 -0.12 2.19 1.43 -0.35 -4.77 118.68 116.24 1yrb s LEU 136 Ca 0.04 -2.03 0.01 0.00 -1.03 0.00 0.00 54.13 51.12 1yrb s LEU 136 Cb 0.07 -2.34 -0.08 0.00 0.03 0.00 0.00 46.19 43.86 1yrb s LEU 136 CO 0.62 -0.99 -0.10 0.29 0.23 0.00 0.00 176.35 176.40 1yrb n LYS 137 N 6.02 0.42 -4.31 1.70 5.02 -1.26 -5.04 118.16 120.71 1yrb n LYS 137 Ca 0.15 0.07 -0.17 0.00 -2.02 0.00 0.00 58.31 56.34 1yrb n LYS 137 Cb 0.47 -1.25 -0.10 0.00 -0.02 0.00 0.00 35.03 34.14 1yrb n LYS 137 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 1yrb s LYS 138 N -2.25 1.24 0.30 1.97 -2.85 -1.26 -5.05 119.74 111.84 1yrb s LYS 138 Ca -0.16 -1.55 0.06 0.00 -1.00 0.00 0.00 55.97 53.31 1yrb s LYS 138 Cb 0.04 -0.88 0.82 0.00 -2.06 0.00 0.00 37.83 35.75 1yrb s LYS 138 CO 0.29 0.11 1.66 -1.35 0.10 0.00 0.00 175.35 176.16 1yrb h PRO 139 N 2.62 0.26 -0.07 1.78 0.11 -2.00 0.11 132.00 134.81 1yrb h PRO 139 Ca -0.38 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 65.73 1yrb h PRO 139 Cb 1.21 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 1yrb h PRO 139 CO 0.63 0.17 0.05 -0.91 -0.21 0.00 0.00 178.00 177.73 1yrb h ASN 140 N 0.27 0.04 -0.24 -2.05 -0.26 -1.98 -1.88 115.58 109.48 1yrb h ASN 140 Ca 0.61 -0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 56.25 1yrb h ASN 140 Cb 1.26 -0.01 -0.02 0.00 -1.06 0.00 0.00 38.32 38.50 1yrb h ASN 140 CO -0.63 0.03 -0.16 0.44 -1.06 0.00 0.00 177.43 176.05 1yrb h ASP 141 N 0.04 0.66 -0.68 5.81 3.32 -1.13 -1.43 116.42 123.02 1yrb h ASP 141 Ca 0.03 -0.21 -0.07 0.00 0.02 0.00 0.00 57.03 56.80 1yrb h ASP 141 Cb 0.07 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 1yrb h ASP 141 CO -0.00 0.84 0.16 1.88 -1.72 0.00 0.00 179.24 180.39 1yrb h TYR 142 N 0.60 1.15 -0.30 4.55 0.05 -1.37 -1.60 116.97 120.05 1yrb h TYR 142 Ca 0.10 -0.14 -0.08 0.00 0.05 0.00 0.00 58.73 58.66 1yrb h TYR 142 Cb 0.62 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 38.02 1yrb h TYR 142 CO 0.03 0.94 -0.12 0.00 -1.05 0.00 0.00 178.16 177.96 1yrb h PHE 144 N 0.38 -0.67 -0.38 0.00 3.57 -1.04 0.71 116.94 119.50 1yrb h PHE 144 Ca 0.07 0.05 -0.14 0.00 3.53 0.00 0.00 57.97 61.49 1yrb h PHE 144 Cb 0.63 0.36 -0.01 0.00 2.79 0.00 0.00 35.95 39.71 1yrb h PHE 144 CO 0.06 -0.33 -0.31 0.28 -2.23 0.00 0.00 178.31 175.78 1yrb h VAL 145 N -0.18 1.28 -0.23 1.41 2.07 -1.17 -0.05 116.25 119.37 1yrb h VAL 145 Ca 0.19 -1.46 -0.17 0.00 0.82 0.00 0.00 66.70 66.08 1yrb h VAL 145 Cb 0.48 1.31 -0.00 0.00 -1.52 0.00 0.00 31.29 31.57 1yrb h VAL 145 CO -0.51 0.49 -0.55 0.03 0.02 0.00 0.00 177.57 177.04 1yrb h ARG 146 N 0.70 0.70 -0.55 1.57 2.47 -0.45 -2.36 114.38 116.46 1yrb h ARG 146 Ca 0.08 -0.44 -0.08 0.00 -1.26 0.00 0.00 59.98 58.27 1yrb h ARG 146 Cb 0.86 0.05 -0.02 0.00 -1.65 0.00 0.00 29.97 29.21 1yrb h ARG 146 CO 0.08 1.06 0.01 0.35 0.56 0.00 0.00 179.97 182.03 1yrb h PHE 147 N 0.54 1.00 -0.94 3.04 3.04 0.55 -2.69 116.94 121.48 1yrb h PHE 147 Ca 0.01 -0.15 0.03 0.00 3.98 0.00 0.00 57.97 61.83 1yrb h PHE 147 Cb 1.12 -0.27 -0.05 0.00 2.56 0.00 0.00 35.95 39.31 1yrb h PHE 147 CO 0.06 0.89 0.61 0.35 -2.02 0.00 0.00 178.31 178.20 1yrb h PHE 148 N 0.86 1.16 -0.86 0.41 3.57 -0.81 -1.55 116.94 119.72 1yrb h PHE 148 Ca 0.16 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.70 1yrb h PHE 148 Cb 0.50 -0.39 -0.04 0.00 2.79 0.00 0.00 35.95 38.81 1yrb h PHE 148 CO 0.03 0.69 0.56 0.00 -2.23 0.00 0.00 178.31 177.36 1yrb h ALA 149 N 1.37 1.38 -0.82 2.41 0.00 -1.12 -0.34 119.26 122.14 1yrb h ALA 149 Ca 0.36 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 1yrb h ALA 149 Cb -0.05 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.36 1yrb h ALA 149 CO -0.10 0.57 0.35 1.25 0.00 0.00 0.00 179.25 181.32 1yrb h LEU 150 N 1.16 1.11 -1.04 0.00 5.85 -1.02 -2.01 115.31 119.37 1yrb h LEU 150 Ca 0.31 -0.16 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 1yrb h LEU 150 Cb -0.13 -0.29 -0.01 0.00 0.37 0.00 0.00 40.66 40.60 1yrb h LEU 150 CO -0.07 0.97 -0.25 -0.07 -0.34 0.00 0.00 178.44 178.69 1yrb h LEU 151 N 1.19 0.38 -0.19 2.25 4.07 -0.33 -0.37 115.31 122.31 1yrb h LEU 151 Ca 0.28 -0.12 -0.02 0.00 0.08 0.00 0.00 57.88 58.09 1yrb h LEU 151 Cb 0.18 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.81 1yrb h LEU 151 CO -0.03 0.64 0.03 0.40 -1.08 0.00 0.00 178.44 178.40 1yrb h ILE 152 N 0.35 1.22 -0.20 1.22 2.04 -0.76 0.70 117.51 122.08 1yrb h ILE 152 Ca 0.05 -0.72 0.06 0.00 1.00 0.00 0.00 64.86 65.25 1yrb h ILE 152 Cb 0.62 1.32 -0.06 0.00 -0.74 0.00 0.00 36.82 37.96 1yrb h ILE 152 CO 0.04 0.22 -0.22 -0.78 0.00 0.00 0.00 178.15 177.42 1yrb h ASP 153 N 0.12 -0.70 -0.03 1.72 1.82 -1.11 0.14 116.42 118.38 1yrb h ASP 153 Ca 0.06 0.13 0.03 0.00 -0.39 0.00 0.00 57.03 56.86 1yrb h ASP 153 Cb 0.30 0.33 -0.04 0.00 0.68 0.00 0.00 39.33 40.60 1yrb h ASP 153 CO 0.00 -0.26 -0.23 0.25 -1.61 0.00 0.00 179.24 177.39 1yrb h LEU 154 N -0.24 -0.68 -0.44 2.28 5.85 -0.94 0.14 115.31 121.27 1yrb h LEU 154 Ca 0.12 0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.87 1yrb h LEU 154 Cb 0.43 0.29 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 1yrb h LEU 154 CO -0.34 -0.29 0.01 -0.09 -0.34 0.00 0.00 178.44 177.39 1yrb h ARG 155 N -0.35 0.78 0.00 1.25 9.65 -0.34 -3.15 114.38 122.21 1yrb h ARG 155 Ca 0.07 -0.24 0.00 0.00 -1.10 0.00 0.00 59.98 58.71 1yrb h ARG 155 Cb 0.44 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.95 1yrb h ARG 155 CO -0.23 0.83 -0.69 1.28 2.80 0.00 0.00 179.97 183.96 1yrb n LEU 156 N -4.40 0.61 -3.46 3.80 4.77 0.44 -4.97 117.00 113.79 1yrb n LEU 156 Ca 0.00 0.01 -0.21 0.00 -0.03 0.00 0.00 56.01 55.77 1yrb n LEU 156 Cb 0.29 -0.18 0.08 0.00 -2.33 0.00 0.00 43.42 41.28 1yrb n LEU 156 CO 0.41 0.08 0.20 0.61 -1.33 0.00 0.00 177.39 177.36 1yrb n GLY 157 N 1.43 -0.46 3.10 -0.72 0.00 0.48 -4.53 105.19 104.50 1yrb n GLY 157 Ca 0.04 0.19 -0.12 0.00 0.00 0.00 0.00 46.02 46.13 1yrb n GLY 157 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yrb s ALA 158 N -3.32 -0.43 0.21 4.61 0.00 -1.17 -5.00 121.76 116.65 1yrb s ALA 158 Ca 0.41 0.20 -0.31 0.00 0.00 0.00 0.00 51.96 52.26 1yrb s ALA 158 Cb -0.18 -0.08 -0.11 0.00 0.00 0.00 0.00 23.12 22.75 1yrb s ALA 158 CO 0.71 -0.16 1.61 0.99 0.00 0.00 0.00 175.76 178.91 1yrb s THR 159 N -0.72 2.33 -0.10 0.00 2.01 -1.26 -4.33 115.64 113.57 1yrb s THR 159 Ca -0.08 0.25 0.02 0.00 0.31 0.00 0.00 61.69 62.18 1yrb s THR 159 Cb -0.05 -3.16 0.02 0.00 0.01 0.00 0.00 72.50 69.32 1yrb s THR 159 CO 0.01 0.02 -0.14 -0.89 -0.69 0.00 0.00 174.62 172.94 1yrb s THR 160 N 0.86 1.41 -0.32 -0.82 2.01 -1.26 -0.71 115.64 116.82 1yrb s THR 160 Ca 0.70 -0.59 -0.10 0.00 0.31 0.00 0.00 61.69 62.00 1yrb s THR 160 Cb -0.46 -1.30 -0.01 0.00 0.01 0.00 0.00 72.50 70.74 1yrb s THR 160 CO 0.35 0.42 0.17 -0.63 -0.69 0.00 0.00 174.62 174.25 1yrb s ILE 161 N 1.02 4.76 0.21 1.82 -1.09 0.70 -4.96 121.20 123.66 1yrb s ILE 161 Ca -0.06 -0.37 -0.30 0.00 -2.23 0.00 0.00 60.65 57.69 1yrb s ILE 161 Cb -0.15 -3.43 -0.09 0.00 -1.58 0.00 0.00 42.46 37.21 1yrb s ILE 161 CO -0.02 0.05 1.35 -2.84 -1.23 0.00 0.00 174.94 172.26 1yrb s PRO 162 N 1.64 4.35 0.02 2.79 0.02 -1.26 -1.10 135.00 141.46 1yrb s PRO 162 Ca 0.05 2.13 -0.01 0.00 0.02 0.00 0.00 61.00 63.18 1yrb s PRO 162 Cb -0.17 -3.17 -0.02 0.00 0.02 0.00 0.00 34.50 31.16 1yrb s PRO 162 CO 0.07 -0.32 -0.00 0.00 -0.33 0.00 0.00 177.00 176.43 1yrb s ALA 163 N 0.15 0.08 -0.10 -1.55 0.00 0.19 -1.88 121.76 118.65 1yrb s ALA 163 Ca 0.58 -0.57 -0.04 0.00 0.00 0.00 0.00 51.96 51.92 1yrb s ALA 163 Cb -0.38 0.16 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 1yrb s ALA 163 CO 0.39 -0.19 0.07 -0.51 0.00 0.00 0.00 175.76 175.52 1yrb s LEU 164 N -1.59 3.97 0.43 0.00 1.43 0.05 -1.03 118.68 121.93 1yrb s LEU 164 Ca -0.14 0.30 0.07 0.00 -1.03 0.00 0.00 54.13 53.33 1yrb s LEU 164 Cb -0.08 -1.94 -0.03 0.00 0.03 0.00 0.00 46.19 44.17 1yrb s LEU 164 CO -0.01 0.39 0.25 0.21 0.23 0.00 0.00 176.35 177.41 1yrb s ASN 165 N -0.92 4.59 -1.29 2.29 3.04 -0.34 -0.14 114.94 122.17 1yrb s ASN 165 Ca 0.14 -1.03 0.00 0.00 0.04 0.00 0.00 52.86 52.01 1yrb s ASN 165 Cb -0.12 -0.38 0.00 0.00 -1.54 0.00 0.00 41.25 39.21 1yrb s ASN 165 CO 0.03 -0.64 0.00 0.29 -3.04 0.00 0.00 177.10 173.74 1yrb n LYS 166 N -1.37 -1.11 0.02 0.43 5.02 -0.94 -4.27 118.16 115.95 1yrb n LYS 166 Ca -0.00 0.76 0.08 0.00 -2.02 0.00 0.00 58.31 57.13 1yrb n LYS 166 Cb 0.64 -5.01 0.34 0.00 -0.02 0.00 0.00 35.03 30.98 1yrb n LYS 166 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1yrb n VAL 167 N -3.69 0.98 0.31 -0.18 0.24 -0.89 -1.95 118.33 113.14 1yrb n VAL 167 Ca -0.16 0.25 0.19 0.00 -2.04 0.00 0.00 64.34 62.58 1yrb n VAL 167 Cb 0.59 -1.03 0.94 0.00 -1.47 0.00 0.00 33.84 32.87 1yrb n VAL 167 CO 0.00 0.00 0.00 -2.24 -2.14 0.00 0.00 176.83 172.45 1yrb h ASP 168 N 0.00 0.00 0.42 -1.34 2.03 -1.90 -2.22 116.42 113.41 1yrb h ASP 168 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1yrb h ASP 168 Cb 0.27 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.77 1yrb h ASP 168 CO 0.00 0.01 -0.18 0.18 -1.03 0.00 0.00 179.24 178.23 1yrb n LEU 169 N -3.15 0.54 -4.86 0.15 4.77 -0.82 -4.90 117.00 108.73 1yrb n LEU 169 Ca -0.01 0.00 -0.35 0.00 -0.03 0.00 0.00 56.01 55.61 1yrb n LEU 169 Cb 0.19 -0.21 -0.06 0.00 -2.33 0.00 0.00 43.42 41.01 1yrb n LEU 169 CO 0.24 0.10 0.05 -0.76 -1.33 0.00 0.00 177.39 175.69 1yrb s LEU 170 N -2.60 4.38 0.84 2.23 1.43 -0.84 -5.09 118.68 119.03 1yrb s LEU 170 Ca 0.24 0.77 -0.11 0.00 -1.03 0.00 0.00 54.13 54.00 1yrb s LEU 170 Cb 0.19 -2.81 0.09 0.00 0.03 0.00 0.00 46.19 43.70 1yrb s LEU 170 CO 0.52 0.23 1.09 -0.94 0.23 0.00 0.00 176.35 177.48 1yrb s SER 171 N -1.58 4.04 0.36 2.29 1.04 -1.26 -4.84 113.70 113.76 1yrb s SER 171 Ca 0.29 1.41 0.09 0.00 0.48 0.00 0.00 55.95 58.23 1yrb s SER 171 Cb -0.14 -2.12 0.69 0.00 0.10 0.00 0.00 66.02 64.55 1yrb s SER 171 CO 0.16 -2.27 1.85 -0.08 0.98 0.00 0.00 173.24 173.88 1yrb h GLU 172 N -1.29 0.20 -0.54 4.02 4.57 -1.98 -0.02 114.58 119.54 1yrb h GLU 172 Ca -0.48 -0.06 -0.06 0.00 -1.18 0.00 0.00 59.36 57.58 1yrb h GLU 172 Cb 1.27 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.82 1yrb h GLU 172 CO 0.57 0.44 0.09 1.05 -1.18 0.00 0.00 179.01 179.98 1yrb h GLU 173 N 0.19 0.89 -0.23 1.92 4.11 -2.00 -2.12 114.58 117.34 1yrb h GLU 173 Ca 0.03 -0.24 -0.02 0.00 0.07 0.00 0.00 59.36 59.20 1yrb h GLU 173 Cb 0.53 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.66 1yrb h GLU 173 CO 0.04 0.86 0.05 0.93 0.07 0.00 0.00 179.01 180.96 1yrb h GLU 174 N 0.78 0.37 -1.00 1.06 5.08 -1.77 -2.35 114.58 116.75 1yrb h GLU 174 Ca 0.16 -0.09 0.10 0.00 -1.00 0.00 0.00 59.36 58.53 1yrb h GLU 174 Cb 0.40 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.53 1yrb h GLU 174 CO 0.01 0.49 0.64 0.87 -1.00 0.00 0.00 179.01 180.02 1yrb h LYS 175 N 0.19 1.04 -0.16 2.33 1.57 -0.93 -1.96 116.57 118.64 1yrb h LYS 175 Ca 0.07 -0.06 -0.18 0.00 -1.87 0.00 0.00 60.65 58.61 1yrb h LYS 175 Cb 0.29 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.36 1yrb h LYS 175 CO 0.00 0.69 -0.64 1.49 -0.57 0.00 0.00 179.45 180.43 1yrb h GLU 176 N 1.08 0.59 -0.06 3.15 4.57 -1.24 -1.75 114.58 120.91 1yrb h GLU 176 Ca 0.47 -0.41 -0.00 0.00 -1.18 0.00 0.00 59.36 58.23 1yrb h GLU 176 Cb 0.34 0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.00 1yrb h GLU 176 CO -0.22 1.03 0.04 -0.09 -1.18 0.00 0.00 179.01 178.59 1yrb h ARG 177 N 0.43 0.09 -0.99 1.92 2.43 -0.98 -1.71 114.38 115.56 1yrb h ARG 177 Ca -0.01 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.17 1yrb h ARG 177 Cb 1.21 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.69 1yrb h ARG 177 CO 0.12 0.10 0.66 0.45 -1.51 0.00 0.00 179.97 179.78 1yrb h HIS 178 N 0.05 1.24 -0.77 2.20 3.86 -1.32 -2.45 115.15 117.96 1yrb h HIS 178 Ca 0.02 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.22 1yrb h HIS 178 Cb 0.03 -0.42 -0.03 0.00 1.06 0.00 0.00 27.41 28.05 1yrb h HIS 178 CO -0.06 0.76 0.30 -0.09 0.86 0.00 0.00 177.93 179.70 1yrb h ARG 179 N 1.32 1.15 -0.22 2.45 2.43 -1.10 0.39 114.38 120.79 1yrb h ARG 179 Ca 0.37 -0.21 0.03 0.00 -0.81 0.00 0.00 59.98 59.37 1yrb h ARG 179 Cb -0.12 -0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.22 1yrb h ARG 179 CO -0.09 0.93 0.02 -0.22 -1.51 0.00 0.00 179.97 179.11 1yrb h LYS 180 N 1.12 0.10 0.02 0.20 3.64 -0.84 -3.25 116.57 117.56 1yrb h LYS 180 Ca 0.25 -0.01 -0.34 0.00 -1.27 0.00 0.00 60.65 59.28 1yrb h LYS 180 Cb 0.22 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.97 1yrb h LYS 180 CO -0.02 0.07 -2.09 0.66 -2.27 0.00 0.00 179.45 175.79 1yrb n TYR 181 N -5.11 0.57 0.09 1.91 4.01 -1.10 -4.11 117.16 113.41 1yrb n TYR 181 Ca -0.02 0.17 -0.06 0.00 -0.16 0.00 0.00 57.90 57.83 1yrb n TYR 181 Cb 0.11 -1.09 -0.01 0.00 -0.31 0.00 0.00 39.34 38.03 1yrb n TYR 181 CO 0.00 0.00 0.00 0.35 -0.46 0.00 0.00 176.86 176.75 1yrb h PHE 182 N 0.01 0.08 0.00 -0.72 3.57 -0.34 -3.39 116.94 116.15 1yrb h PHE 182 Ca -0.44 -0.05 -0.29 0.00 3.53 0.00 0.00 57.97 60.72 1yrb h PHE 182 Cb 2.08 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 40.76 1yrb h PHE 182 CO 0.02 0.90 -2.11 -0.85 -2.23 0.00 0.00 178.31 174.03 1yrb n GLU 183 N -3.55 0.66 -2.88 1.11 0.28 -1.23 -4.86 120.64 110.16 1yrb n GLU 183 Ca -0.01 0.09 -0.43 0.00 -0.16 0.00 0.00 57.16 56.65 1yrb n GLU 183 Cb 0.82 -1.39 -0.03 0.00 1.43 0.00 0.00 31.44 32.27 1yrb n GLU 183 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 1yrb s ASP 184 N -5.75 6.44 0.17 -1.84 2.15 -1.26 -4.89 116.67 111.69 1yrb s ASP 184 Ca -0.23 -1.60 -0.05 0.00 0.43 0.00 0.00 52.55 51.10 1yrb s ASP 184 Cb 0.06 -2.41 0.04 0.00 -0.30 0.00 0.00 42.92 40.32 1yrb s ASP 184 CO 0.48 -1.23 1.46 0.40 -0.17 0.00 0.00 175.17 176.11 1yrb h ILE 185 N 5.95 1.32 -0.81 4.11 1.08 -1.89 -0.12 117.51 127.15 1yrb h ILE 185 Ca -0.02 -1.85 0.07 0.00 -0.39 0.00 0.00 64.86 62.68 1yrb h ILE 185 Cb 1.04 1.81 -0.06 0.00 -3.07 0.00 0.00 36.82 36.54 1yrb h ILE 185 CO 1.15 0.58 0.47 0.44 -0.69 0.00 0.00 178.15 180.11 1yrb h ASP 186 N 0.46 0.71 -0.40 1.72 3.45 -1.93 0.14 116.42 120.58 1yrb h ASP 186 Ca -0.00 0.03 -0.11 0.00 0.43 0.00 0.00 57.03 57.38 1yrb h ASP 186 Cb 1.16 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 39.81 1yrb h ASP 186 CO 0.12 0.44 -0.16 0.22 -1.57 0.00 0.00 179.24 178.28 1yrb h TYR 187 N 0.84 0.93 -0.29 4.55 5.03 -1.84 -2.03 116.97 124.16 1yrb h TYR 187 Ca 0.37 -0.22 -0.01 0.00 2.58 0.00 0.00 58.73 61.45 1yrb h TYR 187 Cb 0.26 -0.22 -0.01 0.00 1.55 0.00 0.00 36.73 38.30 1yrb h TYR 187 CO -0.05 0.97 0.14 1.25 -1.32 0.00 0.00 178.16 179.15 1yrb h LEU 188 N 0.63 0.38 -0.51 2.82 6.46 -0.58 -2.22 115.31 122.28 1yrb h LEU 188 Ca 0.09 -0.12 0.07 0.00 -0.12 0.00 0.00 57.88 57.81 1yrb h LEU 188 Cb 0.71 -0.10 -0.06 0.00 -0.73 0.00 0.00 40.66 40.48 1yrb h LEU 188 CO 0.05 0.39 0.17 0.74 -0.62 0.00 0.00 178.44 179.18 1yrb h THR 189 N 0.34 0.80 -0.35 1.05 2.02 -0.68 -0.34 112.91 115.76 1yrb h THR 189 Ca 0.10 -0.12 0.05 0.00 0.77 0.00 0.00 66.41 67.21 1yrb h THR 189 Cb 0.11 0.43 -0.04 0.00 -1.74 0.00 0.00 68.15 66.91 1yrb h THR 189 CO -0.01 0.06 0.10 0.00 0.37 0.00 0.00 175.52 176.04 1yrb h ALA 190 N 1.35 0.39 -0.63 6.16 0.00 -1.10 -1.30 119.26 124.15 1yrb h ALA 190 Ca 0.25 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.15 1yrb h ALA 190 Cb 0.29 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1yrb h ALA 190 CO -0.27 -0.30 0.15 -0.09 0.00 0.00 0.00 179.25 178.74 1yrb h ARG 191 N 0.23 0.99 -0.45 0.00 9.65 -0.74 -2.66 114.38 121.39 1yrb h ARG 191 Ca 0.16 -0.22 -0.08 0.00 -1.10 0.00 0.00 59.98 58.74 1yrb h ARG 191 Cb 0.16 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.58 1yrb h ARG 191 CO -0.19 0.88 -0.05 -0.07 2.80 0.00 0.00 179.97 183.34 1yrb h LEU 192 N 0.94 0.75 -1.97 3.80 3.38 -0.71 -2.71 115.31 118.79 1yrb h LEU 192 Ca 0.20 -0.20 0.14 0.00 0.09 0.00 0.00 57.88 58.11 1yrb h LEU 192 Cb 0.34 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1yrb h LEU 192 CO 0.00 0.85 0.36 0.50 0.09 0.00 0.00 178.44 180.24 1yrb h LYS 193 N 0.71 0.03 0.00 1.13 3.64 -0.88 -1.47 116.57 119.74 1yrb h LYS 193 Ca 0.13 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 1yrb h LYS 193 Cb 0.51 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1yrb h LYS 193 CO 0.03 0.02 0.00 -0.07 -2.27 0.00 0.00 179.45 177.16 1yrb h LEU 194 N 0.03 0.00 -8.70 5.20 3.38 -1.46 -3.43 115.31 110.34 1yrb h LEU 194 Ca 0.24 0.00 -0.63 0.00 0.09 0.00 0.00 57.88 57.58 1yrb h LEU 194 Cb 0.92 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.54 1yrb h LEU 194 CO -0.01 0.00 0.28 -0.62 0.09 0.00 0.00 178.44 178.18 1yrb s ASP 195 N -4.68 6.44 0.00 -0.43 3.68 -0.55 -4.93 116.67 116.19 1yrb s ASP 195 Ca 0.05 0.03 0.30 0.00 2.13 0.00 0.00 52.55 55.06 1yrb s ASP 195 Cb 0.10 -2.37 1.53 0.00 -1.45 0.00 0.00 42.92 40.73 1yrb s ASP 195 CO 0.48 -0.78 2.03 -0.81 0.13 0.00 0.00 175.17 176.21 1yrb n PRO 196 N 6.44 0.87 -1.31 4.34 -0.04 -1.26 -3.92 135.00 140.11 1yrb n PRO 196 Ca 0.01 -0.18 -0.30 0.00 -0.04 0.00 0.00 63.50 62.99 1yrb n PRO 196 Cb 0.48 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.58 1yrb n PRO 196 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1yrb s SER 197 N -2.26 3.64 0.18 3.54 1.04 -1.26 -4.80 113.70 113.79 1yrb s SER 197 Ca 0.37 1.37 -0.13 0.00 0.48 0.00 0.00 55.95 58.04 1yrb s SER 197 Cb 0.21 -2.06 0.11 0.00 0.10 0.00 0.00 66.02 64.39 1yrb s SER 197 CO 0.42 -2.52 1.81 0.24 0.98 0.00 0.00 173.24 174.17 1yrb h MET 198 N -1.47 0.58 -0.49 4.02 2.86 -1.99 0.32 114.93 118.76 1yrb h MET 198 Ca -0.49 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.07 1yrb h MET 198 Cb 1.29 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.80 1yrb h MET 198 CO 0.57 0.38 0.14 0.37 1.06 0.00 0.00 176.91 179.43 1yrb h GLN 199 N 0.60 0.78 -0.60 1.72 4.15 -1.95 -0.90 115.11 118.91 1yrb h GLN 199 Ca 0.21 -0.17 -0.02 0.00 0.77 0.00 0.00 58.65 59.44 1yrb h GLN 199 Cb 0.05 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.60 1yrb h GLN 199 CO -0.11 0.74 0.29 0.78 -1.93 0.00 0.00 178.83 178.60 1yrb h GLY 200 N 0.67 0.92 0.64 2.39 0.00 -1.68 0.11 103.07 106.12 1yrb h GLY 200 Ca 0.16 -0.46 0.04 0.00 0.00 0.00 0.00 47.33 47.07 1yrb h GLY 200 CO -0.00 0.43 -0.03 1.41 0.00 0.00 0.00 176.54 178.35 1yrb h LEU 201 N 0.81 -0.14 -0.04 3.11 4.07 -0.78 0.22 115.31 122.56 1yrb h LEU 201 Ca 0.20 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.22 1yrb h LEU 201 Cb 0.12 0.10 -0.00 0.00 1.08 0.00 0.00 40.66 41.96 1yrb h LEU 201 CO -0.03 -0.05 0.01 -0.03 -1.08 0.00 0.00 178.44 177.27 1yrb h MET 202 N 0.02 0.03 -0.66 1.13 4.05 -0.70 -0.18 114.93 118.62 1yrb h MET 202 Ca 0.09 -0.00 0.04 0.00 -0.28 0.00 0.00 59.70 59.55 1yrb h MET 202 Cb 0.13 -0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 30.88 1yrb h MET 202 CO -0.18 0.02 0.40 0.00 0.23 0.00 0.00 176.91 177.37 1yrb h ALA 203 N 1.02 0.87 -0.45 0.39 0.00 -0.53 -0.70 119.26 119.87 1yrb h ALA 203 Ca 0.02 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.93 1yrb h ALA 203 Cb 0.01 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1yrb h ALA 203 CO -0.02 0.14 0.28 -0.92 0.00 0.00 0.00 179.25 178.73 1yrb h TYR 204 N 0.77 0.53 -0.68 0.00 5.03 -0.09 0.11 116.97 122.63 1yrb h TYR 204 Ca 0.27 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.57 1yrb h TYR 204 Cb 0.06 -0.18 -0.03 0.00 1.55 0.00 0.00 36.73 38.13 1yrb h TYR 204 CO -0.05 0.32 0.33 0.87 -1.32 0.00 0.00 178.16 178.31 1yrb h LYS 205 N 0.57 0.98 -0.30 1.82 1.57 -0.46 -0.74 116.57 120.01 1yrb h LYS 205 Ca 0.17 -0.14 -0.14 0.00 -1.87 0.00 0.00 60.65 58.67 1yrb h LYS 205 Cb -0.03 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.10 1yrb h LYS 205 CO -0.06 0.77 -0.36 0.52 -0.57 0.00 0.00 179.45 179.76 1yrb h MET 206 N 0.95 0.78 -0.00 3.15 2.86 -0.80 -1.59 114.93 120.28 1yrb h MET 206 Ca 0.23 -0.43 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 1yrb h MET 206 Cb 0.11 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.80 1yrb h MET 206 CO -0.03 1.06 -0.00 0.00 1.06 0.00 0.00 176.91 179.00 1yrb h SER 208 N 0.00 0.49 -0.84 0.00 4.64 -1.03 -3.32 113.55 113.50 1yrb h SER 208 Ca 0.00 -0.95 -0.01 0.00 -0.47 0.00 0.00 61.79 60.36 1yrb h SER 208 Cb 0.34 -0.16 -0.04 0.00 -0.31 0.00 0.00 62.40 62.23 1yrb h SER 208 CO 0.00 1.83 0.50 -0.03 -0.87 0.00 0.00 176.83 178.26 1yrb h MET 209 N 0.07 1.15 -0.58 4.77 -1.53 -1.04 -2.50 114.93 115.27 1yrb h MET 209 Ca -0.39 -0.11 -0.02 0.00 -3.44 0.00 0.00 59.70 55.74 1yrb h MET 209 Cb 2.05 -0.24 -0.03 0.00 -0.55 0.00 0.00 31.60 32.83 1yrb h MET 209 CO 0.12 0.81 0.28 1.98 0.14 0.00 0.00 176.91 180.24 1yrb h MET 210 N 1.17 0.81 0.00 0.39 4.05 -1.31 -1.33 114.93 118.71 1yrb h MET 210 Ca 0.30 -0.10 -0.04 0.00 -0.28 0.00 0.00 59.70 59.58 1yrb h MET 210 Cb -0.03 -0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 30.60 1yrb h MET 210 CO -0.06 0.63 -0.21 1.79 0.23 0.00 0.00 176.91 179.30 1yrb h THR 211 N 0.82 0.68 0.00 -0.77 1.35 -1.54 -0.83 112.91 112.61 1yrb h THR 211 Ca 0.20 -0.89 -0.04 0.00 -0.55 0.00 0.00 66.41 65.13 1yrb h THR 211 Cb 0.09 1.56 -0.01 0.00 -1.73 0.00 0.00 68.15 68.06 1yrb h THR 211 CO -0.03 0.20 -1.70 -0.62 -0.25 0.00 0.00 175.52 173.13 1yrb n GLU 212 N -3.62 0.64 0.08 4.72 1.02 -0.93 -4.10 120.64 118.45 1yrb n GLU 212 Ca -0.01 -0.06 0.11 0.00 -0.02 0.00 0.00 57.16 57.18 1yrb n GLU 212 Cb 0.34 -1.63 -0.00 0.00 -0.02 0.00 0.00 31.44 30.12 1yrb n GLU 212 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1yrb n VAL 213 N -2.47 0.49 -3.70 2.62 0.31 -0.55 -4.87 118.33 110.16 1yrb n VAL 213 Ca -0.06 -0.50 -0.16 0.00 -0.01 0.00 0.00 64.34 63.62 1yrb n VAL 213 Cb 0.63 -0.24 -0.16 0.00 -0.91 0.00 0.00 33.84 33.17 1yrb n VAL 213 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1yrb s LEU 214 N -5.05 0.30 0.00 7.52 0.20 -0.34 -5.07 118.68 116.24 1yrb s LEU 214 Ca -0.00 0.26 -0.13 0.00 0.69 0.00 0.00 54.13 54.95 1yrb s LEU 214 Cb 0.11 0.22 0.21 0.00 -0.43 0.00 0.00 46.19 46.29 1yrb s LEU 214 CO 0.80 -0.21 0.46 -2.65 -0.29 0.00 0.00 176.35 174.47 1yrb n PRO 215 N 4.87 -2.18 -0.06 0.98 -0.02 -1.26 -4.49 135.00 132.84 1yrb n PRO 215 Ca -0.13 -0.78 -0.06 0.00 -2.02 0.00 0.00 63.50 60.51 1yrb n PRO 215 Cb 0.50 -1.30 -0.04 0.00 -0.02 0.00 0.00 33.50 32.64 1yrb n PRO 215 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1yrb h PRO 216 N 0.00 -0.17 -0.75 0.52 0.11 -1.97 -3.49 132.00 126.25 1yrb h PRO 216 Ca -0.21 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.91 1yrb h PRO 216 Cb 0.71 0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.86 1yrb h PRO 216 CO 0.13 -0.11 -0.17 0.28 -0.21 0.00 0.00 178.00 177.91 1yrb n VAL 217 N -3.89 -1.86 -3.30 3.15 0.31 -1.26 -4.95 118.33 106.53 1yrb n VAL 217 Ca -0.02 0.48 -0.38 0.00 -0.01 0.00 0.00 64.34 64.41 1yrb n VAL 217 Cb 0.15 -1.35 -0.06 0.00 -0.91 0.00 0.00 33.84 31.68 1yrb n VAL 217 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1yrb s ARG 218 N -3.90 4.16 0.20 5.55 0.52 -1.26 -5.05 118.95 119.17 1yrb s ARG 218 Ca 0.00 0.69 0.08 0.00 -0.52 0.00 0.00 55.73 55.99 1yrb s ARG 218 Cb 0.00 -3.21 -0.04 0.00 0.52 0.00 0.00 34.95 32.22 1yrb s ARG 218 CO 0.00 0.63 -0.03 0.08 0.02 0.00 0.00 175.30 176.00 1yrb s VAL 219 N -1.14 3.47 0.03 3.52 1.01 -1.26 -4.52 120.40 121.51 1yrb s VAL 219 Ca 0.29 -1.62 0.08 0.00 0.00 0.00 0.00 61.98 60.74 1yrb s VAL 219 Cb -0.19 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 1yrb s VAL 219 CO 0.19 -0.17 -0.25 -0.76 0.00 0.00 0.00 175.10 174.11 1yrb s LEU 220 N -3.07 2.14 -0.27 3.92 1.43 -0.79 -5.02 118.68 117.02 1yrb s LEU 220 Ca 0.27 -0.54 0.03 0.00 -1.03 0.00 0.00 54.13 52.87 1yrb s LEU 220 Cb -0.08 -1.21 0.06 0.00 0.03 0.00 0.00 46.19 45.00 1yrb s LEU 220 CO 0.18 0.25 -0.09 -0.31 0.23 0.00 0.00 176.35 176.60 1yrb s TYR 221 N -0.75 3.33 0.14 0.29 2.02 -1.26 -0.77 117.35 120.35 1yrb s TYR 221 Ca 0.10 -2.41 0.09 0.00 -0.37 0.00 0.00 57.07 54.48 1yrb s TYR 221 Cb -0.10 -2.06 -0.04 0.00 -0.40 0.00 0.00 41.96 39.37 1yrb s TYR 221 CO 0.01 -0.89 -0.17 -0.51 -1.57 0.00 0.00 175.55 172.42 1yrb s LEU 222 N 1.08 2.72 -0.18 -1.29 1.43 0.80 -3.82 118.68 119.42 1yrb s LEU 222 Ca -0.06 -0.60 -0.02 0.00 -1.03 0.00 0.00 54.13 52.42 1yrb s LEU 222 Cb -0.20 -1.52 0.05 0.00 0.03 0.00 0.00 46.19 44.55 1yrb s LEU 222 CO -0.05 0.16 0.01 -0.55 0.23 0.00 0.00 176.35 176.14 1yrb s SER 223 N -2.35 2.87 0.21 2.29 0.15 -0.48 -2.10 113.70 114.28 1yrb s SER 223 Ca 0.20 -0.76 0.20 0.00 0.70 0.00 0.00 55.95 56.29 1yrb s SER 223 Cb -0.10 -0.70 0.89 0.00 -1.71 0.00 0.00 66.02 64.40 1yrb s SER 223 CO 0.11 -0.27 1.61 0.00 1.20 0.00 0.00 173.24 175.90 1yrb n ALA 224 N 4.98 1.51 -0.07 5.45 0.00 -1.26 -0.54 120.51 130.59 1yrb n ALA 224 Ca -0.10 0.08 -0.21 0.00 0.00 0.00 0.00 53.44 53.21 1yrb n ALA 224 Cb 0.47 -1.32 -0.12 0.00 0.00 0.00 0.00 19.45 18.47 1yrb n ALA 224 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1yrb h LYS 225 N 0.00 0.07 -0.01 0.00 6.56 -1.94 -3.41 116.57 117.85 1yrb h LYS 225 Ca 0.00 -0.13 0.00 0.00 -1.06 0.00 0.00 60.65 59.46 1yrb h LYS 225 Cb 0.26 0.05 0.00 0.00 -0.57 0.00 0.00 32.23 31.97 1yrb h LYS 225 CO 0.00 1.06 -0.72 0.25 -2.06 0.00 0.00 179.45 177.98 1yrb n THR 226 N -4.24 0.00 -0.99 -0.16 -2.24 -1.15 -4.97 114.28 100.53 1yrb n THR 226 Ca -0.29 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 1yrb n THR 226 Cb 0.75 1.11 0.00 0.00 -2.10 0.00 0.00 70.33 70.09 1yrb n THR 226 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1yrb n ARG 227 N -0.85 -0.36 -1.68 -0.78 1.74 0.30 -5.00 116.66 110.03 1yrb n ARG 227 Ca 0.06 0.09 -0.45 0.00 -0.77 0.00 0.00 57.85 56.78 1yrb n ARG 227 Cb 0.37 -3.35 -0.03 0.00 -1.02 0.00 0.00 32.46 28.42 1yrb n ARG 227 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 1yrb n GLU 228 N -2.17 2.25 -0.40 5.56 2.13 -1.22 -1.96 120.64 124.82 1yrb n GLU 228 Ca 0.00 0.81 0.00 0.00 0.66 0.00 0.00 57.16 58.63 1yrb n GLU 228 Cb 0.09 -2.56 0.00 0.00 0.27 0.00 0.00 31.44 29.24 1yrb n GLU 228 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1yrb n GLY 229 N 3.12 1.51 0.36 8.31 0.00 -1.25 -1.38 105.19 115.86 1yrb n GLY 229 Ca 0.15 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.13 1yrb n GLY 229 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1yrb h PHE 230 N 0.00 1.24 -0.63 1.61 -1.00 -1.71 -0.67 116.94 115.79 1yrb h PHE 230 Ca 0.00 -0.04 0.00 0.00 2.81 0.00 0.00 57.97 60.74 1yrb h PHE 230 Cb 0.00 -0.39 -0.03 0.00 3.61 0.00 0.00 35.95 39.13 1yrb h PHE 230 CO 0.00 0.87 0.40 0.93 -1.61 0.00 0.00 178.31 178.89 1yrb h GLU 231 N 1.26 0.84 -0.38 1.51 3.07 -1.91 0.62 114.58 119.58 1yrb h GLU 231 Ca 0.31 -0.06 0.02 0.00 -0.50 0.00 0.00 59.36 59.13 1yrb h GLU 231 Cb 0.05 -0.18 -0.03 0.00 -0.84 0.00 0.00 28.75 27.74 1yrb h GLU 231 CO -0.05 0.58 0.21 -0.44 -1.40 0.00 0.00 179.01 177.91 1yrb h ASP 232 N 0.85 0.32 -0.59 1.42 3.32 -1.80 -0.58 116.42 119.36 1yrb h ASP 232 Ca 0.23 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.28 1yrb h ASP 232 Cb -0.06 -0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.41 1yrb h ASP 232 CO -0.05 0.23 0.34 0.25 -1.72 0.00 0.00 179.24 178.29 1yrb h LEU 233 N 0.42 0.73 -0.91 1.55 5.85 -0.69 -1.18 115.31 121.08 1yrb h LEU 233 Ca 0.16 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1yrb h LEU 233 Cb 0.04 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 40.84 1yrb h LEU 233 CO -0.09 0.60 0.50 -0.08 -0.34 0.00 0.00 178.44 179.03 1yrb h GLU 234 N 0.80 1.26 -0.19 1.25 4.81 -0.49 0.04 114.58 122.07 1yrb h GLU 234 Ca 0.21 -0.14 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1yrb h GLU 234 Cb 0.02 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.15 1yrb h GLU 234 CO -0.04 0.92 0.06 1.15 -0.73 0.00 0.00 179.01 180.37 1yrb h THR 235 N 1.27 1.18 -0.90 0.32 2.02 -0.85 -1.82 112.91 114.13 1yrb h THR 235 Ca 0.32 -0.57 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 1yrb h THR 235 Cb 0.02 1.22 -0.04 0.00 -1.74 0.00 0.00 68.15 67.60 1yrb h THR 235 CO -0.05 0.18 0.56 -0.07 0.37 0.00 0.00 175.52 176.50 1yrb h LEU 236 N 0.13 1.06 -0.59 2.58 3.38 -0.78 0.46 115.31 121.55 1yrb h LEU 236 Ca 0.06 -0.05 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1yrb h LEU 236 Cb 0.22 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1yrb h LEU 236 CO -0.00 0.80 0.09 0.00 0.09 0.00 0.00 178.44 179.42 1yrb h ALA 237 N 1.38 0.78 -0.45 1.53 0.00 -0.89 0.26 119.26 121.87 1yrb h ALA 237 Ca 0.32 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.86 1yrb h ALA 237 Cb -0.08 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1yrb h ALA 237 CO -0.06 0.53 -0.18 -0.92 0.00 0.00 0.00 179.25 178.62 1yrb h TYR 238 N 0.87 0.98 -0.57 0.00 3.20 -0.77 0.18 116.97 120.86 1yrb h TYR 238 Ca 0.18 -0.21 -0.09 0.00 3.14 0.00 0.00 58.73 61.75 1yrb h TYR 238 Cb 0.43 -0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.44 1yrb h TYR 238 CO 0.03 0.97 0.02 0.93 -1.64 0.00 0.00 178.16 178.48 1yrb h GLU 239 N 0.76 1.00 -0.67 1.82 5.08 -0.70 -0.49 114.58 121.37 1yrb h GLU 239 Ca 0.11 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.16 1yrb h GLU 239 Cb 0.71 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 1yrb h GLU 239 CO 0.05 0.98 0.39 1.25 -1.00 0.00 0.00 179.01 180.68 1yrb h HIS 240 N 0.88 0.90 -0.30 4.33 2.76 -0.78 -1.19 115.15 121.76 1yrb h HIS 240 Ca 0.16 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 58.38 1yrb h HIS 240 Cb 0.52 -0.29 -0.05 0.00 1.55 0.00 0.00 27.41 29.13 1yrb h HIS 240 CO 0.04 0.63 -0.05 -0.92 -1.30 0.00 0.00 177.93 176.32 1yrb h TYR 241 N 0.92 -0.12 -0.62 5.26 5.03 -0.49 0.00 116.97 126.95 1yrb h TYR 241 Ca 0.24 0.03 -0.08 0.00 2.58 0.00 0.00 58.73 61.50 1yrb h TYR 241 Cb 0.00 0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.36 1yrb h TYR 241 CO -0.01 -0.11 0.09 0.00 -1.32 0.00 0.00 178.16 176.81 1yrb h THR 243 N 0.95 1.06 -4.07 0.00 2.02 -0.82 -3.42 112.91 108.64 1yrb h THR 243 Ca 0.19 -0.50 -0.55 0.00 0.77 0.00 0.00 66.41 66.32 1yrb h THR 243 Cb 0.45 1.39 0.14 0.00 -1.74 0.00 0.00 68.15 68.39 1yrb h THR 243 CO 0.01 0.12 0.58 0.00 0.37 0.00 0.00 175.52 176.61 1yrb n GLY 245 N 0.77 -0.32 0.00 0.00 0.00 -1.26 -4.85 105.19 99.54 1yrb n GLY 245 Ca 0.12 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1yrb n GLY 245 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54