#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b4v s TYR 10 N 0.00 2.85 -0.02 1.61 5.04 -1.26 -0.27 117.35 125.30 1b4v s TYR 10 Ca 0.00 -0.17 0.00 0.00 -2.44 0.00 0.00 57.07 54.46 1b4v s TYR 10 Cb 0.00 -1.73 0.02 0.00 0.35 0.00 0.00 41.96 40.60 1b4v s TYR 10 CO 0.00 0.17 0.01 0.08 -1.34 0.00 0.00 175.55 174.46 1b4v s VAL 11 N -0.50 0.05 0.18 3.14 1.01 -0.64 -4.97 120.40 118.67 1b4v s VAL 11 Ca 0.07 0.09 -0.21 0.00 0.00 0.00 0.00 61.98 61.93 1b4v s VAL 11 Cb -0.12 -0.13 0.12 0.00 0.00 0.00 0.00 36.38 36.25 1b4v s VAL 11 CO 0.02 0.08 1.59 -0.65 0.00 0.00 0.00 175.10 176.14 1b4v h PRO 12 N 6.86 -0.16 -5.66 2.72 0.11 -1.86 -3.31 132.00 130.70 1b4v h PRO 12 Ca -0.38 0.01 -0.54 0.00 0.11 0.00 0.00 66.00 65.20 1b4v h PRO 12 Cb 1.15 0.04 -0.29 0.00 0.11 0.00 0.00 31.00 32.01 1b4v h PRO 12 CO 0.49 -0.11 -0.83 0.00 -0.21 0.00 0.00 178.00 177.34 1b4v s ALA 13 N -6.02 1.45 -0.06 -0.75 0.00 -0.81 -1.02 121.76 114.55 1b4v s ALA 13 Ca -0.14 -0.77 0.04 0.00 0.00 0.00 0.00 51.96 51.09 1b4v s ALA 13 Cb 0.16 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.92 1b4v s ALA 13 CO 0.69 0.35 -0.17 0.08 0.00 0.00 0.00 175.76 176.71 1b4v s VAL 14 N -0.45 1.46 -0.17 0.00 1.01 -0.58 -1.07 120.40 120.60 1b4v s VAL 14 Ca 0.06 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1b4v s VAL 14 Cb -0.07 -1.27 0.00 0.00 0.00 0.00 0.00 36.38 35.05 1b4v s VAL 14 CO -0.00 0.42 -0.16 -0.69 0.00 0.00 0.00 175.10 174.67 1b4v s VAL 15 N 0.21 2.54 -0.23 2.92 1.01 -0.02 -0.90 120.40 125.92 1b4v s VAL 15 Ca -0.08 -0.80 -0.19 0.00 0.00 0.00 0.00 61.98 60.91 1b4v s VAL 15 Cb -0.13 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 1b4v s VAL 15 CO 0.03 0.51 0.57 -0.63 0.00 0.00 0.00 175.10 175.59 1b4v s ILE 16 N 1.00 5.05 0.00 2.22 1.01 0.13 -1.15 121.20 129.45 1b4v s ILE 16 Ca -0.02 1.03 0.00 0.00 0.00 0.00 0.00 60.65 61.67 1b4v s ILE 16 Cb -0.15 -3.89 0.00 0.00 0.01 0.00 0.00 42.46 38.44 1b4v s ILE 16 CO -0.03 0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.62 1b4v n GLY 17 N 4.06 0.21 1.62 6.18 0.00 0.11 -0.05 105.19 117.32 1b4v n GLY 17 Ca -0.03 -1.78 0.03 0.00 0.00 0.00 0.00 46.02 44.24 1b4v n GLY 17 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1b4v n THR 18 N 0.37 0.59 -0.27 2.61 -2.24 -1.26 -4.56 114.28 109.51 1b4v n THR 18 Ca 0.00 -1.72 0.00 0.00 -2.27 0.00 0.00 64.05 60.06 1b4v n THR 18 Cb 0.00 0.81 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 1b4v n THR 18 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b4v n GLY 19 N 0.06 -0.09 0.24 3.38 0.00 -1.26 -2.48 105.19 105.04 1b4v n GLY 19 Ca 0.09 -1.67 -0.15 0.00 0.00 0.00 0.00 46.02 44.29 1b4v n GLY 19 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1b4v h TYR 20 N 0.00 -0.52 -0.62 1.61 -1.99 -1.90 0.90 116.97 114.45 1b4v h TYR 20 Ca 0.00 -0.01 0.01 0.00 2.00 0.00 0.00 58.73 60.73 1b4v h TYR 20 Cb 0.00 0.18 -0.03 0.00 2.00 0.00 0.00 36.73 38.88 1b4v h TYR 20 CO 0.00 -0.32 0.41 0.78 -0.00 0.00 0.00 178.16 179.03 1b4v h GLY 21 N -0.53 0.87 0.90 3.88 0.00 -1.83 -2.33 103.07 104.03 1b4v h GLY 21 Ca -0.04 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 1b4v h GLY 21 CO 0.06 0.31 0.08 0.00 0.00 0.00 0.00 176.54 176.99 1b4v h ALA 22 N 1.23 0.43 -0.44 3.60 0.00 -1.77 -2.50 119.26 119.80 1b4v h ALA 22 Ca 0.23 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1b4v h ALA 22 Cb -0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1b4v h ALA 22 CO -0.05 0.09 0.26 0.00 0.00 0.00 0.00 179.25 179.55 1b4v h ALA 23 N 0.91 0.56 -0.23 0.00 0.00 -0.67 -0.37 119.26 119.46 1b4v h ALA 23 Ca 0.10 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1b4v h ALA 23 Cb 0.30 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1b4v h ALA 23 CO 0.00 0.06 0.12 0.28 0.00 0.00 0.00 179.25 179.71 1b4v h VAL 24 N 0.58 1.12 -0.21 0.00 2.07 -1.44 -2.36 116.25 116.01 1b4v h VAL 24 Ca 0.16 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.35 1b4v h VAL 24 Cb 0.02 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1b4v h VAL 24 CO -0.03 0.12 0.13 0.77 0.02 0.00 0.00 177.57 178.58 1b4v h SER 25 N 0.25 0.24 -0.81 0.57 4.64 -1.21 -2.56 113.55 114.67 1b4v h SER 25 Ca 0.08 -0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1b4v h SER 25 Cb 0.08 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 62.07 1b4v h SER 25 CO -0.01 0.20 0.41 0.00 -0.87 0.00 0.00 176.83 176.56 1b4v h ALA 26 N 1.06 1.18 0.35 5.18 0.00 -1.03 -0.86 119.26 125.15 1b4v h ALA 26 Ca 0.08 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1b4v h ALA 26 Cb -0.01 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.46 1b4v h ALA 26 CO -0.02 0.63 -0.17 1.25 0.00 0.00 0.00 179.25 180.95 1b4v h LEU 27 N 1.16 -0.40 -1.01 0.00 5.85 -1.25 -0.69 115.31 118.97 1b4v h LEU 27 Ca 0.28 -0.03 -0.05 0.00 0.84 0.00 0.00 57.88 58.92 1b4v h LEU 27 Cb 0.09 0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1b4v h LEU 27 CO -0.04 -0.23 0.13 0.03 -0.34 0.00 0.00 178.44 178.00 1b4v h ARG 28 N -0.54 0.85 -0.43 1.25 2.47 -1.33 -0.95 114.38 115.69 1b4v h ARG 28 Ca -0.05 -0.17 -0.03 0.00 -1.26 0.00 0.00 59.98 58.47 1b4v h ARG 28 Cb 0.41 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.58 1b4v h ARG 28 CO 0.08 0.76 0.15 -0.07 0.56 0.00 0.00 179.97 181.45 1b4v h LEU 29 N 0.81 0.61 -0.75 3.04 3.38 -1.08 -1.43 115.31 119.90 1b4v h LEU 29 Ca 0.18 -0.19 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 1b4v h LEU 29 Cb 0.30 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 1b4v h LEU 29 CO -0.00 0.64 0.32 1.23 0.09 0.00 0.00 178.44 180.72 1b4v h GLY 30 N 0.55 1.18 2.00 0.83 0.00 -0.71 -0.92 103.07 106.00 1b4v h GLY 30 Ca 0.14 -0.62 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 1b4v h GLY 30 CO -0.01 0.59 -0.23 0.83 0.00 0.00 0.00 176.54 177.72 1b4v h GLU 31 N 1.07 0.00 -0.04 4.80 5.08 -0.96 -1.62 114.58 122.90 1b4v h GLU 31 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1b4v h GLU 31 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1b4v h GLU 31 CO -0.03 0.23 0.00 0.00 -1.00 0.00 0.00 179.01 178.22 1b4v n ALA 32 N -2.34 2.60 -0.81 3.43 0.00 -0.56 -4.91 120.51 117.92 1b4v n ALA 32 Ca -0.01 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1b4v n ALA 32 Cb 0.34 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1b4v n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b4v n GLY 33 N 1.02 0.56 3.57 0.00 0.00 -0.61 -5.04 105.19 104.70 1b4v n GLY 33 Ca 0.18 -0.32 -0.41 0.00 0.00 0.00 0.00 46.02 45.47 1b4v n GLY 33 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1b4v s VAL 34 N -2.00 4.96 0.01 1.61 1.01 -0.41 -5.01 120.40 120.56 1b4v s VAL 34 Ca 0.00 0.55 -0.30 0.00 0.00 0.00 0.00 61.98 62.24 1b4v s VAL 34 Cb 0.00 -4.01 -0.08 0.00 0.00 0.00 0.00 36.38 32.29 1b4v s VAL 34 CO 0.00 -0.23 1.96 -1.58 0.00 0.00 0.00 175.10 175.25 1b4v s GLN 35 N 2.55 4.07 -0.03 2.72 2.00 -1.26 -4.07 119.66 125.64 1b4v s GLN 35 Ca 0.22 2.53 0.05 0.00 -2.00 0.00 0.00 55.36 56.16 1b4v s GLN 35 Cb -0.15 -4.16 -0.01 0.00 0.80 0.00 0.00 33.01 29.49 1b4v s GLN 35 CO 0.13 -1.03 -0.20 0.99 -0.50 0.00 0.00 175.29 174.68 1b4v s THR 36 N 4.71 1.60 -0.17 -0.34 2.01 0.61 -1.93 115.64 122.13 1b4v s THR 36 Ca 0.88 -0.83 -0.00 0.00 0.31 0.00 0.00 61.69 62.04 1b4v s THR 36 Cb -0.41 -1.35 0.00 0.00 0.01 0.00 0.00 72.50 70.75 1b4v s THR 36 CO 0.40 0.45 -0.15 -0.22 -0.69 0.00 0.00 174.62 174.41 1b4v s LEU 37 N -0.21 2.44 -0.18 4.42 2.96 -0.23 -1.37 118.68 126.52 1b4v s LEU 37 Ca 0.01 -0.51 -0.09 0.00 -0.22 0.00 0.00 54.13 53.33 1b4v s LEU 37 Cb -0.10 -1.57 -0.05 0.00 0.50 0.00 0.00 46.19 44.98 1b4v s LEU 37 CO 0.01 0.05 0.12 -0.04 -1.32 0.00 0.00 176.35 175.17 1b4v s MET 38 N 1.03 3.96 -0.25 1.98 -1.94 0.25 -0.84 119.30 123.49 1b4v s MET 38 Ca -0.01 -0.22 -0.03 0.00 -1.71 0.00 0.00 55.69 53.72 1b4v s MET 38 Cb -0.15 -3.32 0.02 0.00 2.01 0.00 0.00 34.83 33.39 1b4v s MET 38 CO -0.04 0.42 -0.03 -0.51 -0.01 0.00 0.00 175.02 174.86 1b4v s LEU 39 N 0.01 3.29 -0.13 -0.03 1.43 -0.30 -1.17 118.68 121.78 1b4v s LEU 39 Ca 0.09 -0.75 0.02 0.00 -1.03 0.00 0.00 54.13 52.45 1b4v s LEU 39 Cb -0.11 -1.73 -0.00 0.00 0.03 0.00 0.00 46.19 44.38 1b4v s LEU 39 CO -0.00 -0.12 -0.18 -0.70 0.23 0.00 0.00 176.35 175.57 1b4v s GLU 40 N 1.39 3.18 0.33 1.70 2.56 -0.43 0.06 118.70 127.49 1b4v s GLU 40 Ca 0.02 -0.79 0.16 0.00 0.00 0.00 0.00 54.97 54.36 1b4v s GLU 40 Cb -0.16 -2.50 0.50 0.00 2.00 0.00 0.00 34.13 33.97 1b4v s GLU 40 CO -0.03 0.12 1.66 0.00 -0.56 0.00 0.00 175.26 176.45 1b4v h MET 41 N 6.96 0.00 0.00 4.30 -0.00 -1.75 0.16 114.93 124.60 1b4v h MET 41 Ca -0.26 0.00 -0.02 0.00 -0.00 0.00 0.00 59.70 59.42 1b4v h MET 41 Cb 1.21 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.82 1b4v h MET 41 CO 0.53 0.48 0.01 0.41 -0.00 0.00 0.00 176.91 178.34 1b4v n GLY 42 N 0.37 -0.05 3.97 -3.00 0.00 -1.26 -3.57 105.19 101.65 1b4v n GLY 42 Ca -0.00 -1.84 -0.21 0.00 0.00 0.00 0.00 46.02 43.97 1b4v n GLY 42 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b4v s GLN 43 N -2.76 3.19 -0.47 1.61 -0.21 -1.26 -1.41 119.66 118.34 1b4v s GLN 43 Ca 0.03 -0.71 -0.24 0.00 0.02 0.00 0.00 55.36 54.46 1b4v s GLN 43 Cb -0.00 -2.72 0.03 0.00 1.00 0.00 0.00 33.01 31.32 1b4v s GLN 43 CO 0.02 0.01 0.86 -1.17 -2.12 0.00 0.00 175.29 172.89 1b4v s LEU 44 N -4.30 4.15 -1.14 2.90 2.96 -1.26 -0.75 118.68 121.24 1b4v s LEU 44 Ca 0.44 -0.10 -0.20 0.00 -0.22 0.00 0.00 54.13 54.06 1b4v s LEU 44 Cb -0.10 -3.01 0.08 0.00 0.50 0.00 0.00 46.19 43.67 1b4v s LEU 44 CO 0.34 -1.02 1.53 0.26 -1.32 0.00 0.00 176.35 176.13 1b4v s TRP 45 N 3.57 2.80 0.00 5.38 0.52 -1.26 -4.50 118.94 125.45 1b4v s TRP 45 Ca 0.32 -1.35 0.00 0.00 0.02 0.00 0.00 56.10 55.09 1b4v s TRP 45 Cb -0.12 -4.64 0.00 0.00 -1.15 0.00 0.00 33.47 27.57 1b4v s TRP 45 CO 0.23 -1.78 0.48 0.27 0.02 0.00 0.00 176.95 176.17 1b4v n ASN 46 N 8.09 0.00 -4.46 2.95 2.04 -1.26 -5.05 115.26 117.57 1b4v n ASN 46 Ca 0.39 -1.10 -0.36 0.00 -0.44 0.00 0.00 54.58 53.07 1b4v n ASN 46 Cb 0.48 -0.02 -0.12 0.00 -2.53 0.00 0.00 39.78 37.59 1b4v n ASN 46 CO 0.00 0.00 0.00 -1.10 -0.44 0.00 0.00 177.26 175.72 1b4v s GLN 47 N 0.00 3.68 0.26 -3.83 -1.52 -1.26 -5.04 119.66 111.95 1b4v s GLN 47 Ca 0.00 -0.47 -0.30 0.00 -1.95 0.00 0.00 55.36 52.64 1b4v s GLN 47 Cb 0.00 -3.28 -0.11 0.00 -0.22 0.00 0.00 33.01 29.40 1b4v s GLN 47 CO 0.00 -0.12 1.58 -1.25 -0.25 0.00 0.00 175.29 175.25 1b4v s PRO 48 N 1.41 4.16 0.00 2.91 0.04 -1.26 -4.42 135.00 137.84 1b4v s PRO 48 Ca 0.05 2.51 0.00 0.00 0.04 0.00 0.00 61.00 63.60 1b4v s PRO 48 Cb -0.15 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.33 1b4v s PRO 48 CO 0.03 -0.61 0.00 0.41 0.04 0.00 0.00 177.00 176.88 1b4v n GLY 49 N 2.59 -0.21 0.29 0.56 0.00 0.17 -4.83 105.19 103.75 1b4v n GLY 49 Ca 0.10 -1.73 0.14 0.00 0.00 0.00 0.00 46.02 44.52 1b4v n GLY 49 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1b4v h PRO 50 N 0.00 0.00 -0.41 1.61 0.11 -1.95 -1.40 132.00 129.96 1b4v h PRO 50 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1b4v h PRO 50 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1b4v h PRO 50 CO 0.00 0.01 0.00 -0.40 -0.21 0.00 0.00 178.00 177.40 1b4v n ASP 51 N -3.93 3.23 0.00 -2.05 5.68 -1.26 -4.94 116.55 113.28 1b4v n ASP 51 Ca -0.03 -1.96 0.00 0.00 -0.50 0.00 0.00 54.79 52.30 1b4v n ASP 51 Cb 0.09 -0.26 0.00 0.00 -1.14 0.00 0.00 41.12 39.81 1b4v n ASP 51 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1b4v n GLY 52 N 1.47 1.61 3.77 6.12 0.00 -0.53 -5.03 105.19 112.60 1b4v n GLY 52 Ca 0.19 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 1b4v n GLY 52 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1b4v s ASN 53 N -3.27 5.33 -0.00 1.61 0.01 -1.26 -4.57 114.94 112.79 1b4v s ASN 53 Ca 0.00 -0.21 -0.23 0.00 -0.71 0.00 0.00 52.86 51.71 1b4v s ASN 53 Cb 0.00 -1.33 -0.18 0.00 0.41 0.00 0.00 41.25 40.15 1b4v s ASN 53 CO 0.00 0.06 1.24 0.40 -1.51 0.00 0.00 177.10 177.29 1b4v h ILE 54 N 2.09 1.41 -3.16 0.60 2.04 -1.91 0.48 117.51 119.05 1b4v h ILE 54 Ca -0.47 -1.42 -0.63 0.00 1.00 0.00 0.00 64.86 63.34 1b4v h ILE 54 Cb 1.21 2.18 -0.11 0.00 -0.74 0.00 0.00 36.82 39.36 1b4v h ILE 54 CO 0.62 0.40 -0.66 -0.36 0.00 0.00 0.00 178.15 178.15 1b4v s PHE 55 N -3.99 2.95 0.21 1.37 0.08 -1.26 -4.56 117.98 112.78 1b4v s PHE 55 Ca -0.15 -0.06 -0.11 0.00 0.12 0.00 0.00 56.93 56.72 1b4v s PHE 55 Cb 0.03 -1.48 -0.07 0.00 -0.57 0.00 0.00 43.02 40.92 1b4v s PHE 55 CO 0.73 0.49 0.56 0.00 -0.10 0.00 0.00 175.22 176.90 1b4v s GLY 57 N -2.19 1.75 0.50 0.00 0.00 -1.26 -4.59 107.32 101.52 1b4v s GLY 57 Ca 0.45 -1.20 0.29 0.00 0.00 0.00 0.00 44.72 44.26 1b4v s GLY 57 CO 0.20 -0.53 1.81 -0.33 0.00 0.00 0.00 173.10 174.26 1b4v h MET 58 N -1.29 0.00 -0.00 2.90 2.86 -1.33 -3.02 114.93 115.04 1b4v h MET 58 Ca -0.43 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.21 1b4v h MET 58 Cb 1.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.92 1b4v h MET 58 CO 0.44 0.00 -0.58 1.28 1.06 0.00 0.00 176.91 179.11 1b4v n LEU 59 N -3.10 1.01 -2.83 1.22 7.99 -1.26 -4.39 117.00 115.65 1b4v n LEU 59 Ca 0.02 -0.32 -0.15 0.00 -0.01 0.00 0.00 56.01 55.55 1b4v n LEU 59 Cb 0.41 -0.11 0.00 0.00 -0.11 0.00 0.00 43.42 43.61 1b4v n LEU 59 CO 0.30 0.22 -0.10 -0.46 -1.51 0.00 0.00 177.39 175.84 1b4v n ASN 60 N -1.06 1.80 -4.77 -1.43 2.04 -1.15 -4.89 115.26 105.80 1b4v n ASN 60 Ca 0.07 -2.98 -0.39 0.00 -0.44 0.00 0.00 54.58 50.84 1b4v n ASN 60 Cb 0.36 -0.55 -0.01 0.00 -2.53 0.00 0.00 39.78 37.05 1b4v n ASN 60 CO 0.00 0.00 0.00 -2.16 -0.44 0.00 0.00 177.26 174.66 1b4v s PRO 61 N -2.97 4.05 0.00 -0.53 0.04 -1.16 -4.31 135.00 130.13 1b4v s PRO 61 Ca 0.35 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.50 1b4v s PRO 61 Cb 0.41 -2.80 0.00 0.00 0.04 0.00 0.00 34.50 32.15 1b4v s PRO 61 CO -0.03 -0.41 0.00 -0.40 0.04 0.00 0.00 177.00 176.20 1b4v n ASP 62 N 0.24 0.04 0.18 6.66 5.68 -1.26 -4.79 116.55 123.30 1b4v n ASP 62 Ca 0.03 -0.29 0.17 0.00 -0.50 0.00 0.00 54.79 54.20 1b4v n ASP 62 Cb 0.44 0.00 0.81 0.00 -1.14 0.00 0.00 41.12 41.22 1b4v n ASP 62 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1b4v h LYS 63 N 0.00 0.00 0.00 0.11 2.10 -1.94 -1.06 116.57 115.79 1b4v h LYS 63 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1b4v h LYS 63 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1b4v h LYS 63 CO 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 179.45 177.45 1b4v h ARG 64 N 0.00 0.00 0.00 0.07 3.08 -1.94 -2.94 114.38 112.64 1b4v h ARG 64 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 1b4v h ARG 64 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.62 1b4v h ARG 64 CO -0.00 0.00 -0.13 0.66 -1.07 0.00 0.00 179.97 179.43 1b4v h SER 65 N 0.00 0.00 -4.15 7.04 4.64 -1.54 -1.35 113.55 118.19 1b4v h SER 65 Ca 0.00 -0.03 -0.34 0.00 -0.47 0.00 0.00 61.79 60.95 1b4v h SER 65 Cb 0.36 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 62.18 1b4v h SER 65 CO 0.00 0.01 -0.76 -0.55 -0.87 0.00 0.00 176.83 174.66 1b4v s SER 66 N -4.94 0.87 -0.63 4.97 0.15 -1.11 -3.20 113.70 109.82 1b4v s SER 66 Ca 0.09 -0.24 -0.23 0.00 0.70 0.00 0.00 55.95 56.27 1b4v s SER 66 Cb 0.11 -0.06 0.06 0.00 -1.71 0.00 0.00 66.02 64.41 1b4v s SER 66 CO 0.64 0.02 0.97 0.86 1.20 0.00 0.00 173.24 176.93 1b4v s TRP 67 N -0.46 2.69 -1.18 3.44 -0.11 -0.53 -1.56 118.94 121.23 1b4v s TRP 67 Ca -0.00 -0.34 -0.22 0.00 1.22 0.00 0.00 56.10 56.75 1b4v s TRP 67 Cb -0.05 -4.23 0.00 0.00 -1.50 0.00 0.00 33.47 27.70 1b4v s TRP 67 CO 0.00 -1.57 0.74 1.19 -4.62 0.00 0.00 176.95 172.69 1b4v n PHE 68 N 7.72 -1.78 -4.38 5.86 3.01 0.12 -4.84 117.46 123.17 1b4v n PHE 68 Ca -0.02 0.39 -0.23 0.00 1.01 0.00 0.00 57.45 58.61 1b4v n PHE 68 Cb 0.46 -3.32 -0.11 0.00 -0.01 0.00 0.00 39.48 36.50 1b4v n PHE 68 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1b4v s LYS 69 N -6.34 1.42 0.00 -1.08 -0.14 -1.26 -4.86 119.74 107.49 1b4v s LYS 69 Ca 0.44 -1.54 0.24 0.00 -1.36 0.00 0.00 55.97 53.75 1b4v s LYS 69 Cb -0.18 -1.50 0.45 0.00 -1.68 0.00 0.00 37.83 34.92 1b4v s LYS 69 CO 0.89 0.30 1.41 0.27 -0.76 0.00 0.00 175.35 177.45 1b4v n ASN 70 N -0.01 2.90 -3.65 2.83 0.23 -1.26 -3.56 115.26 112.74 1b4v n ASN 70 Ca -0.10 -1.92 -0.14 0.00 -0.53 0.00 0.00 54.58 51.89 1b4v n ASN 70 Cb 0.58 -0.13 -0.08 0.00 -2.08 0.00 0.00 39.78 38.07 1b4v n ASN 70 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1b4v s ARG 71 N -1.75 0.75 0.81 -3.83 3.52 -1.26 -0.85 118.95 116.35 1b4v s ARG 71 Ca 0.34 0.79 -0.11 0.00 -0.13 0.00 0.00 55.73 56.62 1b4v s ARG 71 Cb 0.21 0.36 0.08 0.00 -1.56 0.00 0.00 34.95 34.04 1b4v s ARG 71 CO 0.31 -0.11 1.09 0.95 -0.81 0.00 0.00 175.30 176.73 1b4v s THR 72 N 0.16 3.13 0.07 4.11 -4.23 -0.49 -4.89 115.64 113.49 1b4v s THR 72 Ca -0.01 0.37 0.05 0.00 -1.18 0.00 0.00 61.69 60.91 1b4v s THR 72 Cb -0.04 -2.87 -0.03 0.00 1.34 0.00 0.00 72.50 70.90 1b4v s THR 72 CO 0.02 -0.48 -0.14 -1.61 -0.54 0.00 0.00 174.62 171.87 1b4v s GLU 73 N -4.93 0.81 0.27 3.99 2.02 -1.26 -4.65 118.70 114.94 1b4v s GLU 73 Ca 0.62 -0.94 -0.28 0.00 0.02 0.00 0.00 54.97 54.39 1b4v s GLU 73 Cb -0.17 -0.80 -0.09 0.00 0.10 0.00 0.00 34.13 33.16 1b4v s GLU 73 CO 0.56 0.18 0.92 0.00 0.02 0.00 0.00 175.26 176.94 1b4v s ALA 74 N -1.28 3.30 0.29 5.21 0.00 -1.26 -4.99 121.76 123.03 1b4v s ALA 74 Ca -0.02 0.54 -0.30 0.00 0.00 0.00 0.00 51.96 52.18 1b4v s ALA 74 Cb -0.10 -3.16 -0.13 0.00 0.00 0.00 0.00 23.12 19.73 1b4v s ALA 74 CO 0.02 0.21 1.43 -2.30 0.00 0.00 0.00 175.76 175.11 1b4v n PRO 75 N 1.08 2.26 -1.65 0.00 -0.02 -1.26 -4.79 135.00 130.62 1b4v n PRO 75 Ca -0.01 0.80 -0.52 0.00 -2.02 0.00 0.00 63.50 61.75 1b4v n PRO 75 Cb 0.49 -2.47 -0.06 0.00 -0.02 0.00 0.00 33.50 31.44 1b4v n PRO 75 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1b4v n LEU 76 N 1.68 2.36 0.00 2.45 7.94 -1.26 -0.98 117.00 129.20 1b4v n LEU 76 Ca 0.08 1.08 0.00 0.00 -1.11 0.00 0.00 56.01 56.06 1b4v n LEU 76 Cb 0.34 -1.24 0.00 0.00 0.53 0.00 0.00 43.42 43.05 1b4v n LEU 76 CO 0.63 -0.60 0.00 0.61 -1.11 0.00 0.00 177.39 176.92 1b4v n GLY 77 N 3.43 1.94 0.28 -3.96 0.00 -1.26 -4.93 105.19 100.69 1b4v n GLY 77 Ca 0.21 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.29 1b4v n GLY 77 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1b4v n SER 78 N 0.00 2.61 -0.33 1.61 7.64 -0.15 -4.75 113.62 120.25 1b4v n SER 78 Ca 0.00 -2.61 0.07 0.00 1.01 0.00 0.00 58.87 57.34 1b4v n SER 78 Cb 0.00 -0.30 0.22 0.00 -1.01 0.00 0.00 64.21 63.13 1b4v n SER 78 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1b4v h PHE 79 N 0.60 0.98 -0.06 1.43 3.57 -1.76 0.25 116.94 121.95 1b4v h PHE 79 Ca 0.00 0.03 0.02 0.00 3.53 0.00 0.00 57.97 61.55 1b4v h PHE 79 Cb 0.90 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 39.34 1b4v h PHE 79 CO 0.12 0.34 0.05 -0.07 -2.23 0.00 0.00 178.31 176.53 1b4v h LEU 80 N 0.84 0.00 0.00 0.59 3.38 -1.85 -1.93 115.31 116.34 1b4v h LEU 80 Ca 0.47 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.29 1b4v h LEU 80 Cb 0.53 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 1b4v h LEU 80 CO -0.29 0.00 -1.61 0.79 0.09 0.00 0.00 178.44 177.41 1b4v n TRP 81 N -4.11 0.00 0.99 1.13 8.01 -0.67 -4.72 117.44 118.06 1b4v n TRP 81 Ca -0.02 0.00 0.11 0.00 -1.31 0.00 0.00 57.50 56.29 1b4v n TRP 81 Cb 0.15 -0.43 0.04 0.00 -2.01 0.00 0.00 31.31 29.07 1b4v n TRP 81 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 1b4v n LEU 82 N -2.28 2.45 0.21 -0.99 4.32 0.80 -4.32 117.00 117.20 1b4v n LEU 82 Ca -0.13 -0.87 0.05 0.00 -0.02 0.00 0.00 56.01 55.04 1b4v n LEU 82 Cb 0.73 0.00 0.45 0.00 -1.62 0.00 0.00 43.42 42.99 1b4v n LEU 82 CO 0.20 0.43 0.80 -0.78 -1.22 0.00 0.00 177.39 176.82 1b4v h ASP 83 N 3.42 0.00 -0.08 -1.43 3.58 -1.53 -2.58 116.42 117.80 1b4v h ASP 83 Ca 0.00 0.00 0.02 0.00 0.42 0.00 0.00 57.03 57.47 1b4v h ASP 83 Cb 0.86 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.90 1b4v h ASP 83 CO 0.00 0.29 0.06 1.62 -2.88 0.00 0.00 179.24 178.33 1b4v h VAL 84 N 0.00 0.83 -0.02 2.25 3.04 -1.83 -1.17 116.25 119.36 1b4v h VAL 84 Ca -0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 1b4v h VAL 84 Cb 0.57 0.95 0.00 0.00 -2.01 0.00 0.00 31.29 30.80 1b4v h VAL 84 CO 0.04 0.00 -0.08 1.33 -1.01 0.00 0.00 177.57 177.85 1b4v n VAL 85 N -4.33 0.00 -2.19 1.51 0.24 -0.97 -4.94 118.33 107.64 1b4v n VAL 85 Ca -0.01 -0.27 -0.38 0.00 -2.04 0.00 0.00 64.34 61.64 1b4v n VAL 85 Cb 0.17 0.71 -0.01 0.00 -1.47 0.00 0.00 33.84 33.25 1b4v n VAL 85 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1b4v s ASN 86 N -2.12 6.14 0.06 -1.34 0.02 -0.44 -4.64 114.94 112.62 1b4v s ASN 86 Ca 0.32 2.39 -0.08 0.00 -1.02 0.00 0.00 52.86 54.48 1b4v s ASN 86 Cb 0.20 -2.61 -0.00 0.00 0.02 0.00 0.00 41.25 38.86 1b4v s ASN 86 CO 0.38 -0.94 0.16 -0.13 0.02 0.00 0.00 177.10 176.58 1b4v s ARG 87 N -2.61 0.74 0.37 -0.60 1.81 -1.26 -4.98 118.95 112.42 1b4v s ARG 87 Ca 0.63 -0.85 -0.26 0.00 -1.72 0.00 0.00 55.73 53.53 1b4v s ARG 87 Cb -0.31 0.30 -0.09 0.00 -0.45 0.00 0.00 34.95 34.40 1b4v s ARG 87 CO 0.38 -0.22 1.11 -0.80 -0.68 0.00 0.00 175.30 175.09 1b4v s ASN 88 N -2.53 6.79 0.07 0.23 0.01 -1.26 -1.39 114.94 116.85 1b4v s ASN 88 Ca 0.01 2.21 -0.01 0.00 -0.71 0.00 0.00 52.86 54.36 1b4v s ASN 88 Cb 0.03 -2.61 -0.04 0.00 0.41 0.00 0.00 41.25 39.04 1b4v s ASN 88 CO -0.08 -0.48 -0.00 0.27 -1.51 0.00 0.00 177.10 175.30 1b4v s ILE 89 N -1.45 0.19 0.16 0.60 -4.36 -0.03 -4.89 121.20 111.43 1b4v s ILE 89 Ca 0.54 -1.81 -0.30 0.00 -0.26 0.00 0.00 60.65 58.82 1b4v s ILE 89 Cb -0.28 -1.63 -0.07 0.00 1.25 0.00 0.00 42.46 41.73 1b4v s ILE 89 CO 0.35 -0.87 0.95 -1.81 0.24 0.00 0.00 174.94 173.81 1b4v s ASP 90 N -2.95 7.56 0.09 4.36 1.01 -1.26 -4.29 116.67 121.19 1b4v s ASP 90 Ca 0.11 1.86 -0.34 0.00 0.71 0.00 0.00 52.55 54.89 1b4v s ASP 90 Cb 0.08 -2.60 -0.13 0.00 1.01 0.00 0.00 42.92 41.28 1b4v s ASP 90 CO -0.07 0.02 1.70 -2.65 0.21 0.00 0.00 175.17 174.38 1b4v n PRO 91 N 2.27 2.27 -3.94 8.23 -0.02 -1.23 -4.76 135.00 137.82 1b4v n PRO 91 Ca 0.01 0.82 -0.09 0.00 -2.02 0.00 0.00 63.50 62.22 1b4v n PRO 91 Cb 0.48 -2.63 -0.08 0.00 -0.02 0.00 0.00 33.50 31.25 1b4v n PRO 91 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1b4v s TYR 92 N 2.04 0.33 -1.12 6.00 5.04 -1.26 -4.77 117.35 123.62 1b4v s TYR 92 Ca 0.83 -0.74 -0.07 0.00 -2.44 0.00 0.00 57.07 54.64 1b4v s TYR 92 Cb -0.65 -0.13 -0.09 0.00 0.35 0.00 0.00 41.96 41.44 1b4v s TYR 92 CO 0.41 -0.58 2.61 0.00 -1.34 0.00 0.00 175.55 176.66 1b4v n ALA 93 N -0.10 6.08 -0.75 3.97 0.00 -0.53 0.11 120.51 129.29 1b4v n ALA 93 Ca -0.12 -2.61 -0.30 0.00 0.00 0.00 0.00 53.44 50.42 1b4v n ALA 93 Cb 0.63 -3.08 0.25 0.00 0.00 0.00 0.00 19.45 17.25 1b4v n ALA 93 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1b4v s GLY 94 N 2.69 1.51 0.08 0.00 0.00 -0.60 -4.67 107.32 106.33 1b4v s GLY 94 Ca 0.55 -0.69 0.12 0.00 0.00 0.00 0.00 44.72 44.70 1b4v s GLY 94 CO -0.04 0.18 1.01 -0.24 0.00 0.00 0.00 173.10 174.01 1b4v h VAL 95 N -2.81 1.05 -3.34 1.40 3.04 -1.44 -3.36 116.25 110.79 1b4v h VAL 95 Ca -0.49 -2.71 -0.65 0.00 -1.01 0.00 0.00 66.70 61.84 1b4v h VAL 95 Cb 1.32 2.48 -0.26 0.00 -2.01 0.00 0.00 31.29 32.82 1b4v h VAL 95 CO 0.38 0.60 -0.73 -0.22 -1.01 0.00 0.00 177.57 176.59 1b4v s LEU 96 N -6.28 2.90 -0.21 3.16 2.96 -1.19 -1.05 118.68 118.97 1b4v s LEU 96 Ca -0.01 -0.30 -0.01 0.00 -0.22 0.00 0.00 54.13 53.59 1b4v s LEU 96 Cb 0.09 -1.69 0.01 0.00 0.50 0.00 0.00 46.19 45.10 1b4v s LEU 96 CO 0.81 0.11 -0.11 -0.62 -1.32 0.00 0.00 176.35 175.22 1b4v s ASP 97 N 0.69 3.82 -0.51 3.68 2.15 0.71 -1.46 116.67 125.76 1b4v s ASP 97 Ca -0.04 -0.60 -0.18 0.00 0.43 0.00 0.00 52.55 52.15 1b4v s ASP 97 Cb -0.15 -1.62 0.06 0.00 -0.30 0.00 0.00 42.92 40.92 1b4v s ASP 97 CO 0.02 -0.03 0.59 -0.60 -0.17 0.00 0.00 175.17 174.98 1b4v s ARG 98 N 1.37 3.09 -0.35 4.34 3.52 -1.26 -0.78 118.95 128.88 1b4v s ARG 98 Ca 0.04 -0.99 -0.21 0.00 -0.13 0.00 0.00 55.73 54.44 1b4v s ARG 98 Cb -0.14 -4.11 0.00 0.00 -1.56 0.00 0.00 34.95 29.14 1b4v s ARG 98 CO -0.08 -1.21 0.68 0.08 -0.81 0.00 0.00 175.30 173.96 1b4v s VAL 99 N 2.46 4.86 -0.34 7.11 1.01 0.67 -4.92 120.40 131.24 1b4v s VAL 99 Ca 0.13 0.71 -0.18 0.00 0.00 0.00 0.00 61.98 62.64 1b4v s VAL 99 Cb -0.20 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 32.07 1b4v s VAL 99 CO 0.11 -0.32 0.51 0.20 0.00 0.00 0.00 175.10 175.60 1b4v s ASN 100 N 1.78 6.32 0.55 3.32 0.01 -1.26 -0.78 114.94 124.87 1b4v s ASN 100 Ca 0.26 0.01 0.08 0.00 -0.71 0.00 0.00 52.86 52.50 1b4v s ASN 100 Cb -0.14 -2.27 0.06 0.00 0.41 0.00 0.00 41.25 39.31 1b4v s ASN 100 CO 0.15 -0.46 0.62 -0.31 -1.51 0.00 0.00 177.10 175.58 1b4v s TYR 101 N 2.38 1.64 0.18 2.20 1.51 0.53 -5.02 117.35 120.77 1b4v s TYR 101 Ca 0.19 -0.74 -0.22 0.00 -1.01 0.00 0.00 57.07 55.29 1b4v s TYR 101 Cb -0.15 -2.11 0.10 0.00 -0.11 0.00 0.00 41.96 39.69 1b4v s TYR 101 CO 0.13 -0.81 1.57 0.22 -1.11 0.00 0.00 175.55 175.55 1b4v h ASP 102 N 0.46 -1.33 -0.13 2.29 3.58 -1.89 -3.25 116.42 116.14 1b4v h ASP 102 Ca -0.33 0.24 -0.18 0.00 0.42 0.00 0.00 57.03 57.18 1b4v h ASP 102 Cb 1.29 0.64 -0.33 0.00 1.72 0.00 0.00 39.33 42.65 1b4v h ASP 102 CO 0.48 -0.31 -0.95 0.00 -2.88 0.00 0.00 179.24 175.57 1b4v n GLN 103 N -5.43 0.85 -3.66 0.28 6.02 -1.26 -5.05 117.38 109.14 1b4v n GLN 103 Ca 0.04 -2.67 -0.11 0.00 -0.01 0.00 0.00 57.00 54.25 1b4v n GLN 103 Cb 0.36 -0.75 -0.08 0.00 1.02 0.00 0.00 30.24 30.79 1b4v n GLN 103 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1b4v s MET 104 N -1.55 0.67 -0.26 -1.09 1.75 -1.23 -4.33 119.30 113.26 1b4v s MET 104 Ca 0.34 0.98 -0.02 0.00 -1.25 0.00 0.00 55.69 55.75 1b4v s MET 104 Cb 0.37 0.22 0.03 0.00 2.84 0.00 0.00 34.83 38.30 1b4v s MET 104 CO -0.11 -0.12 -0.05 -1.12 -0.65 0.00 0.00 175.02 172.97 1b4v s SER 105 N 0.94 4.41 -0.23 1.11 0.01 -0.22 -0.35 113.70 119.38 1b4v s SER 105 Ca -0.05 -0.94 -0.09 0.00 1.31 0.00 0.00 55.95 56.18 1b4v s SER 105 Cb -0.05 -1.67 -0.04 0.00 0.21 0.00 0.00 66.02 64.46 1b4v s SER 105 CO -0.08 -0.15 0.12 -0.69 0.41 0.00 0.00 173.24 172.85 1b4v s VAL 106 N 1.31 5.00 -0.17 3.43 1.01 0.04 -0.71 120.40 130.31 1b4v s VAL 106 Ca -0.01 0.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.87 1b4v s VAL 106 Cb -0.17 -3.32 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 1b4v s VAL 106 CO -0.04 0.36 0.38 -0.31 0.00 0.00 0.00 175.10 175.49 1b4v s TYR 107 N 1.09 3.43 0.03 5.22 1.51 0.28 -0.24 117.35 128.67 1b4v s TYR 107 Ca 0.06 0.67 -0.01 0.00 -1.01 0.00 0.00 57.07 56.78 1b4v s TYR 107 Cb -0.14 -2.47 -0.02 0.00 -0.11 0.00 0.00 41.96 39.22 1b4v s TYR 107 CO 0.04 0.11 -0.01 0.14 -1.11 0.00 0.00 175.55 174.72 1b4v s VAL 108 N 0.88 0.13 0.36 0.71 -7.23 0.04 -4.64 120.40 110.65 1b4v s VAL 108 Ca 0.20 -1.07 -0.18 0.00 -1.81 0.00 0.00 61.98 59.12 1b4v s VAL 108 Cb -0.14 -0.55 -0.10 0.00 0.56 0.00 0.00 36.38 36.15 1b4v s VAL 108 CO 0.07 -0.59 0.83 -0.83 -0.31 0.00 0.00 175.10 174.27 1b4v s GLY 109 N -1.77 2.38 -0.20 2.32 0.00 -1.26 -0.21 107.32 108.57 1b4v s GLY 109 Ca -0.11 0.20 -0.01 0.00 0.00 0.00 0.00 44.72 44.80 1b4v s GLY 109 CO -0.03 0.45 -0.01 0.50 0.00 0.00 0.00 173.10 174.01 1b4v s ARG 110 N -3.01 1.13 0.00 2.90 1.81 -0.22 -4.42 118.95 117.15 1b4v s ARG 110 Ca 0.57 -0.63 0.00 0.00 -1.72 0.00 0.00 55.73 53.95 1b4v s ARG 110 Cb -0.10 -2.24 0.00 0.00 -0.45 0.00 0.00 34.95 32.16 1b4v s ARG 110 CO 0.16 -0.58 0.00 0.41 -0.68 0.00 0.00 175.30 174.61 1b4v n GLY 111 N 4.89 1.04 3.58 -3.53 0.00 -1.26 -4.37 105.19 105.54 1b4v n GLY 111 Ca -0.10 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 43.97 1b4v n GLY 111 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1b4v s VAL 112 N -1.72 3.42 0.00 1.61 1.01 0.07 -0.86 120.40 123.94 1b4v s VAL 112 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 61.98 62.35 1b4v s VAL 112 Cb 0.00 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.65 1b4v s VAL 112 CO 0.00 -0.57 0.00 0.61 0.00 0.00 0.00 175.10 175.14 1b4v n GLY 113 N 5.54 1.43 7.00 4.51 0.00 -1.04 -4.53 105.19 118.11 1b4v n GLY 113 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1b4v n GLY 113 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b4v n GLY 114 N 0.00 3.00 0.33 -0.02 0.00 -0.04 -1.87 105.19 106.59 1b4v n GLY 114 Ca 0.00 -0.16 0.21 0.00 0.00 0.00 0.00 46.02 46.07 1b4v n GLY 114 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1b4v h GLY 115 N 0.00 0.00 2.00 -0.02 0.00 -1.90 -2.18 103.07 100.97 1b4v h GLY 115 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1b4v h GLY 115 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 176.54 178.02 1b4v h SER 116 N 0.00 0.00 0.21 0.19 4.64 -1.76 0.06 113.55 116.88 1b4v h SER 116 Ca -0.00 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.09 1b4v h SER 116 Cb 0.10 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1b4v h SER 116 CO 0.00 0.00 -0.91 -0.07 -0.87 0.00 0.00 176.83 174.98 1b4v h LEU 117 N 0.00 0.64 -0.53 5.97 3.38 -1.53 -3.37 115.31 119.88 1b4v h LEU 117 Ca 0.00 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.48 1b4v h LEU 117 Cb 0.20 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1b4v h LEU 117 CO 0.00 1.28 -0.40 1.33 0.09 0.00 0.00 178.44 180.73 1b4v n VAL 118 N -3.80 0.00 -1.71 1.22 0.24 -0.90 -3.68 118.33 109.70 1b4v n VAL 118 Ca -0.07 -0.30 -0.30 0.00 -2.04 0.00 0.00 64.34 61.64 1b4v n VAL 118 Cb 0.81 1.10 0.09 0.00 -1.47 0.00 0.00 33.84 34.37 1b4v n VAL 118 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1b4v s ASN 119 N -1.88 4.57 0.00 -1.34 6.03 -0.04 -3.98 114.94 118.30 1b4v s ASN 119 Ca 0.09 1.09 0.23 0.00 -1.03 0.00 0.00 52.86 53.24 1b4v s ASN 119 Cb 0.11 -1.76 1.37 0.00 -3.03 0.00 0.00 41.25 37.93 1b4v s ASN 119 CO 0.41 -1.89 1.77 0.61 -2.03 0.00 0.00 177.10 175.97 1b4v n GLY 120 N -2.61 -0.81 2.93 0.45 0.00 -1.26 -4.85 105.19 99.04 1b4v n GLY 120 Ca 0.07 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1b4v n GLY 120 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b4v n GLY 121 N 0.59 0.39 3.61 -0.02 0.00 -1.26 -4.58 105.19 103.92 1b4v n GLY 121 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1b4v n GLY 121 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1b4v s MET 122 N -0.71 3.39 -0.48 1.61 -1.94 -1.26 -1.37 119.30 118.53 1b4v s MET 122 Ca 0.00 1.61 -0.12 0.00 -1.71 0.00 0.00 55.69 55.47 1b4v s MET 122 Cb 0.00 -4.21 0.11 0.00 2.01 0.00 0.00 34.83 32.75 1b4v s MET 122 CO 0.00 -1.80 0.38 0.00 -0.01 0.00 0.00 175.02 173.59 1b4v s ALA 123 N 6.84 3.46 -0.04 3.03 0.00 -0.54 -4.76 121.76 129.74 1b4v s ALA 123 Ca 0.83 -2.44 0.03 0.00 0.00 0.00 0.00 51.96 50.38 1b4v s ALA 123 Cb -0.25 -2.94 0.00 0.00 0.00 0.00 0.00 23.12 19.93 1b4v s ALA 123 CO 0.34 -1.88 -0.13 0.08 0.00 0.00 0.00 175.76 174.17 1b4v s VAL 124 N 1.46 1.11 0.09 0.00 1.01 -1.26 -4.04 120.40 118.77 1b4v s VAL 124 Ca 0.04 -0.51 -0.24 0.00 0.00 0.00 0.00 61.98 61.27 1b4v s VAL 124 Cb -0.27 -0.98 -0.07 0.00 0.00 0.00 0.00 36.38 35.07 1b4v s VAL 124 CO 0.01 0.34 0.74 -1.61 0.00 0.00 0.00 175.10 174.58 1b4v s GLU 125 N 0.29 4.48 0.72 2.72 2.02 -1.26 -4.53 118.70 123.14 1b4v s GLU 125 Ca -0.07 1.05 -0.12 0.00 0.02 0.00 0.00 54.97 55.85 1b4v s GLU 125 Cb -0.12 -3.31 0.03 0.00 0.10 0.00 0.00 34.13 30.83 1b4v s GLU 125 CO 0.02 0.45 1.09 -1.25 0.02 0.00 0.00 175.26 175.59 1b4v s PRO 126 N -0.63 2.57 0.15 0.39 0.04 -1.26 -4.95 135.00 131.31 1b4v s PRO 126 Ca 0.36 1.19 -0.31 0.00 0.04 0.00 0.00 61.00 62.28 1b4v s PRO 126 Cb -0.21 -1.93 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 1b4v s PRO 126 CO 0.23 -1.40 1.55 0.21 0.04 0.00 0.00 177.00 177.63 1b4v s LYS 127 N -4.67 4.23 0.21 4.56 2.20 -1.26 -4.88 119.74 120.13 1b4v s LYS 127 Ca 0.62 2.32 -0.10 0.00 -0.36 0.00 0.00 55.97 58.45 1b4v s LYS 127 Cb -0.17 -3.19 0.29 0.00 -1.51 0.00 0.00 37.83 33.24 1b4v s LYS 127 CO 0.51 -0.59 1.73 -0.09 -0.36 0.00 0.00 175.35 176.55 1b4v h ARG 128 N 6.89 0.34 -0.39 4.03 2.43 -1.99 -0.34 114.38 125.34 1b4v h ARG 128 Ca -0.42 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 58.74 1b4v h ARG 128 Cb 1.20 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.66 1b4v h ARG 128 CO 0.91 0.23 0.26 0.66 -1.51 0.00 0.00 179.97 180.51 1b4v h SER 129 N 0.35 0.41 -0.02 -3.80 4.64 -1.99 -0.76 113.55 112.38 1b4v h SER 129 Ca 0.31 -0.01 -0.22 0.00 -0.47 0.00 0.00 61.79 61.40 1b4v h SER 129 Cb 0.41 -0.10 0.02 0.00 -0.31 0.00 0.00 62.40 62.42 1b4v h SER 129 CO -0.34 0.29 -0.86 0.22 -0.87 0.00 0.00 176.83 175.28 1b4v h TYR 130 N 0.49 0.91 -0.65 4.77 3.20 -1.58 -2.72 116.97 121.38 1b4v h TYR 130 Ca 0.15 -0.48 0.04 0.00 3.14 0.00 0.00 58.73 61.59 1b4v h TYR 130 Cb 0.01 -0.11 -0.05 0.00 1.54 0.00 0.00 36.73 38.12 1b4v h TYR 130 CO -0.00 1.31 0.38 0.35 -1.64 0.00 0.00 178.16 178.56 1b4v h PHE 131 N 0.25 0.70 0.00 -3.82 3.57 -0.47 -0.61 116.94 116.56 1b4v h PHE 131 Ca -0.10 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.38 1b4v h PHE 131 Cb 1.53 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 40.04 1b4v h PHE 131 CO 0.11 0.36 -0.19 0.93 -2.23 0.00 0.00 178.31 177.30 1b4v h GLU 132 N 0.72 0.00 -0.06 1.11 5.08 -1.18 -0.85 114.58 119.40 1b4v h GLU 132 Ca 0.28 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.52 1b4v h GLU 132 Cb 0.11 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.37 1b4v h GLU 132 CO -0.15 0.19 -0.40 1.49 -1.00 0.00 0.00 179.01 179.14 1b4v h GLU 133 N 0.00 0.39 0.00 2.33 4.81 -0.89 -3.12 114.58 118.09 1b4v h GLU 133 Ca -0.00 -0.33 -0.17 0.00 -0.13 0.00 0.00 59.36 58.73 1b4v h GLU 133 Cb 0.35 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.78 1b4v h GLU 133 CO 0.03 0.98 -0.81 -0.84 -0.73 0.00 0.00 179.01 177.63 1b4v h ILE 134 N -0.10 1.47 -2.10 2.32 3.07 -0.95 -3.38 117.51 117.84 1b4v h ILE 134 Ca -0.03 -2.89 -0.57 0.00 1.55 0.00 0.00 64.86 62.92 1b4v h ILE 134 Cb 1.07 2.61 -0.41 0.00 -0.27 0.00 0.00 36.82 39.82 1b4v h ILE 134 CO 0.08 0.80 -0.89 0.18 -1.05 0.00 0.00 178.15 177.27 1b4v n LEU 135 N -3.41 2.01 0.30 0.16 4.77 -0.34 -4.87 117.00 115.62 1b4v n LEU 135 Ca 0.00 -5.11 0.18 0.00 -0.03 0.00 0.00 56.01 51.05 1b4v n LEU 135 Cb 0.83 0.06 1.00 0.00 -2.33 0.00 0.00 43.42 42.98 1b4v n LEU 135 CO 0.44 2.13 1.15 1.55 -1.33 0.00 0.00 177.39 181.34 1b4v h PRO 136 N 3.79 0.00 -0.00 3.23 0.13 -1.73 -2.08 132.00 135.34 1b4v h PRO 136 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1b4v h PRO 136 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1b4v h PRO 136 CO 0.64 0.00 -0.16 0.54 -0.23 0.00 0.00 178.00 178.79 1b4v n ARG 137 N -3.54 0.22 -3.66 0.86 1.74 -1.26 -4.84 116.66 106.17 1b4v n ARG 137 Ca -0.02 -0.07 -0.37 0.00 -0.77 0.00 0.00 57.85 56.62 1b4v n ARG 137 Cb 0.13 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.02 1b4v n ARG 137 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1b4v s VAL 138 N -2.83 5.23 -0.54 1.55 1.01 -0.78 -5.03 120.40 119.01 1b4v s VAL 138 Ca 0.18 0.55 -0.28 0.00 0.00 0.00 0.00 61.98 62.43 1b4v s VAL 138 Cb 0.19 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 33.00 1b4v s VAL 138 CO 0.55 0.57 1.44 -0.62 0.00 0.00 0.00 175.10 177.05 1b4v s ASP 139 N -1.12 6.11 0.42 3.32 3.68 -1.26 -4.88 116.67 122.94 1b4v s ASP 139 Ca 0.21 0.37 0.19 0.00 2.13 0.00 0.00 52.55 55.45 1b4v s ASP 139 Cb -0.15 -2.54 0.92 0.00 -1.45 0.00 0.00 42.92 39.70 1b4v s ASP 139 CO 0.10 -1.70 1.87 0.77 0.13 0.00 0.00 175.17 176.34 1b4v h SER 140 N 11.21 0.00 -0.30 -0.34 4.64 -1.95 -2.98 113.55 123.83 1b4v h SER 140 Ca -0.27 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.03 1b4v h SER 140 Cb 1.10 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1b4v h SER 140 CO 1.17 0.29 0.10 0.28 -0.87 0.00 0.00 176.83 177.80 1b4v h SER 141 N 0.00 0.44 -0.84 4.97 0.02 -1.99 -1.12 113.55 115.02 1b4v h SER 141 Ca -0.00 -0.20 -0.03 0.00 -0.84 0.00 0.00 61.79 60.71 1b4v h SER 141 Cb 0.63 -0.11 -0.04 0.00 0.14 0.00 0.00 62.40 63.02 1b4v h SER 141 CO 0.04 0.52 0.40 -0.33 -1.14 0.00 0.00 176.83 176.32 1b4v h GLU 142 N 0.33 1.22 0.20 3.45 5.08 -1.96 0.10 114.58 123.00 1b4v h GLU 142 Ca 0.10 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1b4v h GLU 142 Cb 0.24 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1b4v h GLU 142 CO -0.00 0.93 -0.10 0.52 -1.00 0.00 0.00 179.01 179.36 1b4v h MET 143 N 1.20 -0.26 0.00 2.33 2.86 -1.34 -0.43 114.93 119.29 1b4v h MET 143 Ca 0.29 0.02 -0.17 0.00 -2.06 0.00 0.00 59.70 57.77 1b4v h MET 143 Cb 0.12 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 1b4v h MET 143 CO -0.04 -0.15 -0.82 1.88 1.06 0.00 0.00 176.91 178.84 1b4v h TYR 144 N -0.31 0.00 0.01 -0.22 -1.99 -1.10 0.21 116.97 113.56 1b4v h TYR 144 Ca -0.03 0.00 -0.25 0.00 2.00 0.00 0.00 58.73 60.45 1b4v h TYR 144 Cb 0.24 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.93 1b4v h TYR 144 CO -0.05 0.82 -1.32 -0.44 -0.00 0.00 0.00 178.16 177.17 1b4v h ASP 145 N 0.00 0.02 0.00 3.88 3.45 -0.82 -3.41 116.42 119.54 1b4v h ASP 145 Ca -0.01 -0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.42 1b4v h ASP 145 Cb 1.54 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 40.30 1b4v h ASP 145 CO 0.11 1.03 -0.42 -1.14 -1.57 0.00 0.00 179.24 177.25 1b4v n ARG 146 N -3.23 0.00 -0.05 3.56 0.63 -0.21 -4.79 116.66 112.57 1b4v n ARG 146 Ca -0.08 0.00 -0.15 0.00 -0.92 0.00 0.00 57.85 56.70 1b4v n ARG 146 Cb 0.99 -0.45 -0.05 0.00 0.45 0.00 0.00 32.46 33.41 1b4v n ARG 146 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 1b4v h TYR 147 N 0.00 1.07 -0.27 -0.14 0.05 -1.18 -2.39 116.97 114.11 1b4v h TYR 147 Ca 0.00 -0.41 -0.03 0.00 0.05 0.00 0.00 58.73 58.33 1b4v h TYR 147 Cb 0.42 -0.19 -0.01 0.00 1.01 0.00 0.00 36.73 37.96 1b4v h TYR 147 CO 0.00 1.24 0.04 0.74 -1.05 0.00 0.00 178.16 179.14 1b4v h PHE 148 N 0.62 0.48 -0.56 4.88 0.04 -0.86 -0.96 116.94 120.58 1b4v h PHE 148 Ca -0.01 -0.07 -0.02 0.00 2.80 0.00 0.00 57.97 60.67 1b4v h PHE 148 Cb 1.24 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 39.23 1b4v h PHE 148 CO 0.08 0.55 0.25 -1.35 -0.60 0.00 0.00 178.31 177.24 1b4v h PRO 149 N 0.27 0.79 -0.43 1.51 0.11 -1.79 -0.64 132.00 131.83 1b4v h PRO 149 Ca 0.08 -0.11 -0.04 0.00 0.11 0.00 0.00 66.00 66.05 1b4v h PRO 149 Cb 0.33 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 31.28 1b4v h PRO 149 CO 0.01 0.63 0.12 -0.09 -0.21 0.00 0.00 178.00 178.46 1b4v h ARG 150 N 0.79 0.67 -0.51 1.05 2.43 -1.20 -2.20 114.38 115.42 1b4v h ARG 150 Ca 0.19 -0.15 -0.04 0.00 -0.81 0.00 0.00 59.98 59.18 1b4v h ARG 150 Cb 0.12 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.55 1b4v h ARG 150 CO -0.02 0.66 0.17 0.00 -1.51 0.00 0.00 179.97 179.27 1b4v h ALA 151 N 0.98 0.66 -0.42 2.80 0.00 -0.71 -1.90 119.26 120.67 1b4v h ALA 151 Ca 0.14 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1b4v h ALA 151 Cb 0.28 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 1b4v h ALA 151 CO -0.00 0.31 0.15 -0.97 0.00 0.00 0.00 179.25 178.74 1b4v h ASN 152 N 0.69 0.17 0.08 0.00 -0.73 -0.98 -0.39 115.58 114.41 1b4v h ASN 152 Ca 0.16 0.05 -0.00 0.00 1.87 0.00 0.00 56.30 58.38 1b4v h ASN 152 Cb 0.26 0.03 0.00 0.00 0.27 0.00 0.00 38.32 38.88 1b4v h ASN 152 CO -0.01 0.13 -0.04 -1.28 -0.37 0.00 0.00 177.43 175.87 1b4v h SER 153 N 0.32 -0.09 -0.77 1.15 0.87 -1.26 -2.63 113.55 111.14 1b4v h SER 153 Ca 0.20 -0.28 -0.03 0.00 -1.23 0.00 0.00 61.79 60.45 1b4v h SER 153 Cb 0.18 0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.13 1b4v h SER 153 CO -0.20 0.23 0.35 0.24 -0.53 0.00 0.00 176.83 176.93 1b4v h MET 154 N -0.42 1.14 0.00 2.24 2.86 -1.21 -2.40 114.93 117.13 1b4v h MET 154 Ca -0.01 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.45 1b4v h MET 154 Cb 0.36 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 31.82 1b4v h MET 154 CO 0.02 0.89 0.00 -0.07 1.06 0.00 0.00 176.91 178.81 1b4v h LEU 155 N 1.12 0.00 -0.95 1.22 3.38 -1.09 -3.42 115.31 115.58 1b4v h LEU 155 Ca 0.27 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 58.00 1b4v h LEU 155 Cb 0.15 0.00 0.08 0.00 0.09 0.00 0.00 40.66 40.98 1b4v h LEU 155 CO -0.03 0.00 -0.40 0.54 0.09 0.00 0.00 178.44 178.64 1b4v n ARG 156 N -2.33 -4.67 -1.98 1.13 1.74 -0.90 -4.85 116.66 104.79 1b4v n ARG 156 Ca 0.02 0.49 -0.41 0.00 -0.77 0.00 0.00 57.85 57.17 1b4v n ARG 156 Cb 0.22 -4.49 -0.02 0.00 -1.02 0.00 0.00 32.46 27.15 1b4v n ARG 156 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1b4v s VAL 157 N -3.19 2.56 0.27 1.55 1.01 -1.00 -4.63 120.40 116.97 1b4v s VAL 157 Ca 0.33 0.49 0.02 0.00 0.00 0.00 0.00 61.98 62.82 1b4v s VAL 157 Cb -0.15 -3.31 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1b4v s VAL 157 CO 0.43 0.09 0.15 0.54 0.00 0.00 0.00 175.10 176.30 1b4v s ASN 158 N 0.24 1.15 0.00 3.32 6.03 0.17 -4.95 114.94 120.91 1b4v s ASN 158 Ca 0.58 -1.49 0.07 0.00 -1.03 0.00 0.00 52.86 50.98 1b4v s ASN 158 Cb -0.43 0.34 -0.02 0.00 -3.03 0.00 0.00 41.25 38.12 1b4v s ASN 158 CO 0.46 -0.85 -0.20 -1.00 -2.03 0.00 0.00 177.10 173.48 1b4v s HIS 159 N -3.76 1.80 0.42 1.54 3.76 -1.26 -1.83 115.29 115.95 1b4v s HIS 159 Ca 0.37 -0.35 -0.25 0.00 -0.15 0.00 0.00 55.06 54.69 1b4v s HIS 159 Cb 0.06 -1.13 -0.08 0.00 1.11 0.00 0.00 32.58 32.54 1b4v s HIS 159 CO 0.16 0.01 1.18 -1.50 -0.85 0.00 0.00 174.74 173.74 1b4v s ILE 160 N -0.58 3.09 -0.10 0.60 2.07 -1.26 -4.87 121.20 120.14 1b4v s ILE 160 Ca 0.08 0.89 -0.30 0.00 -1.41 0.00 0.00 60.65 59.91 1b4v s ILE 160 Cb -0.08 -3.49 -0.03 0.00 0.13 0.00 0.00 42.46 38.99 1b4v s ILE 160 CO 0.00 0.06 1.34 -0.62 -1.91 0.00 0.00 174.94 173.81 1b4v s ASP 161 N -1.16 6.90 0.30 4.50 2.15 -1.26 -4.92 116.67 123.17 1b4v s ASP 161 Ca 0.59 1.87 0.00 0.00 0.43 0.00 0.00 52.55 55.44 1b4v s ASP 161 Cb -0.31 -2.54 0.46 0.00 -0.30 0.00 0.00 42.92 40.23 1b4v s ASP 161 CO 0.38 -0.75 1.86 0.71 -0.17 0.00 0.00 175.17 177.21 1b4v h THR 162 N 5.33 1.21 -0.27 1.71 1.35 -1.99 -0.53 112.91 119.73 1b4v h THR 162 Ca -0.32 -0.72 -0.05 0.00 -0.55 0.00 0.00 66.41 64.77 1b4v h THR 162 Cb 1.14 0.63 -0.01 0.00 -1.73 0.00 0.00 68.15 68.17 1b4v h THR 162 CO 0.94 0.27 -0.03 0.50 -0.25 0.00 0.00 175.52 176.95 1b4v h LYS 163 N 0.78 0.49 -0.31 4.72 3.64 -1.99 -1.11 116.57 122.78 1b4v h LYS 163 Ca 0.18 -0.17 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1b4v h LYS 163 Cb 0.23 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1b4v h LYS 163 CO -0.01 0.68 0.11 2.35 -2.27 0.00 0.00 179.45 180.31 1b4v h TRP 164 N 0.26 0.48 -0.80 1.91 7.01 -1.93 -2.31 115.95 120.57 1b4v h TRP 164 Ca 0.07 -0.04 0.07 0.00 2.11 0.00 0.00 58.89 61.10 1b4v h TRP 164 Cb 0.48 -0.14 -0.06 0.00 -2.10 0.00 0.00 29.16 27.34 1b4v h TRP 164 CO 0.04 0.48 0.47 0.35 -2.79 0.00 0.00 178.44 177.00 1b4v h PHE 165 N 0.35 0.87 -0.22 2.65 3.04 -1.01 0.24 116.94 122.85 1b4v h PHE 165 Ca 0.10 0.03 -0.08 0.00 3.98 0.00 0.00 57.97 62.00 1b4v h PHE 165 Cb 0.21 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 38.44 1b4v h PHE 165 CO -0.00 0.41 -0.21 1.49 -2.02 0.00 0.00 178.31 177.98 1b4v h GLU 166 N 0.84 0.39 0.00 1.11 4.57 -0.97 -3.31 114.58 117.22 1b4v h GLU 166 Ca 0.36 -0.13 -0.22 0.00 -1.18 0.00 0.00 59.36 58.19 1b4v h GLU 166 Cb 0.23 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.75 1b4v h GLU 166 CO -0.20 0.59 -1.89 -0.25 -1.18 0.00 0.00 179.01 176.08 1b4v n ASP 167 N -4.16 0.40 -4.75 1.04 8.00 -0.89 -4.99 116.55 111.20 1b4v n ASP 167 Ca -0.00 0.18 -0.41 0.00 0.71 0.00 0.00 54.79 55.27 1b4v n ASP 167 Cb 0.36 0.76 -0.03 0.00 -0.02 0.00 0.00 41.12 42.20 1b4v n ASP 167 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1b4v s THR 168 N -2.85 3.18 0.31 -3.53 -1.32 0.03 -4.92 115.64 106.54 1b4v s THR 168 Ca -0.06 1.11 0.30 0.00 -1.21 0.00 0.00 61.69 61.82 1b4v s THR 168 Cb 0.09 -3.70 0.31 0.00 -1.51 0.00 0.00 72.50 67.69 1b4v s THR 168 CO 0.84 0.23 2.03 1.05 -2.21 0.00 0.00 174.62 176.55 1b4v h GLU 169 N 4.21 0.00 0.00 7.08 4.11 -1.91 -2.90 114.58 125.16 1b4v h GLU 169 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1b4v h GLU 169 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1b4v h GLU 169 CO 0.70 0.11 0.00 0.91 0.07 0.00 0.00 179.01 180.80 1b4v n TRP 170 N -3.41 0.64 -1.29 2.06 7.02 -1.25 -2.55 117.44 118.65 1b4v n TRP 170 Ca -0.01 0.27 0.08 0.00 -1.02 0.00 0.00 57.50 56.82 1b4v n TRP 170 Cb 0.28 -0.94 0.12 0.00 -2.42 0.00 0.00 31.31 28.35 1b4v n TRP 170 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1b4v n TYR 171 N -2.10 0.00 -0.17 -5.99 4.02 -1.10 -1.20 117.16 110.62 1b4v n TYR 171 Ca 0.01 -0.84 -0.02 0.00 -0.01 0.00 0.00 57.90 57.05 1b4v n TYR 171 Cb 0.16 -0.14 0.20 0.00 -0.02 0.00 0.00 39.34 39.55 1b4v n TYR 171 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1b4v h LYS 172 N 0.07 0.92 -0.77 -0.72 3.64 -1.58 -1.72 116.57 116.40 1b4v h LYS 172 Ca -0.00 -0.13 0.08 0.00 -1.27 0.00 0.00 60.65 59.33 1b4v h LYS 172 Cb 1.08 -0.17 -0.05 0.00 -0.41 0.00 0.00 32.23 32.69 1b4v h LYS 172 CO 0.00 0.73 0.51 0.27 -2.27 0.00 0.00 179.45 178.68 1b4v h PHE 173 N 0.91 0.79 -0.19 1.91 -5.15 -1.70 -0.63 116.94 112.88 1b4v h PHE 173 Ca 0.22 0.02 -0.13 0.00 -0.20 0.00 0.00 57.97 57.89 1b4v h PHE 173 Cb 0.13 -0.26 0.00 0.00 0.22 0.00 0.00 35.95 36.04 1b4v h PHE 173 CO 0.01 0.39 -0.38 0.00 -2.00 0.00 0.00 178.31 176.34 1b4v h ALA 174 N 1.60 0.29 -0.48 12.09 0.00 -1.66 -3.08 119.26 128.03 1b4v h ALA 174 Ca 0.34 -0.44 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 1b4v h ALA 174 Cb 0.36 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1b4v h ALA 174 CO -0.13 0.38 0.02 0.00 0.00 0.00 0.00 179.25 179.52 1b4v h ARG 175 N 0.25 0.78 -0.22 0.00 3.08 -0.85 -1.77 114.38 115.64 1b4v h ARG 175 Ca 0.01 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 1b4v h ARG 175 Cb 0.98 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.92 1b4v h ARG 175 CO 0.08 0.77 0.12 0.28 -1.07 0.00 0.00 179.97 180.15 1b4v h VAL 176 N 0.73 1.12 -0.33 2.04 2.07 -1.17 -1.69 116.25 119.03 1b4v h VAL 176 Ca 0.15 -0.33 -0.08 0.00 0.82 0.00 0.00 66.70 67.26 1b4v h VAL 176 Cb 0.42 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 1b4v h VAL 176 CO 0.02 0.12 -0.12 0.28 0.02 0.00 0.00 177.57 177.88 1b4v h SER 177 N 0.25 0.54 -0.33 0.57 0.02 -1.43 -1.21 113.55 111.96 1b4v h SER 177 Ca 0.08 -0.15 -0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1b4v h SER 177 Cb 0.08 -0.15 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 1b4v h SER 177 CO -0.01 0.70 0.19 -0.09 -1.14 0.00 0.00 176.83 176.47 1b4v h ARG 178 N 0.52 0.45 -0.47 3.45 2.43 -1.06 0.12 114.38 119.81 1b4v h ARG 178 Ca 0.09 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 1b4v h ARG 178 Cb 0.51 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.95 1b4v h ARG 178 CO 0.03 0.36 0.20 1.49 -1.51 0.00 0.00 179.97 180.53 1b4v h GLU 179 N 0.41 0.69 -0.49 0.20 4.22 -1.01 -0.30 114.58 118.30 1b4v h GLU 179 Ca 0.12 -0.12 -0.04 0.00 0.08 0.00 0.00 59.36 59.40 1b4v h GLU 179 Cb 0.03 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1b4v h GLU 179 CO -0.02 0.61 0.14 1.96 -2.18 0.00 0.00 179.01 179.53 1b4v h GLN 180 N 0.61 0.77 -0.46 1.92 1.08 -0.98 -2.77 115.11 115.30 1b4v h GLN 180 Ca 0.16 -0.17 -0.09 0.00 -1.45 0.00 0.00 58.65 57.10 1b4v h GLN 180 Cb 0.17 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.47 1b4v h GLN 180 CO -0.02 0.73 -0.08 0.00 -0.95 0.00 0.00 178.83 178.52 1b4v h ALA 181 N 1.01 1.01 -0.53 3.87 0.00 -0.60 -2.88 119.26 121.14 1b4v h ALA 181 Ca 0.16 -0.30 0.06 0.00 0.00 0.00 0.00 54.91 54.82 1b4v h ALA 181 Cb 0.29 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 1b4v h ALA 181 CO -0.00 0.60 0.35 0.78 0.00 0.00 0.00 179.25 180.98 1b4v h GLY 182 N 0.98 0.59 2.00 0.00 0.00 -0.77 -0.40 103.07 105.47 1b4v h GLY 182 Ca 0.13 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.24 1b4v h GLY 182 CO 0.03 0.15 -0.16 0.50 0.00 0.00 0.00 176.54 177.06 1b4v h LYS 183 N 0.48 0.00 -0.50 4.80 1.57 -1.33 -1.67 116.57 119.92 1b4v h LYS 183 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1b4v h LYS 183 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1b4v h LYS 183 CO -0.06 0.16 0.00 0.00 -0.57 0.00 0.00 179.45 178.98 1b4v n ALA 184 N -2.23 2.42 -1.28 3.86 0.00 -0.27 -4.88 120.51 118.14 1b4v n ALA 184 Ca -0.01 -0.90 -0.06 0.00 0.00 0.00 0.00 53.44 52.48 1b4v n ALA 184 Cb 0.33 -0.96 -0.02 0.00 0.00 0.00 0.00 19.45 18.80 1b4v n ALA 184 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b4v n GLY 185 N 1.33 0.72 3.63 0.00 0.00 -0.63 -4.95 105.19 105.30 1b4v n GLY 185 Ca 0.18 -0.79 -0.34 0.00 0.00 0.00 0.00 46.02 45.06 1b4v n GLY 185 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b4v s LEU 186 N -1.32 3.46 0.33 0.99 1.43 -0.57 -4.99 118.68 118.02 1b4v s LEU 186 Ca 0.00 0.06 0.07 0.00 -1.03 0.00 0.00 54.13 53.23 1b4v s LEU 186 Cb 0.00 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.41 1b4v s LEU 186 CO 0.00 0.33 0.41 -0.83 0.23 0.00 0.00 176.35 176.49 1b4v s GLY 187 N -0.58 1.65 0.34 -3.19 0.00 -1.26 -2.87 107.32 101.40 1b4v s GLY 187 Ca 0.09 -1.52 0.09 0.00 0.00 0.00 0.00 44.72 43.39 1b4v s GLY 187 CO 0.02 -1.44 -0.03 -0.51 0.00 0.00 0.00 173.10 171.14 1b4v s THR 188 N -2.21 2.51 0.01 0.90 -4.23 -1.26 -2.93 115.64 108.42 1b4v s THR 188 Ca 0.43 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.88 1b4v s THR 188 Cb -0.08 -2.73 -0.01 0.00 1.34 0.00 0.00 72.50 71.02 1b4v s THR 188 CO 0.30 -0.21 -0.01 0.54 -0.54 0.00 0.00 174.62 174.69 1b4v s VAL 189 N -2.54 0.07 0.32 2.29 0.11 0.07 -4.90 120.40 115.81 1b4v s VAL 189 Ca 0.34 -0.34 -0.28 0.00 -2.93 0.00 0.00 61.98 58.76 1b4v s VAL 189 Cb 0.00 -0.12 -0.09 0.00 -1.53 0.00 0.00 36.38 34.64 1b4v s VAL 189 CO 0.18 -0.17 1.13 -0.36 -3.33 0.00 0.00 175.10 172.55 1b4v s PHE 190 N -0.53 3.40 -0.27 1.54 0.40 -1.26 -1.41 117.98 119.86 1b4v s PHE 190 Ca -0.06 1.64 -0.06 0.00 -0.60 0.00 0.00 56.93 57.85 1b4v s PHE 190 Cb -0.04 -3.33 -0.00 0.00 0.51 0.00 0.00 43.02 40.16 1b4v s PHE 190 CO -0.00 -0.82 0.05 0.08 0.70 0.00 0.00 175.22 175.22 1b4v s VAL 191 N -1.26 3.88 0.88 -0.44 1.01 -0.17 -4.91 120.40 119.38 1b4v s VAL 191 Ca 0.48 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.82 1b4v s VAL 191 Cb -0.31 -2.90 0.12 0.00 0.00 0.00 0.00 36.38 33.29 1b4v s VAL 191 CO 0.40 0.22 1.15 -2.84 0.00 0.00 0.00 175.10 174.03 1b4v s PRO 192 N 1.52 1.27 0.12 2.72 0.02 -1.26 -4.79 135.00 134.60 1b4v s PRO 192 Ca 0.04 1.54 -0.13 0.00 0.02 0.00 0.00 61.00 62.47 1b4v s PRO 192 Cb -0.16 -1.76 0.02 0.00 0.02 0.00 0.00 34.50 32.62 1b4v s PRO 192 CO 0.01 -2.45 0.32 1.21 -0.33 0.00 0.00 177.00 175.77 1b4v s ASN 193 N -2.67 -0.08 0.00 2.53 3.84 -0.76 -1.47 114.94 116.33 1b4v s ASN 193 Ca 0.67 -0.51 0.25 0.00 0.21 0.00 0.00 52.86 53.48 1b4v s ASN 193 Cb -0.23 0.43 0.56 0.00 -0.55 0.00 0.00 41.25 41.46 1b4v s ASN 193 CO 0.56 -0.83 1.44 1.33 -2.79 0.00 0.00 177.10 176.82 1b4v n VAL 194 N -0.18 0.00 -2.81 -5.21 0.24 -0.47 -0.65 118.33 109.25 1b4v n VAL 194 Ca -0.14 -0.21 -0.41 0.00 -2.04 0.00 0.00 64.34 61.54 1b4v n VAL 194 Cb 0.63 0.72 -0.03 0.00 -1.47 0.00 0.00 33.84 33.69 1b4v n VAL 194 CO 0.00 0.00 0.00 -0.47 -2.14 0.00 0.00 176.83 174.22 1b4v s TYR 195 N -2.38 3.61 -0.32 6.34 6.14 -1.26 -1.77 117.35 127.71 1b4v s TYR 195 Ca 0.25 1.54 -0.28 0.00 0.64 0.00 0.00 57.07 59.22 1b4v s TYR 195 Cb 0.19 -3.03 -0.03 0.00 0.42 0.00 0.00 41.96 39.51 1b4v s TYR 195 CO 0.49 -0.01 2.00 0.34 0.64 0.00 0.00 175.55 179.01 1b4v s ASP 196 N 0.96 5.60 0.39 4.32 -1.08 -0.60 -4.82 116.67 121.43 1b4v s ASP 196 Ca 0.47 1.45 0.18 0.00 -0.52 0.00 0.00 52.55 54.13 1b4v s ASP 196 Cb -0.20 -2.52 0.78 0.00 -1.46 0.00 0.00 42.92 39.52 1b4v s ASP 196 CO 0.24 -1.92 1.80 -0.26 0.52 0.00 0.00 175.17 175.54 1b4v h PHE 197 N 14.25 0.00 -0.54 -5.34 0.04 -1.91 -1.65 116.94 121.79 1b4v h PHE 197 Ca -0.35 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.30 1b4v h PHE 197 Cb 1.20 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.33 1b4v h PHE 197 CO 0.96 0.36 -0.12 0.78 -0.60 0.00 0.00 178.31 179.68 1b4v h GLY 198 N 1.62 1.11 1.11 -1.45 0.00 -1.92 -1.39 103.07 102.15 1b4v h GLY 198 Ca -0.00 -0.91 -0.10 0.00 0.00 0.00 0.00 47.33 46.32 1b4v h GLY 198 CO 0.05 0.83 -0.01 -1.82 0.00 0.00 0.00 176.54 175.59 1b4v h TYR 199 N 0.91 1.16 -0.86 5.60 3.20 -1.88 -2.51 116.97 122.59 1b4v h TYR 199 Ca 0.14 -0.20 -0.01 0.00 3.14 0.00 0.00 58.73 61.80 1b4v h TYR 199 Cb 0.69 -0.30 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 1b4v h TYR 199 CO 0.05 1.02 0.51 1.98 -1.64 0.00 0.00 178.16 180.08 1b4v h MET 200 N 0.97 1.18 -0.67 1.82 4.05 -0.97 -0.33 114.93 120.97 1b4v h MET 200 Ca 0.17 -0.11 -0.01 0.00 -0.28 0.00 0.00 59.70 59.46 1b4v h MET 200 Cb 0.57 -0.24 -0.03 0.00 -0.80 0.00 0.00 31.60 31.09 1b4v h MET 200 CO 0.03 0.83 0.36 1.96 0.23 0.00 0.00 176.91 180.33 1b4v h GLN 201 N 1.19 0.94 0.00 0.39 4.20 -0.92 -2.18 115.11 118.73 1b4v h GLN 201 Ca 0.31 -0.11 -0.06 0.00 0.06 0.00 0.00 58.65 58.84 1b4v h GLN 201 Cb -0.03 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 1b4v h GLN 201 CO -0.06 0.71 -0.31 0.00 -0.67 0.00 0.00 178.83 178.51 1b4v h ARG 202 N 0.92 0.00 -0.11 1.46 3.08 -0.95 -2.60 114.38 116.19 1b4v h ARG 202 Ca 0.24 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.28 1b4v h ARG 202 Cb 0.05 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.09 1b4v h ARG 202 CO -0.04 0.31 0.03 0.93 -1.07 0.00 0.00 179.97 180.13 1b4v h GLU 203 N 0.00 0.17 0.00 0.04 5.08 -0.47 -0.11 114.58 119.29 1b4v h GLU 203 Ca -0.00 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 1b4v h GLU 203 Cb 0.57 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.79 1b4v h GLU 203 CO 0.04 0.31 -0.07 0.00 -1.00 0.00 0.00 179.01 178.29 1b4v h ALA 204 N 0.85 1.77 -0.09 3.43 0.00 -1.18 -0.91 119.26 123.13 1b4v h ALA 204 Ca 0.03 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1b4v h ALA 204 Cb 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1b4v h ALA 204 CO -0.00 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.34 1b4v n ALA 205 N -2.47 2.56 -2.37 0.00 0.00 -1.00 -4.92 120.51 112.31 1b4v n ALA 205 Ca -0.03 -0.40 -0.16 0.00 0.00 0.00 0.00 53.44 52.85 1b4v n ALA 205 Cb 0.16 -1.18 -0.00 0.00 0.00 0.00 0.00 19.45 18.42 1b4v n ALA 205 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b4v n GLY 206 N 1.06 -0.29 0.06 0.00 0.00 -0.35 -4.92 105.19 100.76 1b4v n GLY 206 Ca 0.17 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 46.05 1b4v n GLY 206 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1b4v n GLU 207 N -2.62 0.65 -4.06 1.61 1.02 -0.08 -4.98 120.64 112.17 1b4v n GLU 207 Ca -0.18 -0.04 -0.07 0.00 -0.02 0.00 0.00 57.16 56.85 1b4v n GLU 207 Cb 0.64 -1.63 -0.10 0.00 -0.02 0.00 0.00 31.44 30.33 1b4v n GLU 207 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1b4v s VAL 208 N -3.21 0.20 0.18 2.62 -7.23 -1.22 -5.01 120.40 106.72 1b4v s VAL 208 Ca -0.06 -1.62 -0.33 0.00 -1.81 0.00 0.00 61.98 58.16 1b4v s VAL 208 Cb 0.11 -1.30 -0.14 0.00 0.56 0.00 0.00 36.38 35.61 1b4v s VAL 208 CO 0.86 -0.89 1.56 -2.65 -0.31 0.00 0.00 175.10 173.66 1b4v n PRO 209 N 0.34 2.18 -2.68 4.82 -0.02 -1.26 -4.54 135.00 133.85 1b4v n PRO 209 Ca -0.16 0.78 -0.34 0.00 -2.02 0.00 0.00 63.50 61.77 1b4v n PRO 209 Cb 0.60 -2.54 -0.05 0.00 -0.02 0.00 0.00 33.50 31.49 1b4v n PRO 209 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1b4v s LYS 210 N 0.71 4.02 0.00 -0.52 1.02 -1.26 -4.90 119.74 118.81 1b4v s LYS 210 Ca 0.77 1.25 0.00 0.00 0.02 0.00 0.00 55.97 58.01 1b4v s LYS 210 Cb -0.66 -2.15 0.00 0.00 -0.52 0.00 0.00 37.83 34.49 1b4v s LYS 210 CO 0.39 -0.23 0.00 0.45 -0.92 0.00 0.00 175.35 175.05 1b4v n SER 211 N -0.77 0.00 0.04 2.83 2.88 -1.26 -4.68 113.62 112.65 1b4v n SER 211 Ca 0.08 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.65 1b4v n SER 211 Cb 0.53 0.01 0.39 0.00 -0.75 0.00 0.00 64.21 64.39 1b4v n SER 211 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1b4v h ALA 212 N 0.00 1.59 -0.46 -1.46 0.00 -1.81 -1.01 119.26 116.12 1b4v h ALA 212 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1b4v h ALA 212 Cb 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1b4v h ALA 212 CO 0.00 0.32 0.00 1.28 0.00 0.00 0.00 179.25 180.85 1b4v n LEU 213 N -4.39 3.34 -1.74 0.00 4.77 -1.26 -0.97 117.00 116.75 1b4v n LEU 213 Ca 0.02 -1.68 -0.06 0.00 -0.03 0.00 0.00 56.01 54.25 1b4v n LEU 213 Cb 0.15 -0.46 0.08 0.00 -2.33 0.00 0.00 43.42 40.86 1b4v n LEU 213 CO 0.37 0.61 0.17 0.00 -1.33 0.00 0.00 177.39 177.20 1b4v n ALA 214 N 0.76 3.68 -3.77 -1.18 0.00 -0.42 -5.00 120.51 114.58 1b4v n ALA 214 Ca 0.18 -3.19 -0.29 0.00 0.00 0.00 0.00 53.44 50.13 1b4v n ALA 214 Cb 0.62 -0.52 0.02 0.00 0.00 0.00 0.00 19.45 19.57 1b4v n ALA 214 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1b4v n THR 215 N -0.59 -4.85 -4.35 0.00 -1.04 -1.22 -4.77 114.28 97.46 1b4v n THR 215 Ca 0.23 -0.78 -0.21 0.00 -2.04 0.00 0.00 64.05 61.25 1b4v n THR 215 Cb 0.89 -3.75 -0.16 0.00 -1.82 0.00 0.00 70.33 65.49 1b4v n THR 215 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1b4v s GLU 216 N -6.18 1.02 0.11 -2.82 2.02 -0.98 -0.92 118.70 110.94 1b4v s GLU 216 Ca 0.30 -0.26 0.00 0.00 0.02 0.00 0.00 54.97 55.02 1b4v s GLU 216 Cb -0.11 -0.94 0.00 0.00 0.10 0.00 0.00 34.13 33.18 1b4v s GLU 216 CO 0.87 0.05 0.00 1.55 0.02 0.00 0.00 175.26 177.75 1b4v n VAL 217 N 3.56 0.00 0.29 2.63 3.14 -1.21 -4.27 118.33 122.47 1b4v n VAL 217 Ca -0.21 0.00 0.18 0.00 -2.96 0.00 0.00 64.34 61.35 1b4v n VAL 217 Cb 0.53 0.00 0.81 0.00 -1.06 0.00 0.00 33.84 34.12 1b4v n VAL 217 CO 0.00 0.00 0.00 -0.29 -6.46 0.00 0.00 176.83 170.08 1b4v h ILE 218 N 0.00 0.05 -0.26 1.55 2.10 -1.89 -1.32 117.51 117.74 1b4v h ILE 218 Ca 0.00 -0.42 0.00 0.00 1.08 0.00 0.00 64.86 65.52 1b4v h ILE 218 Cb 0.00 1.39 0.00 0.00 -1.09 0.00 0.00 36.82 37.12 1b4v h ILE 218 CO 0.00 0.02 0.00 -1.22 -1.08 0.00 0.00 178.15 175.87 1b4v n TYR 219 N -3.13 0.71 0.00 2.19 4.01 -1.26 -4.71 117.16 114.98 1b4v n TYR 219 Ca -0.00 -0.75 0.00 0.00 -0.16 0.00 0.00 57.90 56.98 1b4v n TYR 219 Cb 0.25 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 1b4v n TYR 219 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1b4v n GLY 220 N -0.24 2.51 3.30 2.72 0.00 -0.50 -4.33 105.19 108.65 1b4v n GLY 220 Ca 0.17 -1.89 -0.34 0.00 0.00 0.00 0.00 46.02 43.97 1b4v n GLY 220 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1b4v s ASN 221 N 0.00 3.90 0.00 1.61 -0.87 -1.26 -3.33 114.94 114.99 1b4v s ASN 221 Ca 0.00 -0.42 0.25 0.00 -1.57 0.00 0.00 52.86 51.12 1b4v s ASN 221 Cb 0.00 -1.62 1.34 0.00 -0.02 0.00 0.00 41.25 40.95 1b4v s ASN 221 CO 0.00 0.08 1.84 0.59 -2.57 0.00 0.00 177.10 177.04 1b4v n ASN 222 N 4.12 0.00 -3.54 -1.22 3.02 -1.26 -4.80 115.26 111.57 1b4v n ASN 222 Ca -0.19 -0.32 -0.10 0.00 -0.03 0.00 0.00 54.58 53.94 1b4v n ASN 222 Cb 0.52 -0.19 -0.04 0.00 -0.61 0.00 0.00 39.78 39.46 1b4v n ASN 222 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1b4v s HIS 223 N -2.37 -0.38 0.00 3.10 3.76 -1.26 -5.01 115.29 113.13 1b4v s HIS 223 Ca 0.29 0.49 0.00 0.00 -0.15 0.00 0.00 55.06 55.68 1b4v s HIS 223 Cb 0.17 0.48 0.00 0.00 1.11 0.00 0.00 32.58 34.34 1b4v s HIS 223 CO 0.35 -0.44 0.00 0.41 -0.85 0.00 0.00 174.74 174.20 1b4v n GLY 224 N 0.33 1.91 3.65 -2.22 0.00 -1.26 -4.57 105.19 103.03 1b4v n GLY 224 Ca -0.10 -0.33 -0.43 0.00 0.00 0.00 0.00 46.02 45.16 1b4v n GLY 224 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b4v s LYS 225 N 0.00 4.16 -1.30 1.61 2.20 -1.26 -1.56 119.74 123.59 1b4v s LYS 225 Ca 0.00 1.32 -0.15 0.00 -0.36 0.00 0.00 55.97 56.78 1b4v s LYS 225 Cb 0.00 -3.71 0.11 0.00 -1.51 0.00 0.00 37.83 32.71 1b4v s LYS 225 CO 0.00 -0.77 1.76 1.04 -0.36 0.00 0.00 175.35 177.02 1b4v n GLN 226 N 6.63 3.25 -1.29 4.03 1.13 -0.73 -4.97 117.38 125.43 1b4v n GLN 226 Ca 0.13 -3.36 -0.29 0.00 -1.94 0.00 0.00 57.00 51.54 1b4v n GLN 226 Cb 0.46 -3.25 0.16 0.00 0.11 0.00 0.00 30.24 27.72 1b4v n GLN 226 CO 0.00 0.00 0.00 -1.54 -1.44 0.00 0.00 177.06 174.08 1b4v s SER 227 N 3.15 3.06 0.49 1.08 1.04 -1.26 -4.78 113.70 116.49 1b4v s SER 227 Ca 0.47 1.17 0.22 0.00 0.48 0.00 0.00 55.95 58.30 1b4v s SER 227 Cb 0.05 -1.83 1.27 0.00 0.10 0.00 0.00 66.02 65.61 1b4v s SER 227 CO 0.02 -2.86 1.95 -0.07 0.98 0.00 0.00 173.24 173.27 1b4v h LEU 228 N -1.70 0.16 -2.18 2.42 3.38 -1.83 -0.75 115.31 114.81 1b4v h LEU 228 Ca -0.52 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.44 1b4v h LEU 228 Cb 1.32 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 42.05 1b4v h LEU 228 CO 0.58 0.08 -0.07 -2.24 0.09 0.00 0.00 178.44 176.89 1b4v h ASP 229 N 0.17 0.00 0.62 -0.43 2.03 -1.90 -0.75 116.42 116.15 1b4v h ASP 229 Ca 0.32 0.00 -0.12 0.00 -0.73 0.00 0.00 57.03 56.50 1b4v h ASP 229 Cb 1.02 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.49 1b4v h ASP 229 CO -0.05 0.07 -1.47 0.29 -1.03 0.00 0.00 179.24 177.04 1b4v n LYS 230 N -3.63 0.63 0.00 4.15 5.02 -0.31 -2.87 118.16 121.16 1b4v n LYS 230 Ca -0.02 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 1b4v n LYS 230 Cb 0.17 -1.75 0.00 0.00 -0.02 0.00 0.00 35.03 33.43 1b4v n LYS 230 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1b4v n THR 231 N -2.74 0.00 -0.07 -0.18 -2.24 -0.83 -4.59 114.28 103.63 1b4v n THR 231 Ca -0.08 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.63 1b4v n THR 231 Cb 0.76 -0.15 -0.01 0.00 -2.10 0.00 0.00 70.33 68.84 1b4v n THR 231 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 1b4v h TYR 232 N 0.00 -0.06 -0.63 4.78 -1.99 -1.77 -2.16 116.97 115.14 1b4v h TYR 232 Ca 0.00 0.02 -0.06 0.00 2.00 0.00 0.00 58.73 60.69 1b4v h TYR 232 Cb 0.00 0.07 -0.03 0.00 2.00 0.00 0.00 36.73 38.78 1b4v h TYR 232 CO 0.00 -0.08 0.16 -0.07 -0.00 0.00 0.00 178.16 178.17 1b4v h LEU 233 N 0.05 0.92 -0.62 3.88 3.38 -1.41 0.11 115.31 121.62 1b4v h LEU 233 Ca 0.14 -0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1b4v h LEU 233 Cb 0.19 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1b4v h LEU 233 CO -0.26 0.88 0.32 0.00 0.09 0.00 0.00 178.44 179.48 1b4v h ALA 234 N 1.23 0.80 -0.51 1.53 0.00 -1.37 -0.72 119.26 120.22 1b4v h ALA 234 Ca 0.20 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 1b4v h ALA 234 Cb 0.32 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1b4v h ALA 234 CO -0.00 0.34 -0.17 0.00 0.00 0.00 0.00 179.25 179.41 1b4v h ALA 235 N 1.14 0.71 -0.37 0.00 0.00 -0.98 -1.57 119.26 118.19 1b4v h ALA 235 Ca 0.22 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1b4v h ALA 235 Cb 0.09 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1b4v h ALA 235 CO -0.03 0.68 0.24 0.00 0.00 0.00 0.00 179.25 180.14 1b4v h ALA 236 N 0.89 0.47 -0.07 0.00 0.00 -0.39 -1.49 119.26 118.68 1b4v h ALA 236 Ca 0.12 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1b4v h ALA 236 Cb 0.75 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1b4v h ALA 236 CO 0.06 -0.06 -0.21 -0.07 0.00 0.00 0.00 179.25 178.97 1b4v h LEU 237 N 0.50 0.10 -1.78 0.00 3.38 -1.03 -2.46 115.31 114.02 1b4v h LEU 237 Ca 0.13 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1b4v h LEU 237 Cb -0.04 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1b4v h LEU 237 CO -0.03 0.33 0.00 1.23 0.09 0.00 0.00 178.44 180.06 1b4v h GLY 238 N 0.78 0.00 2.00 0.83 0.00 -0.24 -2.58 103.07 103.87 1b4v h GLY 238 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 1b4v h GLY 238 CO 0.03 0.00 -0.04 -0.91 0.00 0.00 0.00 176.54 175.63 1b4v h THR 239 N 0.00 0.08 0.00 4.70 1.35 -1.08 -3.46 112.91 114.50 1b4v h THR 239 Ca 0.00 -0.68 0.00 0.00 -0.55 0.00 0.00 66.41 65.18 1b4v h THR 239 Cb 0.32 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.36 1b4v h THR 239 CO 0.00 0.03 0.00 0.61 -0.25 0.00 0.00 175.52 175.91 1b4v n GLY 240 N 0.22 0.77 0.17 5.82 0.00 -0.97 -4.86 105.19 106.35 1b4v n GLY 240 Ca 0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.05 1b4v n GLY 240 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1b4v n LYS 241 N -2.46 1.10 -4.95 1.61 4.76 -1.26 -5.02 118.16 111.95 1b4v n LYS 241 Ca 0.00 -1.16 -0.27 0.00 -2.87 0.00 0.00 58.31 54.00 1b4v n LYS 241 Cb 0.00 -1.08 -0.16 0.00 -1.84 0.00 0.00 35.03 31.95 1b4v n LYS 241 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1b4v s VAL 242 N -0.62 1.59 0.10 -0.18 1.01 -1.26 -0.28 120.40 120.76 1b4v s VAL 242 Ca 0.06 -0.81 0.07 0.00 0.00 0.00 0.00 61.98 61.29 1b4v s VAL 242 Cb 0.03 -1.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.02 1b4v s VAL 242 CO 0.05 0.45 -0.16 0.42 0.00 0.00 0.00 175.10 175.86 1b4v s THR 243 N -0.02 1.41 -0.09 3.92 -4.23 -0.47 -4.65 115.64 111.51 1b4v s THR 243 Ca -0.04 -1.56 0.01 0.00 -1.18 0.00 0.00 61.69 58.93 1b4v s THR 243 Cb -0.12 -1.42 0.02 0.00 1.34 0.00 0.00 72.50 72.32 1b4v s THR 243 CO 0.03 -0.25 -0.10 -0.63 -0.54 0.00 0.00 174.62 173.13 1b4v s ILE 244 N -1.58 1.07 -0.20 2.99 1.01 -1.26 -0.58 121.20 122.64 1b4v s ILE 244 Ca 0.05 -0.37 -0.04 0.00 0.00 0.00 0.00 60.65 60.29 1b4v s ILE 244 Cb -0.08 -1.04 -0.02 0.00 0.01 0.00 0.00 42.46 41.34 1b4v s ILE 244 CO 0.03 0.36 -0.03 -1.10 0.00 0.00 0.00 174.94 174.20 1b4v s GLN 245 N 1.25 3.49 0.40 2.79 -0.21 -0.31 -4.98 119.66 122.09 1b4v s GLN 245 Ca -0.04 -0.58 0.02 0.00 0.02 0.00 0.00 55.36 54.79 1b4v s GLN 245 Cb -0.14 -3.01 -0.01 0.00 1.00 0.00 0.00 33.01 30.85 1b4v s GLN 245 CO -0.03 -0.07 0.59 0.95 -2.12 0.00 0.00 175.29 174.61 1b4v s THR 246 N 1.18 4.09 -1.51 -0.19 -4.23 -1.26 -1.31 115.64 112.40 1b4v s THR 246 Ca 0.02 -0.67 -0.00 0.00 -1.18 0.00 0.00 61.69 59.86 1b4v s THR 246 Cb -0.14 -3.48 0.00 0.00 1.34 0.00 0.00 72.50 70.22 1b4v s THR 246 CO -0.00 -0.28 0.03 0.18 -0.54 0.00 0.00 174.62 174.01 1b4v n LEU 247 N -1.91 -1.69 -4.11 4.79 4.77 0.36 -4.90 117.00 114.31 1b4v n LEU 247 Ca 0.00 0.04 -0.33 0.00 -0.03 0.00 0.00 56.01 55.69 1b4v n LEU 247 Cb 0.58 -2.65 -0.15 0.00 -2.33 0.00 0.00 43.42 38.87 1b4v n LEU 247 CO 0.46 -0.16 -0.42 -1.00 -1.33 0.00 0.00 177.39 174.93 1b4v s HIS 248 N -2.89 3.23 -0.18 -1.77 3.76 -0.10 -1.76 115.29 115.59 1b4v s HIS 248 Ca 0.02 -2.10 -0.05 0.00 -0.15 0.00 0.00 55.06 52.78 1b4v s HIS 248 Cb -0.01 -2.00 -0.03 0.00 1.11 0.00 0.00 32.58 31.66 1b4v s HIS 248 CO 0.02 -0.84 -0.01 -1.14 -0.85 0.00 0.00 174.74 171.93 1b4v s GLN 249 N 1.17 3.68 0.00 1.40 0.74 -0.19 -2.23 119.66 124.23 1b4v s GLN 249 Ca -0.07 -0.50 -0.30 0.00 0.05 0.00 0.00 55.36 54.54 1b4v s GLN 249 Cb -0.19 -3.03 -0.03 0.00 1.10 0.00 0.00 33.01 30.85 1b4v s GLN 249 CO -0.04 0.12 1.02 0.08 -0.55 0.00 0.00 175.29 175.93 1b4v s VAL 250 N 0.70 4.71 -0.19 1.34 1.01 -1.26 -0.84 120.40 125.86 1b4v s VAL 250 Ca -0.00 1.95 -0.02 0.00 0.00 0.00 0.00 61.98 63.90 1b4v s VAL 250 Cb -0.14 -4.25 -0.11 0.00 0.00 0.00 0.00 36.38 31.88 1b4v s VAL 250 CO 0.02 0.14 -0.20 0.29 0.00 0.00 0.00 175.10 175.35 1b4v n LYS 251 N 3.98 0.46 -4.16 2.72 4.76 -0.25 -4.97 118.16 120.70 1b4v n LYS 251 Ca 0.07 0.14 -0.15 0.00 -2.87 0.00 0.00 58.31 55.50 1b4v n LYS 251 Cb 0.50 -1.32 -0.11 0.00 -1.84 0.00 0.00 35.03 32.26 1b4v n LYS 251 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1b4v s THR 252 N -2.37 0.91 -0.04 -0.18 -4.23 -1.22 -4.96 115.64 103.54 1b4v s THR 252 Ca -0.26 -1.53 0.02 0.00 -1.18 0.00 0.00 61.69 58.73 1b4v s THR 252 Cb 0.08 -1.23 0.02 0.00 1.34 0.00 0.00 72.50 72.70 1b4v s THR 252 CO 0.41 -0.49 -0.07 -0.63 -0.54 0.00 0.00 174.62 173.30 1b4v s ILE 253 N -2.17 0.69 0.05 2.99 1.01 -1.26 -2.29 121.20 120.23 1b4v s ILE 253 Ca 0.03 -0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.43 1b4v s ILE 253 Cb -0.05 -0.67 -0.04 0.00 0.01 0.00 0.00 42.46 41.71 1b4v s ILE 253 CO 0.00 0.25 -0.03 0.00 0.00 0.00 0.00 174.94 175.16 1b4v s ARG 254 N 0.70 0.62 -0.23 2.79 1.70 -0.57 -4.42 118.95 119.54 1b4v s ARG 254 Ca -0.11 -1.20 -0.15 0.00 -0.47 0.00 0.00 55.73 53.80 1b4v s ARG 254 Cb -0.13 0.17 -0.04 0.00 -0.57 0.00 0.00 34.95 34.37 1b4v s ARG 254 CO 0.01 -0.10 0.36 -1.14 -1.08 0.00 0.00 175.30 173.35 1b4v s GLN 255 N -3.80 4.10 1.00 3.89 0.74 -1.23 -1.16 119.66 123.20 1b4v s GLN 255 Ca 0.06 0.08 -0.11 0.00 0.05 0.00 0.00 55.36 55.44 1b4v s GLN 255 Cb 0.07 -3.58 0.19 0.00 1.10 0.00 0.00 33.01 30.79 1b4v s GLN 255 CO -0.09 -0.11 1.09 0.95 -0.55 0.00 0.00 175.29 176.58 1b4v s THR 256 N 1.54 2.23 -2.00 -0.34 -4.23 0.23 -4.85 115.64 108.23 1b4v s THR 256 Ca 0.16 0.08 0.05 0.00 -1.18 0.00 0.00 61.69 60.80 1b4v s THR 256 Cb -0.15 -2.23 0.15 0.00 1.34 0.00 0.00 72.50 71.61 1b4v s THR 256 CO 0.08 -0.10 0.79 0.29 -0.54 0.00 0.00 174.62 175.14 1b4v n LYS 257 N -4.39 0.17 -0.07 3.99 5.02 -1.26 -2.34 118.16 119.29 1b4v n LYS 257 Ca 0.07 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.39 1b4v n LYS 257 Cb 0.54 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 34.08 1b4v n LYS 257 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1b4v n ASP 258 N -1.00 1.52 0.00 4.39 5.68 -1.26 -5.02 116.55 120.86 1b4v n ASP 258 Ca 0.04 -2.08 0.00 0.00 -0.50 0.00 0.00 54.79 52.25 1b4v n ASP 258 Cb 0.02 -0.13 0.00 0.00 -1.14 0.00 0.00 41.12 39.87 1b4v n ASP 258 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1b4v n GLY 259 N -0.59 2.78 0.12 6.12 0.00 -0.99 -5.08 105.19 107.55 1b4v n GLY 259 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.05 1b4v n GLY 259 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b4v n GLY 260 N -1.54 -0.75 3.17 -0.02 0.00 -1.26 -4.80 105.19 100.00 1b4v n GLY 260 Ca 0.00 -1.73 -0.23 0.00 0.00 0.00 0.00 46.02 44.06 1b4v n GLY 260 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1b4v s TYR 261 N -0.83 1.49 -0.01 1.61 2.02 -0.56 -0.60 117.35 120.47 1b4v s TYR 261 Ca 0.02 -0.32 0.07 0.00 -0.37 0.00 0.00 57.07 56.47 1b4v s TYR 261 Cb -0.00 -0.92 -0.02 0.00 -0.40 0.00 0.00 41.96 40.62 1b4v s TYR 261 CO 0.02 0.02 -0.23 0.00 -1.57 0.00 0.00 175.55 173.79 1b4v s ALA 262 N -0.60 1.92 0.03 3.71 0.00 -0.31 -0.51 121.76 126.00 1b4v s ALA 262 Ca 0.05 -1.00 0.06 0.00 0.00 0.00 0.00 51.96 51.07 1b4v s ALA 262 Cb -0.07 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 1b4v s ALA 262 CO 0.00 0.47 -0.17 -0.51 0.00 0.00 0.00 175.76 175.55 1b4v s LEU 263 N -0.59 2.15 -0.26 0.00 1.43 0.74 -1.51 118.68 120.64 1b4v s LEU 263 Ca 0.09 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 52.62 1b4v s LEU 263 Cb -0.09 -0.80 -0.05 0.00 0.03 0.00 0.00 46.19 45.29 1b4v s LEU 263 CO -0.01 0.11 0.18 0.42 0.23 0.00 0.00 176.35 177.29 1b4v s THR 264 N -0.76 5.33 -0.11 5.49 -4.23 -0.97 -1.46 115.64 118.94 1b4v s THR 264 Ca 0.05 0.19 0.03 0.00 -1.18 0.00 0.00 61.69 60.77 1b4v s THR 264 Cb -0.08 -3.52 0.01 0.00 1.34 0.00 0.00 72.50 70.25 1b4v s THR 264 CO 0.01 0.30 -0.19 -0.69 -0.54 0.00 0.00 174.62 173.50 1b4v s VAL 265 N 1.41 1.78 -0.16 2.29 1.01 0.47 -1.09 120.40 126.11 1b4v s VAL 265 Ca 0.07 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 61.11 1b4v s VAL 265 Cb -0.15 -1.57 -0.05 0.00 0.00 0.00 0.00 36.38 34.61 1b4v s VAL 265 CO 0.08 0.50 0.23 -1.61 0.00 0.00 0.00 175.10 174.29 1b4v s GLU 266 N 0.69 4.14 -0.19 2.72 2.02 -0.02 -0.41 118.70 127.65 1b4v s GLU 266 Ca -0.12 -0.02 -0.06 0.00 0.02 0.00 0.00 54.97 54.79 1b4v s GLU 266 Cb -0.16 -3.39 -0.03 0.00 0.10 0.00 0.00 34.13 30.64 1b4v s GLU 266 CO 0.02 0.33 0.03 -1.14 0.02 0.00 0.00 175.26 174.52 1b4v s GLN 267 N 0.22 3.77 0.31 1.61 0.74 0.80 -1.02 119.66 126.09 1b4v s GLN 267 Ca 0.14 -0.45 0.05 0.00 0.05 0.00 0.00 55.36 55.15 1b4v s GLN 267 Cb -0.12 -3.13 -0.06 0.00 1.10 0.00 0.00 33.01 30.79 1b4v s GLN 267 CO 0.02 0.13 0.02 0.15 -0.55 0.00 0.00 175.29 175.06 1b4v s LYS 268 N 0.71 1.62 0.63 1.67 1.02 -0.72 0.09 119.74 124.77 1b4v s LYS 268 Ca 0.01 -1.87 0.06 0.00 0.02 0.00 0.00 55.97 54.19 1b4v s LYS 268 Cb -0.14 -0.99 0.11 0.00 -0.52 0.00 0.00 37.83 36.29 1b4v s LYS 268 CO 0.02 -0.10 0.87 0.16 -0.92 0.00 0.00 175.35 175.38 1b4v s ASP 269 N -3.48 4.81 0.23 2.83 3.84 -0.65 -4.82 116.67 119.43 1b4v s ASP 269 Ca 0.34 -0.72 0.19 0.00 -0.00 0.00 0.00 52.55 52.35 1b4v s ASP 269 Cb 0.07 0.26 0.91 0.00 -1.38 0.00 0.00 42.92 42.78 1b4v s ASP 269 CO 0.14 -1.55 1.57 0.35 -0.00 0.00 0.00 175.17 175.68 1b4v n THR 270 N -2.46 1.10 1.34 2.11 -2.24 -1.26 -0.98 114.28 111.89 1b4v n THR 270 Ca 0.16 0.50 0.13 0.00 -2.27 0.00 0.00 64.05 62.58 1b4v n THR 270 Cb 0.61 -1.46 0.40 0.00 -2.10 0.00 0.00 70.33 67.78 1b4v n THR 270 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1b4v n ASP 271 N -2.09 1.66 0.00 3.42 8.00 -1.26 -1.45 116.55 124.83 1b4v n ASP 271 Ca 0.00 -1.45 0.00 0.00 0.71 0.00 0.00 54.79 54.05 1b4v n ASP 271 Cb 0.10 0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.25 1b4v n ASP 271 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b4v n GLY 272 N 1.25 0.61 3.71 0.44 0.00 -0.15 -4.87 105.19 106.18 1b4v n GLY 272 Ca 0.16 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1b4v n GLY 272 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b4v s LYS 273 N -0.24 4.56 -0.20 1.61 2.20 -1.26 -4.79 119.74 121.62 1b4v s LYS 273 Ca 0.00 1.49 -0.29 0.00 -0.36 0.00 0.00 55.97 56.81 1b4v s LYS 273 Cb 0.00 -3.43 -0.02 0.00 -1.51 0.00 0.00 37.83 32.87 1b4v s LYS 273 CO 0.00 -0.05 1.53 -1.17 -0.36 0.00 0.00 175.35 175.31 1b4v s LEU 274 N 0.85 3.99 -0.11 5.43 2.96 -1.26 -1.64 118.68 128.89 1b4v s LEU 274 Ca 0.52 1.65 0.00 0.00 -0.22 0.00 0.00 54.13 56.09 1b4v s LEU 274 Cb -0.23 -3.53 -0.25 0.00 0.50 0.00 0.00 46.19 42.68 1b4v s LEU 274 CO 0.29 -1.12 0.39 0.18 -1.32 0.00 0.00 176.35 174.77 1b4v n LEU 275 N 7.91 2.09 -3.55 -0.68 4.77 0.11 -4.98 117.00 122.67 1b4v n LEU 275 Ca 0.17 0.23 -0.06 0.00 -0.03 0.00 0.00 56.01 56.32 1b4v n LEU 275 Cb 0.45 -0.70 -0.02 0.00 -2.33 0.00 0.00 43.42 40.82 1b4v n LEU 275 CO 0.63 0.72 0.85 0.00 -1.33 0.00 0.00 177.39 178.27 1b4v s ALA 276 N -2.56 -1.95 -0.12 -1.18 0.00 -1.04 -5.00 121.76 109.89 1b4v s ALA 276 Ca -0.18 1.29 0.00 0.00 0.00 0.00 0.00 51.96 53.07 1b4v s ALA 276 Cb 0.07 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.37 1b4v s ALA 276 CO 0.77 -0.65 -0.11 0.99 0.00 0.00 0.00 175.76 176.76 1b4v s THR 277 N -2.76 1.27 0.22 0.00 2.01 -1.26 -0.14 115.64 114.98 1b4v s THR 277 Ca 0.07 -0.46 0.09 0.00 0.31 0.00 0.00 61.69 61.70 1b4v s THR 277 Cb -0.01 -1.23 -0.05 0.00 0.01 0.00 0.00 72.50 71.22 1b4v s THR 277 CO -0.07 0.41 -0.16 -1.59 -0.69 0.00 0.00 174.62 172.52 1b4v s LYS 278 N 1.49 1.41 -0.25 4.92 -2.85 0.45 -4.94 119.74 119.97 1b4v s LYS 278 Ca 0.03 -1.63 -0.10 0.00 -1.00 0.00 0.00 55.97 53.26 1b4v s LYS 278 Cb -0.13 -1.28 -0.05 0.00 -2.06 0.00 0.00 37.83 34.31 1b4v s LYS 278 CO -0.08 0.22 0.16 -1.21 0.10 0.00 0.00 175.35 174.54 1b4v s GLU 279 N -3.60 4.00 -0.13 1.78 0.41 -1.26 -0.39 118.70 119.51 1b4v s GLU 279 Ca 0.24 -0.30 0.00 0.00 -0.41 0.00 0.00 54.97 54.50 1b4v s GLU 279 Cb -0.02 -3.54 0.02 0.00 -1.78 0.00 0.00 34.13 28.82 1b4v s GLU 279 CO 0.09 -0.01 -0.12 0.42 -0.49 0.00 0.00 175.26 175.15 1b4v s ILE 280 N 1.24 1.38 0.24 -1.63 1.01 -0.53 -4.54 121.20 118.37 1b4v s ILE 280 Ca 0.07 -0.52 0.08 0.00 0.00 0.00 0.00 60.65 60.28 1b4v s ILE 280 Cb -0.14 -1.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.97 1b4v s ILE 280 CO 0.06 0.43 0.10 -0.94 0.00 0.00 0.00 174.94 174.58 1b4v s SER 281 N 1.46 5.09 0.30 3.58 1.04 0.63 -0.19 113.70 125.61 1b4v s SER 281 Ca 0.03 -0.40 -0.17 0.00 0.48 0.00 0.00 55.95 55.89 1b4v s SER 281 Cb -0.13 -1.16 0.02 0.00 0.10 0.00 0.00 66.02 64.85 1b4v s SER 281 CO -0.08 -0.00 0.68 0.00 0.98 0.00 0.00 173.24 174.81 1b4v n ARG 283 N -0.47 0.61 -4.81 0.00 0.63 -0.19 -1.49 116.66 110.95 1b4v n ARG 283 Ca -0.04 0.38 -0.33 0.00 -0.92 0.00 0.00 57.85 56.94 1b4v n ARG 283 Cb 0.60 -1.64 -0.14 0.00 0.45 0.00 0.00 32.46 31.72 1b4v n ARG 283 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 1b4v s TYR 284 N -2.46 2.79 -0.17 -0.14 1.51 -0.46 -4.62 117.35 113.80 1b4v s TYR 284 Ca -0.31 -0.64 0.01 0.00 -1.01 0.00 0.00 57.07 55.12 1b4v s TYR 284 Cb 0.09 -1.82 0.02 0.00 -0.11 0.00 0.00 41.96 40.14 1b4v s TYR 284 CO 0.59 -0.20 -0.19 -1.17 -1.11 0.00 0.00 175.55 173.47 1b4v s LEU 285 N 0.29 2.04 -0.16 -1.29 2.96 -0.54 -1.53 118.68 120.44 1b4v s LEU 285 Ca -0.10 -0.62 -0.01 0.00 -0.22 0.00 0.00 54.13 53.18 1b4v s LEU 285 Cb -0.16 -1.42 -0.01 0.00 0.50 0.00 0.00 46.19 45.10 1b4v s LEU 285 CO 0.06 -0.01 -0.10 -0.36 -1.32 0.00 0.00 176.35 174.61 1b4v s PHE 286 N 1.31 2.87 -0.27 5.38 0.08 -0.08 -0.51 117.98 126.76 1b4v s PHE 286 Ca 0.05 -0.79 -0.12 0.00 0.12 0.00 0.00 56.93 56.19 1b4v s PHE 286 Cb -0.13 -1.94 -0.05 0.00 -0.57 0.00 0.00 43.02 40.34 1b4v s PHE 286 CO -0.12 -0.35 0.22 -0.51 -0.10 0.00 0.00 175.22 174.36 1b4v s LEU 287 N 0.77 4.05 -0.17 -0.37 1.02 0.12 -0.70 118.68 123.40 1b4v s LEU 287 Ca -0.04 0.08 0.21 0.00 0.02 0.00 0.00 54.13 54.40 1b4v s LEU 287 Cb -0.15 -2.18 0.47 0.00 0.02 0.00 0.00 46.19 44.35 1b4v s LEU 287 CO 0.01 -0.04 1.15 0.61 0.02 0.00 0.00 176.35 178.10 1b4v n GLY 288 N 4.78 2.28 0.24 -3.19 0.00 0.93 -1.07 105.19 109.16 1b4v n GLY 288 Ca -0.13 -1.18 0.02 0.00 0.00 0.00 0.00 46.02 44.73 1b4v n GLY 288 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4v n ALA 289 N -0.27 2.49 0.00 4.61 0.00 -0.99 -4.14 120.51 122.22 1b4v n ALA 289 Ca 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1b4v n ALA 289 Cb 0.93 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.39 1b4v n ALA 289 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b4v n GLY 290 N 0.67 -1.10 0.30 0.00 0.00 -1.26 -2.32 105.19 101.47 1b4v n GLY 290 Ca 0.04 -1.63 0.07 0.00 0.00 0.00 0.00 46.02 44.50 1b4v n GLY 290 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1b4v h SER 291 N 0.00 0.43 0.00 1.61 0.87 -1.84 0.11 113.55 114.74 1b4v h SER 291 Ca 0.00 0.10 -0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1b4v h SER 291 Cb 0.00 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.00 1b4v h SER 291 CO 0.00 0.17 -0.01 -0.07 -0.53 0.00 0.00 176.83 176.39 1b4v h LEU 292 N 0.55 0.01 -0.20 2.23 3.38 -1.86 -3.24 115.31 116.17 1b4v h LEU 292 Ca 0.45 -0.87 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 1b4v h LEU 292 Cb 0.66 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.40 1b4v h LEU 292 CO -0.38 0.88 0.06 1.23 0.09 0.00 0.00 178.44 180.32 1b4v h GLY 293 N -0.87 0.34 1.00 0.83 0.00 -1.23 -1.48 103.07 101.66 1b4v h GLY 293 Ca -0.00 -0.21 -0.10 0.00 0.00 0.00 0.00 47.33 47.02 1b4v h GLY 293 CO 0.00 0.19 -0.14 1.76 0.00 0.00 0.00 176.54 178.35 1b4v h SER 294 N 0.15 0.81 -0.58 0.19 0.02 -1.04 -2.27 113.55 110.84 1b4v h SER 294 Ca 0.06 -0.38 -0.05 0.00 -0.84 0.00 0.00 61.79 60.59 1b4v h SER 294 Cb 0.25 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.54 1b4v h SER 294 CO -0.00 1.01 0.19 0.74 -1.14 0.00 0.00 176.83 177.63 1b4v h THR 295 N 0.61 1.24 -0.65 -2.27 2.02 -1.58 -2.19 112.91 110.09 1b4v h THR 295 Ca 0.09 -0.80 -0.02 0.00 0.77 0.00 0.00 66.41 66.45 1b4v h THR 295 Cb 0.68 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 67.73 1b4v h THR 295 CO 0.05 0.30 0.32 -0.08 0.37 0.00 0.00 175.52 176.48 1b4v h GLU 296 N 0.82 0.93 -0.76 6.66 4.81 -1.21 -0.07 114.58 125.76 1b4v h GLU 296 Ca 0.19 -0.13 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1b4v h GLU 296 Cb 0.28 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 1b4v h GLU 296 CO -0.01 0.73 0.47 -0.07 -0.73 0.00 0.00 179.01 179.40 1b4v h LEU 297 N 0.89 0.90 -0.08 1.64 3.38 -1.17 -1.29 115.31 119.59 1b4v h LEU 297 Ca 0.22 -0.06 -0.20 0.00 0.09 0.00 0.00 57.88 57.94 1b4v h LEU 297 Cb 0.10 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.64 1b4v h LEU 297 CO -0.03 0.69 -0.74 -0.07 0.09 0.00 0.00 178.44 178.38 1b4v h LEU 298 N 1.03 0.79 -1.00 1.67 3.38 -1.08 -1.14 115.31 118.96 1b4v h LEU 298 Ca 0.27 -0.68 -0.07 0.00 0.09 0.00 0.00 57.88 57.49 1b4v h LEU 298 Cb -0.05 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1b4v h LEU 298 CO -0.05 1.35 -0.08 0.58 0.09 0.00 0.00 178.44 180.33 1b4v h VAL 299 N 0.29 1.24 -0.07 1.22 2.07 -0.98 -0.56 116.25 119.46 1b4v h VAL 299 Ca -0.07 -1.03 -0.01 0.00 0.82 0.00 0.00 66.70 66.41 1b4v h VAL 299 Cb 1.40 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 32.20 1b4v h VAL 299 CO 0.15 0.35 0.01 -0.09 0.02 0.00 0.00 177.57 178.00 1b4v h ARG 300 N 0.59 0.12 -0.80 1.57 2.43 -1.21 -1.50 114.38 115.57 1b4v h ARG 300 Ca 0.11 -0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.29 1b4v h ARG 300 Cb 0.49 -0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 29.97 1b4v h ARG 300 CO 0.03 0.36 0.50 0.00 -1.51 0.00 0.00 179.97 179.35 1b4v h ALA 301 N 0.75 1.07 0.43 2.80 0.00 -0.95 -0.21 119.26 123.14 1b4v h ALA 301 Ca 0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1b4v h ALA 301 Cb 0.30 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1b4v h ALA 301 CO 0.00 0.29 -0.20 -0.09 0.00 0.00 0.00 179.25 179.25 1b4v h ARG 302 N 0.96 -0.55 0.00 0.00 2.43 -1.03 -0.36 114.38 115.83 1b4v h ARG 302 Ca 0.33 0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.50 1b4v h ARG 302 Cb 0.07 0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1b4v h ARG 302 CO -0.13 -0.25 -0.16 -0.44 -1.51 0.00 0.00 179.97 177.47 1b4v h ASP 303 N -0.83 0.00 -0.01 -3.80 5.19 -1.15 -2.48 116.42 113.35 1b4v h ASP 303 Ca -0.06 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.35 1b4v h ASP 303 Cb 0.55 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.06 1b4v h ASP 303 CO 0.10 0.16 -0.04 0.35 -3.12 0.00 0.00 179.24 176.69 1b4v n THR 304 N -3.44 0.00 -0.95 0.35 -2.24 -0.10 -4.98 114.28 102.92 1b4v n THR 304 Ca -0.01 -0.36 0.00 0.00 -2.27 0.00 0.00 64.05 61.42 1b4v n THR 304 Cb 0.34 0.99 0.00 0.00 -2.10 0.00 0.00 70.33 69.57 1b4v n THR 304 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b4v n GLY 305 N 1.28 0.50 0.17 3.38 0.00 -0.93 -4.93 105.19 104.66 1b4v n GLY 305 Ca 0.16 -0.18 0.10 0.00 0.00 0.00 0.00 46.02 46.10 1b4v n GLY 305 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1b4v h THR 306 N 0.00 0.12 -2.01 2.61 1.35 -1.36 -3.36 112.91 110.27 1b4v h THR 306 Ca 0.00 -1.18 -0.54 0.00 -0.55 0.00 0.00 66.41 64.14 1b4v h THR 306 Cb 0.00 1.88 -0.39 0.00 -1.73 0.00 0.00 68.15 67.91 1b4v h THR 306 CO 0.00 0.07 -1.11 0.18 -0.25 0.00 0.00 175.52 174.40 1b4v n LEU 307 N -2.96 0.44 0.30 3.87 4.77 -0.53 -3.58 117.00 119.30 1b4v n LEU 307 Ca 0.02 -4.79 0.20 0.00 -0.03 0.00 0.00 56.01 51.41 1b4v n LEU 307 Cb 0.58 0.62 1.05 0.00 -2.33 0.00 0.00 43.42 43.33 1b4v n LEU 307 CO 0.37 2.12 1.10 1.55 -1.33 0.00 0.00 177.39 181.20 1b4v h PRO 308 N 3.77 0.00 -0.21 3.23 0.13 -1.76 -2.94 132.00 134.21 1b4v h PRO 308 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1b4v h PRO 308 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 1b4v h PRO 308 CO 0.48 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.34 1b4v n ASN 309 N -2.91 1.55 -4.77 1.44 3.02 -1.26 -4.90 115.26 107.44 1b4v n ASN 309 Ca -0.02 -1.80 -0.38 0.00 -0.03 0.00 0.00 54.58 52.35 1b4v n ASN 309 Cb 0.09 -0.14 -0.02 0.00 -0.61 0.00 0.00 39.78 39.10 1b4v n ASN 309 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1b4v s LEU 310 N -1.35 4.18 0.84 3.41 1.43 -1.11 -4.41 118.68 121.66 1b4v s LEU 310 Ca 0.28 2.32 -0.10 0.00 -1.03 0.00 0.00 54.13 55.60 1b4v s LEU 310 Cb 0.15 -4.04 0.14 0.00 0.03 0.00 0.00 46.19 42.46 1b4v s LEU 310 CO 0.21 -0.67 1.17 0.54 0.23 0.00 0.00 176.35 177.83 1b4v s ASN 311 N -1.18 3.90 0.19 2.29 2.20 -1.26 -4.98 114.94 116.11 1b4v s ASN 311 Ca 0.57 0.21 0.23 0.00 -0.94 0.00 0.00 52.86 52.93 1b4v s ASN 311 Cb -0.30 -0.50 0.90 0.00 -2.00 0.00 0.00 41.25 39.35 1b4v s ASN 311 CO 0.38 -2.21 1.69 -1.54 -2.94 0.00 0.00 177.10 172.47 1b4v n SER 312 N -3.32 0.54 0.24 3.54 3.41 -1.26 -2.73 113.62 114.04 1b4v n SER 312 Ca 0.13 0.62 0.14 0.00 -0.26 0.00 0.00 58.87 59.49 1b4v n SER 312 Cb 0.60 -0.74 0.40 0.00 -0.26 0.00 0.00 64.21 64.21 1b4v n SER 312 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1b4v h GLU 313 N 0.00 0.00 -6.34 4.33 4.39 -1.94 -3.43 114.58 111.60 1b4v h GLU 313 Ca 0.00 0.00 -0.54 0.00 0.34 0.00 0.00 59.36 59.16 1b4v h GLU 313 Cb 0.40 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.06 1b4v h GLU 313 CO 0.00 0.03 1.14 0.08 -1.16 0.00 0.00 179.01 179.10 1b4v s VAL 314 N -3.42 3.23 0.00 3.13 1.01 -1.10 -1.58 120.40 121.66 1b4v s VAL 314 Ca 0.04 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.38 1b4v s VAL 314 Cb 0.07 -3.23 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1b4v s VAL 314 CO 0.62 -0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.30 1b4v n GLY 315 N 4.30 3.10 3.97 4.51 0.00 0.25 -4.90 105.19 116.42 1b4v n GLY 315 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.97 1b4v n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4v s ALA 316 N -2.74 3.63 -0.91 4.61 0.00 -0.62 -0.52 121.76 125.21 1b4v s ALA 316 Ca 0.00 -1.39 -0.00 0.00 0.00 0.00 0.00 51.96 50.57 1b4v s ALA 316 Cb 0.00 -2.18 0.00 0.00 0.00 0.00 0.00 23.12 20.94 1b4v s ALA 316 CO 0.00 -1.17 0.02 0.41 0.00 0.00 0.00 175.76 175.02 1b4v n GLY 317 N -2.68 -0.06 3.80 0.00 0.00 -1.20 -2.08 105.19 102.96 1b4v n GLY 317 Ca 0.11 -0.43 -0.39 0.00 0.00 0.00 0.00 46.02 45.31 1b4v n GLY 317 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1b4v s TRP 318 N -2.55 3.83 -0.04 1.61 -0.00 -0.58 -3.67 118.94 117.53 1b4v s TRP 318 Ca 0.01 1.40 -0.12 0.00 -0.00 0.00 0.00 56.10 57.39 1b4v s TRP 318 Cb -0.00 -2.59 0.02 0.00 -0.00 0.00 0.00 33.47 30.89 1b4v s TRP 318 CO 0.01 0.54 0.27 0.20 -0.00 0.00 0.00 176.95 177.98 1b4v s GLY 319 N -1.18 -0.14 -0.10 5.86 0.00 0.53 -0.04 107.32 112.26 1b4v s GLY 319 Ca 0.32 0.41 0.02 0.00 0.00 0.00 0.00 44.72 45.47 1b4v s GLY 319 CO 0.22 0.24 1.08 -1.55 0.00 0.00 0.00 173.10 173.09 1b4v n PRO 320 N 1.84 1.59 -2.63 2.90 -0.04 -1.26 -1.37 135.00 136.03 1b4v n PRO 320 Ca -0.19 -0.80 -0.18 0.00 -0.04 0.00 0.00 63.50 62.29 1b4v n PRO 320 Cb 0.57 -1.46 -0.00 0.00 -0.04 0.00 0.00 33.50 32.57 1b4v n PRO 320 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1b4v n ASN 321 N 0.11 -4.92 -2.11 3.54 5.15 -0.99 -1.58 115.26 114.46 1b4v n ASN 321 Ca 0.12 -0.02 -0.18 0.00 -0.60 0.00 0.00 54.58 53.90 1b4v n ASN 321 Cb 0.69 -4.09 -0.03 0.00 -0.53 0.00 0.00 39.78 35.81 1b4v n ASN 321 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1b4v n GLY 322 N -1.04 0.27 3.68 8.20 0.00 -1.26 -3.82 105.19 111.23 1b4v n GLY 322 Ca -0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 1b4v n GLY 322 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1b4v s ASN 323 N -2.22 6.47 -0.07 1.61 0.02 -0.61 -2.14 114.94 118.00 1b4v s ASN 323 Ca 0.00 2.66 -0.05 0.00 -1.02 0.00 0.00 52.86 54.45 1b4v s ASN 323 Cb 0.00 -2.55 0.03 0.00 0.02 0.00 0.00 41.25 38.75 1b4v s ASN 323 CO 0.00 -1.00 0.18 -0.63 0.02 0.00 0.00 177.10 175.67 1b4v s ILE 324 N 3.45 -0.03 -0.08 0.60 -1.09 -0.58 -4.85 121.20 118.63 1b4v s ILE 324 Ca 0.82 0.10 0.01 0.00 -2.23 0.00 0.00 60.65 59.35 1b4v s ILE 324 Cb -0.43 -0.28 -0.03 0.00 -1.58 0.00 0.00 42.46 40.15 1b4v s ILE 324 CO 0.37 0.04 -0.10 -0.32 -1.23 0.00 0.00 174.94 173.70 1b4v s MET 325 N 0.75 2.89 0.21 2.79 1.75 -1.05 -0.05 119.30 126.58 1b4v s MET 325 Ca -0.05 -0.62 -0.08 0.00 -1.25 0.00 0.00 55.69 53.69 1b4v s MET 325 Cb -0.07 -2.57 -0.02 0.00 2.84 0.00 0.00 34.83 35.02 1b4v s MET 325 CO -0.04 0.52 0.32 -0.08 -0.65 0.00 0.00 175.02 175.09 1b4v s THR 326 N -0.44 0.02 -0.02 10.11 -1.32 -0.84 -0.32 115.64 122.82 1b4v s THR 326 Ca 0.06 -1.57 -0.11 0.00 -1.21 0.00 0.00 61.69 58.86 1b4v s THR 326 Cb -0.12 -2.18 0.02 0.00 -1.51 0.00 0.00 72.50 68.70 1b4v s THR 326 CO 0.02 -0.09 0.24 0.00 -2.21 0.00 0.00 174.62 172.58 1b4v s ALA 327 N -4.04 -0.59 -0.00 11.08 0.00 -1.26 -1.25 121.76 125.69 1b4v s ALA 327 Ca 0.26 0.24 0.08 0.00 0.00 0.00 0.00 51.96 52.53 1b4v s ALA 327 Cb 0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 1b4v s ALA 327 CO 0.07 -0.21 -0.24 1.03 0.00 0.00 0.00 175.76 176.41 1b4v s ARG 328 N -1.05 2.09 -0.25 0.00 0.52 -0.26 -1.65 118.95 118.35 1b4v s ARG 328 Ca -0.11 -0.94 -0.20 0.00 -0.52 0.00 0.00 55.73 53.95 1b4v s ARG 328 Cb -0.05 -2.09 -0.02 0.00 0.52 0.00 0.00 34.95 33.31 1b4v s ARG 328 CO 0.03 0.56 0.64 0.00 0.02 0.00 0.00 175.30 176.54 1b4v s ALA 329 N -0.71 3.60 0.59 2.13 0.00 -0.32 -1.38 121.76 125.67 1b4v s ALA 329 Ca 0.11 -0.40 -0.11 0.00 0.00 0.00 0.00 51.96 51.56 1b4v s ALA 329 Cb -0.10 -3.03 -0.04 0.00 0.00 0.00 0.00 23.12 19.94 1b4v s ALA 329 CO 0.01 -0.77 1.00 -0.80 0.00 0.00 0.00 175.76 175.19 1b4v s ASN 330 N 1.42 6.28 0.76 0.00 -0.87 0.27 -4.23 114.94 118.57 1b4v s ASN 330 Ca 0.27 1.39 -0.12 0.00 -1.57 0.00 0.00 52.86 52.82 1b4v s ASN 330 Cb -0.16 -2.45 0.06 0.00 -0.02 0.00 0.00 41.25 38.68 1b4v s ASN 330 CO 0.09 -0.81 1.12 -1.00 -2.57 0.00 0.00 177.10 173.93 1b4v s HIS 331 N -3.08 2.36 0.48 2.20 3.76 -1.26 -4.90 115.29 114.85 1b4v s HIS 331 Ca 0.55 1.60 0.16 0.00 -0.15 0.00 0.00 55.06 57.22 1b4v s HIS 331 Cb -0.11 -3.18 1.16 0.00 1.11 0.00 0.00 32.58 31.56 1b4v s HIS 331 CO 0.51 -2.04 2.05 0.52 -0.85 0.00 0.00 174.74 174.93 1b4v h MET 332 N -0.86 0.20 -0.00 1.40 2.86 -1.98 -0.40 114.93 116.15 1b4v h MET 332 Ca -0.45 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.18 1b4v h MET 332 Cb 1.25 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.86 1b4v h MET 332 CO 0.50 0.13 0.00 -2.67 1.06 0.00 0.00 176.91 175.93 1b4v n TRP 333 N -4.47 0.00 -2.97 -0.22 2.14 -1.26 -4.04 117.44 106.61 1b4v n TRP 333 Ca 0.04 -0.00 -0.25 0.00 2.07 0.00 0.00 57.50 59.36 1b4v n TRP 333 Cb 0.27 0.00 -0.04 0.00 -0.81 0.00 0.00 31.31 30.74 1b4v n TRP 333 CO 0.00 0.00 0.00 0.09 2.07 0.00 0.00 177.69 179.85 1b4v n ASN 334 N -0.80 3.72 -4.77 -0.67 3.02 -0.16 -5.09 115.26 110.51 1b4v n ASN 334 Ca 0.15 -3.54 -0.40 0.00 -0.03 0.00 0.00 54.58 50.77 1b4v n ASN 334 Cb 0.08 -0.57 -0.00 0.00 -0.61 0.00 0.00 39.78 38.67 1b4v n ASN 334 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1b4v s PRO 335 N -3.26 3.98 0.03 3.52 0.04 -1.26 -4.65 135.00 133.40 1b4v s PRO 335 Ca 0.47 2.18 0.25 0.00 0.04 0.00 0.00 61.00 63.94 1b4v s PRO 335 Cb 0.30 -2.78 0.49 0.00 0.04 0.00 0.00 34.50 32.55 1b4v s PRO 335 CO -0.13 -0.49 1.40 0.25 0.04 0.00 0.00 177.00 178.07 1b4v n THR 336 N 0.16 0.09 0.00 1.26 -2.24 -1.26 -4.84 114.28 107.45 1b4v n THR 336 Ca 0.03 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1b4v n THR 336 Cb 0.43 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 1b4v n THR 336 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b4v n GLY 337 N 1.46 2.15 0.14 3.38 0.00 -1.26 -2.20 105.19 108.86 1b4v n GLY 337 Ca 0.05 -1.70 0.05 0.00 0.00 0.00 0.00 46.02 44.41 1b4v n GLY 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4v h ALA 338 N 0.00 0.70 -2.92 4.61 0.00 -1.87 -3.42 119.26 116.35 1b4v h ALA 338 Ca 0.00 -0.41 -0.71 0.00 0.00 0.00 0.00 54.91 53.79 1b4v h ALA 338 Cb 0.00 0.04 -0.28 0.00 0.00 0.00 0.00 17.79 17.54 1b4v h ALA 338 CO 0.00 0.50 -0.51 -1.01 0.00 0.00 0.00 179.25 178.23 1b4v s HIS 339 N -3.05 3.33 -0.12 0.00 3.76 -1.26 -3.82 115.29 114.13 1b4v s HIS 339 Ca 0.02 -1.55 0.00 0.00 -0.15 0.00 0.00 55.06 53.39 1b4v s HIS 339 Cb 0.08 -2.77 0.02 0.00 1.11 0.00 0.00 32.58 31.02 1b4v s HIS 339 CO 0.76 -0.82 -0.11 -0.65 -0.85 0.00 0.00 174.74 173.07 1b4v s GLN 340 N 1.40 1.87 0.28 1.40 -0.21 -1.26 -3.92 119.66 119.22 1b4v s GLN 340 Ca 0.02 -0.40 -0.30 0.00 0.02 0.00 0.00 55.36 54.69 1b4v s GLN 340 Cb -0.22 -1.77 -0.12 0.00 1.00 0.00 0.00 33.01 31.90 1b4v s GLN 340 CO 0.02 -0.20 1.49 0.45 -2.12 0.00 0.00 175.29 174.93 1b4v n SER 341 N 4.68 3.29 0.09 5.90 2.88 -0.34 -4.83 113.62 125.29 1b4v n SER 341 Ca -0.16 1.15 0.11 0.00 -1.33 0.00 0.00 58.87 58.64 1b4v n SER 341 Cb 0.50 -1.51 0.44 0.00 -0.75 0.00 0.00 64.21 62.89 1b4v n SER 341 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1b4v n SER 342 N 2.01 0.49 -4.55 -3.46 7.64 -0.15 -4.58 113.62 111.02 1b4v n SER 342 Ca 0.09 0.62 -0.39 0.00 1.01 0.00 0.00 58.87 60.20 1b4v n SER 342 Cb 0.34 -0.72 -0.11 0.00 -1.01 0.00 0.00 64.21 62.71 1b4v n SER 342 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1b4v s ILE 343 N -3.23 5.19 0.58 0.44 -1.09 -1.26 -4.86 121.20 116.98 1b4v s ILE 343 Ca 0.05 -0.03 -0.19 0.00 -2.23 0.00 0.00 60.65 58.25 1b4v s ILE 343 Cb 0.09 -3.55 -0.04 0.00 -1.58 0.00 0.00 42.46 37.38 1b4v s ILE 343 CO 0.36 0.15 1.19 -2.84 -1.23 0.00 0.00 174.94 172.57 1b4v s PRO 344 N 1.73 3.05 0.00 2.79 0.02 -1.26 -4.94 135.00 136.38 1b4v s PRO 344 Ca 0.06 1.76 0.00 0.00 0.02 0.00 0.00 61.00 62.85 1b4v s PRO 344 Cb -0.17 -1.95 0.00 0.00 0.02 0.00 0.00 34.50 32.41 1b4v s PRO 344 CO 0.10 -1.13 0.00 0.00 -0.33 0.00 0.00 177.00 175.64 1b4v n ALA 345 N -1.56 0.74 -2.69 -1.55 0.00 -1.26 -4.91 120.51 109.28 1b4v n ALA 345 Ca 0.13 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.40 1b4v n ALA 345 Cb 0.50 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.83 1b4v n ALA 345 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1b4v s LEU 346 N -0.82 2.30 0.04 0.00 2.96 -1.26 -1.00 118.68 120.91 1b4v s LEU 346 Ca 0.00 -0.65 -0.08 0.00 -0.22 0.00 0.00 54.13 53.18 1b4v s LEU 346 Cb 0.00 -0.43 -0.00 0.00 0.50 0.00 0.00 46.19 46.26 1b4v s LEU 346 CO 0.00 -0.13 0.17 -0.83 -1.32 0.00 0.00 176.35 174.24 1b4v s GLY 347 N -1.86 0.08 -0.26 7.98 0.00 -0.50 -2.11 107.32 110.65 1b4v s GLY 347 Ca -0.02 -0.39 -0.15 0.00 0.00 0.00 0.00 44.72 44.16 1b4v s GLY 347 CO 0.02 -0.56 0.40 -0.42 0.00 0.00 0.00 173.10 172.54 1b4v s ILE 348 N -2.71 5.16 -0.47 0.90 1.01 0.15 -0.75 121.20 124.49 1b4v s ILE 348 Ca -0.04 0.63 -0.14 0.00 0.00 0.00 0.00 60.65 61.10 1b4v s ILE 348 Cb -0.00 -3.72 0.09 0.00 0.01 0.00 0.00 42.46 38.83 1b4v s ILE 348 CO -0.05 0.16 0.38 -0.62 0.00 0.00 0.00 174.94 174.81 1b4v s ASP 349 N 1.55 6.02 -0.23 3.58 3.68 -1.15 -1.03 116.67 129.09 1b4v s ASP 349 Ca 0.16 -1.48 0.16 0.00 2.13 0.00 0.00 52.55 53.53 1b4v s ASP 349 Cb -0.16 -2.14 0.47 0.00 -1.45 0.00 0.00 42.92 39.65 1b4v s ASP 349 CO 0.09 -0.66 1.16 0.00 0.13 0.00 0.00 175.17 175.89 1b4v n ALA 350 N 5.13 3.53 -2.86 3.66 0.00 -0.02 -4.68 120.51 125.27 1b4v n ALA 350 Ca -0.12 -3.13 -0.39 0.00 0.00 0.00 0.00 53.44 49.80 1b4v n ALA 350 Cb 0.43 -0.60 -0.12 0.00 0.00 0.00 0.00 19.45 19.16 1b4v n ALA 350 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1b4v s TRP 351 N -3.14 3.19 -0.04 0.00 -0.11 -1.09 -1.76 118.94 115.99 1b4v s TRP 351 Ca 0.38 -0.68 0.06 0.00 1.22 0.00 0.00 56.10 57.08 1b4v s TRP 351 Cb 0.37 -2.37 0.09 0.00 -1.50 0.00 0.00 33.47 30.06 1b4v s TRP 351 CO -0.03 -0.51 0.99 -0.40 -4.62 0.00 0.00 176.95 172.38 1b4v n ASP 352 N 4.98 1.73 0.00 5.86 5.75 -1.26 -4.96 116.55 128.65 1b4v n ASP 352 Ca -0.13 -2.23 0.00 0.00 -0.01 0.00 0.00 54.79 52.41 1b4v n ASP 352 Cb 0.48 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 1b4v n ASP 352 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1b4v n ASN 353 N -0.71 0.00 -4.36 -1.12 5.03 -1.26 -5.03 115.26 107.81 1b4v n ASN 353 Ca 0.05 0.00 -0.30 0.00 0.87 0.00 0.00 54.58 55.21 1b4v n ASN 353 Cb 0.44 0.00 0.16 0.00 -1.02 0.00 0.00 39.78 39.36 1b4v n ASN 353 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1b4v s SER 354 N -3.66 3.52 0.61 6.41 1.04 -1.26 -4.93 113.70 115.43 1b4v s SER 354 Ca 0.00 0.43 0.39 0.00 0.48 0.00 0.00 55.95 57.25 1b4v s SER 354 Cb 0.00 -0.61 1.96 0.00 0.10 0.00 0.00 66.02 67.46 1b4v s SER 354 CO 0.00 -2.50 2.21 0.44 0.98 0.00 0.00 173.24 174.37 1b4v h ASP 355 N -1.48 0.00 -0.06 7.02 3.32 -1.96 -1.93 116.42 121.33 1b4v h ASP 355 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1b4v h ASP 355 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 1b4v h ASP 355 CO 0.47 0.01 0.00 -1.54 -1.72 0.00 0.00 179.24 176.46 1b4v n SER 356 N -3.15 1.67 -4.67 6.45 3.41 -1.26 -4.70 113.62 111.37 1b4v n SER 356 Ca -0.02 -1.59 -0.45 0.00 -0.26 0.00 0.00 58.87 56.55 1b4v n SER 356 Cb 0.17 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.06 1b4v n SER 356 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1b4v n SER 357 N 0.31 2.88 -3.71 4.04 7.64 -0.73 -4.92 113.62 119.13 1b4v n SER 357 Ca 0.18 1.13 -0.12 0.00 1.01 0.00 0.00 58.87 61.07 1b4v n SER 357 Cb 0.37 -1.44 -0.12 0.00 -1.01 0.00 0.00 64.21 62.01 1b4v n SER 357 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1b4v s VAL 358 N 0.11 -0.10 -0.27 0.44 1.01 -0.72 -3.83 120.40 117.04 1b4v s VAL 358 Ca 0.70 0.15 0.03 0.00 0.00 0.00 0.00 61.98 62.86 1b4v s VAL 358 Cb -0.65 -0.46 0.06 0.00 0.00 0.00 0.00 36.38 35.34 1b4v s VAL 358 CO 0.48 0.06 -0.09 0.12 0.00 0.00 0.00 175.10 175.66 1b4v s PHE 359 N 1.49 3.32 -0.18 5.22 5.36 -0.50 -0.84 117.98 131.85 1b4v s PHE 359 Ca -0.08 -2.39 -0.02 0.00 -0.96 0.00 0.00 56.93 53.48 1b4v s PHE 359 Cb -0.10 -2.02 -0.01 0.00 -0.34 0.00 0.00 43.02 40.55 1b4v s PHE 359 CO -0.10 -0.89 -0.09 0.00 -1.46 0.00 0.00 175.22 172.69 1b4v s ALA 360 N 1.08 2.70 0.02 11.12 0.00 -0.20 -0.78 121.76 135.71 1b4v s ALA 360 Ca -0.07 -1.05 -0.30 0.00 0.00 0.00 0.00 51.96 50.54 1b4v s ALA 360 Cb -0.20 -1.46 -0.04 0.00 0.00 0.00 0.00 23.12 21.43 1b4v s ALA 360 CO -0.05 -0.14 1.02 -2.00 0.00 0.00 0.00 175.76 174.59 1b4v s GLU 361 N 0.98 4.55 -0.67 0.00 2.12 -0.31 0.32 118.70 125.69 1b4v s GLU 361 Ca -0.01 1.49 -0.25 0.00 0.36 0.00 0.00 54.97 56.56 1b4v s GLU 361 Cb -0.15 -3.43 0.05 0.00 0.26 0.00 0.00 34.13 30.86 1b4v s GLU 361 CO -0.01 -0.07 1.09 0.42 -0.54 0.00 0.00 175.26 176.16 1b4v s ILE 362 N 0.93 4.09 0.05 -3.70 1.01 -0.90 -1.55 121.20 121.13 1b4v s ILE 362 Ca 0.53 0.12 -0.26 0.00 0.00 0.00 0.00 60.65 61.04 1b4v s ILE 362 Cb -0.23 -4.75 -0.05 0.00 0.01 0.00 0.00 42.46 37.44 1b4v s ILE 362 CO 0.28 -1.54 0.80 0.00 0.00 0.00 0.00 174.94 174.48 1b4v s ALA 363 N 4.73 3.34 0.72 9.38 0.00 0.06 -4.65 121.76 135.35 1b4v s ALA 363 Ca 0.30 0.33 -0.11 0.00 0.00 0.00 0.00 51.96 52.48 1b4v s ALA 363 Cb -0.12 -3.05 0.02 0.00 0.00 0.00 0.00 23.12 19.97 1b4v s ALA 363 CO 0.15 0.03 1.08 -1.25 0.00 0.00 0.00 175.76 175.76 1b4v s PRO 364 N 0.04 2.75 -0.08 0.00 0.04 -1.26 -3.95 135.00 132.54 1b4v s PRO 364 Ca 0.40 0.71 0.03 0.00 0.04 0.00 0.00 61.00 62.19 1b4v s PRO 364 Cb -0.21 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.35 1b4v s PRO 364 CO 0.24 -1.17 -0.19 -1.64 0.04 0.00 0.00 177.00 174.28 1b4v s MET 365 N -5.17 2.42 0.00 4.56 -1.94 -1.26 -4.96 119.30 112.95 1b4v s MET 365 Ca 0.58 -0.68 0.28 0.00 -1.71 0.00 0.00 55.69 54.16 1b4v s MET 365 Cb -0.13 -1.89 1.52 0.00 2.01 0.00 0.00 34.83 36.34 1b4v s MET 365 CO 0.54 0.13 1.98 -0.35 -0.01 0.00 0.00 175.02 177.30 1b4v n PRO 366 N 3.61 0.62 -0.34 2.03 -0.04 -1.26 -4.49 135.00 135.13 1b4v n PRO 366 Ca -0.21 0.02 0.08 0.00 -0.04 0.00 0.00 63.50 63.35 1b4v n PRO 366 Cb 0.52 -1.50 0.17 0.00 -0.04 0.00 0.00 33.50 32.65 1b4v n PRO 366 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1b4v n ALA 367 N -1.15 0.29 -0.46 0.55 0.00 -1.26 -4.82 120.51 113.65 1b4v n ALA 367 Ca 0.17 1.03 0.00 0.00 0.00 0.00 0.00 53.44 54.64 1b4v n ALA 367 Cb 0.16 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 18.96 1b4v n ALA 367 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b4v n GLY 368 N -1.56 0.75 3.19 0.00 0.00 -1.25 -5.02 105.19 101.29 1b4v n GLY 368 Ca 0.17 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 1b4v n GLY 368 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1b4v s LEU 369 N 0.00 1.65 0.10 0.99 0.05 -1.25 -4.79 118.68 115.42 1b4v s LEU 369 Ca 0.00 -0.77 -0.31 0.00 0.05 0.00 0.00 54.13 53.10 1b4v s LEU 369 Cb 0.00 0.83 -0.08 0.00 -2.05 0.00 0.00 46.19 44.88 1b4v s LEU 369 CO 0.00 -0.71 1.55 -0.70 -0.55 0.00 0.00 176.35 175.93 1b4v s GLU 370 N -3.89 4.24 0.00 1.48 2.56 -1.26 -4.59 118.70 117.24 1b4v s GLU 370 Ca 0.07 2.25 0.00 0.00 0.00 0.00 0.00 54.97 57.29 1b4v s GLU 370 Cb 0.06 -3.39 0.00 0.00 2.00 0.00 0.00 34.13 32.79 1b4v s GLU 370 CO -0.09 -0.62 0.00 0.25 -0.56 0.00 0.00 175.26 174.24 1b4v n THR 371 N 4.34 0.00 -1.11 -1.70 -2.24 -1.26 -5.01 114.28 107.29 1b4v n THR 371 Ca 0.14 -0.29 -0.04 0.00 -2.27 0.00 0.00 64.05 61.59 1b4v n THR 371 Cb 0.41 0.90 -0.02 0.00 -2.10 0.00 0.00 70.33 69.52 1b4v n THR 371 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1b4v n TRP 372 N -0.75 0.00 -3.42 4.78 8.01 -1.26 -4.91 117.44 119.89 1b4v n TRP 372 Ca 0.00 0.00 -0.38 0.00 -1.31 0.00 0.00 57.50 55.81 1b4v n TRP 372 Cb 0.00 -2.00 -0.06 0.00 -2.01 0.00 0.00 31.31 27.24 1b4v n TRP 372 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.69 176.76 1b4v s VAL 373 N -1.49 5.13 -0.22 -0.99 1.01 -1.26 -0.57 120.40 122.01 1b4v s VAL 373 Ca 0.00 0.86 -0.06 0.00 0.00 0.00 0.00 61.98 62.78 1b4v s VAL 373 Cb 0.00 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 1b4v s VAL 373 CO 0.00 0.44 0.02 -0.44 0.00 0.00 0.00 175.10 175.11 1b4v s SER 374 N -0.09 4.81 -0.03 3.32 0.01 -0.48 -4.86 113.70 116.37 1b4v s SER 374 Ca 0.24 -0.25 -0.00 0.00 1.31 0.00 0.00 55.95 57.24 1b4v s SER 374 Cb -0.15 -1.84 -0.04 0.00 0.21 0.00 0.00 66.02 64.20 1b4v s SER 374 CO 0.11 0.00 0.03 -0.22 0.41 0.00 0.00 173.24 173.57 1b4v s LEU 375 N 1.37 3.66 -0.00 2.44 2.96 -1.25 -1.10 118.68 126.76 1b4v s LEU 375 Ca 0.05 0.10 0.01 0.00 -0.22 0.00 0.00 54.13 54.06 1b4v s LEU 375 Cb -0.15 -2.02 -0.00 0.00 0.50 0.00 0.00 46.19 44.52 1b4v s LEU 375 CO 0.01 0.31 -0.02 -0.31 -1.32 0.00 0.00 176.35 175.02 1b4v s TYR 376 N -1.05 0.22 -0.38 5.38 2.02 -0.38 -0.76 117.35 122.40 1b4v s TYR 376 Ca 0.18 -0.04 -0.03 0.00 -0.37 0.00 0.00 57.07 56.81 1b4v s TYR 376 Cb -0.12 -0.14 0.09 0.00 -0.40 0.00 0.00 41.96 41.39 1b4v s TYR 376 CO 0.08 -0.00 0.16 -1.17 -1.57 0.00 0.00 175.55 173.05 1b4v s LEU 377 N -0.05 4.93 0.10 -1.29 0.20 -0.59 -1.99 118.68 119.98 1b4v s LEU 377 Ca 0.01 -1.80 -0.23 0.00 0.69 0.00 0.00 54.13 52.79 1b4v s LEU 377 Cb -0.01 -1.82 -0.07 0.00 -0.43 0.00 0.00 46.19 43.86 1b4v s LEU 377 CO -0.00 -0.48 0.71 0.00 -0.29 0.00 0.00 176.35 176.29 1b4v s ALA 378 N 1.19 3.47 -0.22 5.97 0.00 0.92 -1.17 121.76 131.92 1b4v s ALA 378 Ca 0.05 0.23 -0.03 0.00 0.00 0.00 0.00 51.96 52.21 1b4v s ALA 378 Cb -0.22 -2.87 0.00 0.00 0.00 0.00 0.00 23.12 20.04 1b4v s ALA 378 CO -0.03 0.25 -0.06 0.42 0.00 0.00 0.00 175.76 176.33 1b4v s ILE 379 N -0.76 3.10 0.47 0.00 1.01 0.04 -1.52 121.20 123.55 1b4v s ILE 379 Ca 0.34 -0.69 0.03 0.00 0.00 0.00 0.00 60.65 60.34 1b4v s ILE 379 Cb -0.21 -2.45 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 1b4v s ILE 379 CO 0.23 0.37 0.01 0.42 0.00 0.00 0.00 174.94 175.96 1b4v s THR 380 N 1.42 1.46 -0.46 2.92 -4.23 -0.91 -1.41 115.64 114.43 1b4v s THR 380 Ca 0.04 -2.00 -0.05 0.00 -1.18 0.00 0.00 61.69 58.50 1b4v s THR 380 Cb -0.15 -2.46 0.12 0.00 1.34 0.00 0.00 72.50 71.35 1b4v s THR 380 CO -0.05 0.00 0.29 -0.75 -0.54 0.00 0.00 174.62 173.57 1b4v s LYS 381 N -3.82 2.25 -0.16 3.99 2.20 -1.25 -3.99 119.74 118.95 1b4v s LYS 381 Ca 0.16 -1.90 0.01 0.00 -0.36 0.00 0.00 55.97 53.88 1b4v s LYS 381 Cb 0.05 -3.73 0.02 0.00 -1.51 0.00 0.00 37.83 32.66 1b4v s LYS 381 CO 0.08 -1.13 -0.17 1.21 -0.36 0.00 0.00 175.35 174.98 1b4v s ASN 382 N 1.96 2.90 0.29 1.43 2.47 -1.26 -4.84 114.94 117.90 1b4v s ASN 382 Ca 0.09 -0.57 0.24 0.00 0.42 0.00 0.00 52.86 53.05 1b4v s ASN 382 Cb -0.23 -1.33 1.02 0.00 -1.45 0.00 0.00 41.25 39.26 1b4v s ASN 382 CO -0.03 -0.03 1.74 1.55 -3.72 0.00 0.00 177.10 176.61 1b4v h PRO 383 N 7.99 0.00 -6.81 0.43 0.13 -1.96 -3.46 132.00 128.32 1b4v h PRO 383 Ca -0.42 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.18 1b4v h PRO 383 Cb 1.14 0.00 0.08 0.00 0.13 0.00 0.00 31.00 32.35 1b4v h PRO 383 CO 0.58 0.00 0.89 -0.65 -0.23 0.00 0.00 178.00 178.60 1b4v s GLN 384 N -3.35 4.11 0.08 0.86 -1.52 -1.26 -5.01 119.66 113.57 1b4v s GLN 384 Ca 0.04 2.59 0.05 0.00 -1.95 0.00 0.00 55.36 56.10 1b4v s GLN 384 Cb 0.09 -3.02 -0.03 0.00 -0.22 0.00 0.00 33.01 29.83 1b4v s GLN 384 CO 0.40 -0.64 -0.14 1.03 -0.25 0.00 0.00 175.29 175.69 1b4v s ARG 385 N -0.54 0.87 0.41 2.91 1.81 -1.26 -4.77 118.95 118.38 1b4v s ARG 385 Ca 0.63 -1.03 0.07 0.00 -1.72 0.00 0.00 55.73 53.69 1b4v s ARG 385 Cb -0.48 -0.85 -0.05 0.00 -0.45 0.00 0.00 34.95 33.12 1b4v s ARG 385 CO 0.48 0.18 0.21 0.20 -0.68 0.00 0.00 175.30 175.70 1b4v s GLY 386 N -1.93 2.30 -0.03 -3.53 0.00 0.95 -4.88 107.32 100.20 1b4v s GLY 386 Ca 0.01 -2.07 0.02 0.00 0.00 0.00 0.00 44.72 42.68 1b4v s GLY 386 CO 0.02 -1.87 -0.08 -1.59 0.00 0.00 0.00 173.10 169.58 1b4v s THR 387 N -2.57 0.71 -0.30 0.90 2.01 -1.03 -1.53 115.64 113.82 1b4v s THR 387 Ca 0.42 -0.30 -0.23 0.00 0.31 0.00 0.00 61.69 61.89 1b4v s THR 387 Cb 0.03 -0.65 -0.00 0.00 0.01 0.00 0.00 72.50 71.89 1b4v s THR 387 CO 0.23 0.23 0.78 -0.36 -0.69 0.00 0.00 174.62 174.82 1b4v s PHE 388 N 0.33 3.21 -0.12 4.92 0.08 0.33 -0.22 117.98 126.50 1b4v s PHE 388 Ca -0.05 0.81 -0.00 0.00 0.12 0.00 0.00 56.93 57.81 1b4v s PHE 388 Cb -0.09 -3.20 -0.02 0.00 -0.57 0.00 0.00 43.02 39.14 1b4v s PHE 388 CO 0.01 -0.55 -0.10 0.14 -0.10 0.00 0.00 175.22 174.61 1b4v s VAL 389 N 2.93 3.34 0.05 -0.44 -7.23 0.10 -4.67 120.40 114.48 1b4v s VAL 389 Ca 0.32 -0.57 -0.30 0.00 -1.81 0.00 0.00 61.98 59.61 1b4v s VAL 389 Cb -0.14 -2.40 -0.05 0.00 0.56 0.00 0.00 36.38 34.35 1b4v s VAL 389 CO 0.12 0.53 1.12 -0.47 -0.31 0.00 0.00 175.10 176.09 1b4v s TYR 390 N 0.09 3.52 -0.43 2.82 5.04 -1.26 0.44 117.35 127.57 1b4v s TYR 390 Ca -0.04 1.45 -0.10 0.00 -2.44 0.00 0.00 57.07 55.94 1b4v s TYR 390 Cb -0.14 -3.31 0.09 0.00 0.35 0.00 0.00 41.96 38.94 1b4v s TYR 390 CO 0.04 -0.81 0.29 0.34 -1.34 0.00 0.00 175.55 174.06 1b4v s ASP 391 N 0.99 5.69 0.49 4.32 3.68 0.31 -4.92 116.67 127.23 1b4v s ASP 391 Ca 0.56 -1.56 0.21 0.00 2.13 0.00 0.00 52.55 53.89 1b4v s ASP 391 Cb -0.27 -2.01 1.24 0.00 -1.45 0.00 0.00 42.92 40.44 1b4v s ASP 391 CO 0.29 -0.57 2.04 0.00 0.13 0.00 0.00 175.17 177.06 1b4v h ALA 392 N 8.44 1.51 -0.06 3.66 0.00 -1.95 0.10 119.26 130.97 1b4v h ALA 392 Ca -0.23 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1b4v h ALA 392 Cb 1.08 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1b4v h ALA 392 CO 0.79 0.18 0.02 0.00 0.00 0.00 0.00 179.25 180.24 1b4v h ALA 393 N 1.85 0.08 -0.02 0.00 0.00 -1.95 -3.22 119.26 116.00 1b4v h ALA 393 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1b4v h ALA 393 Cb 0.31 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1b4v h ALA 393 CO 0.02 -0.33 -0.27 0.25 0.00 0.00 0.00 179.25 178.91 1b4v n THR 394 N -4.95 0.00 -3.54 0.00 -2.24 -1.16 -4.97 114.28 97.41 1b4v n THR 394 Ca -0.06 -0.35 -0.22 0.00 -2.27 0.00 0.00 64.05 61.15 1b4v n THR 394 Cb 0.11 1.31 0.08 0.00 -2.10 0.00 0.00 70.33 69.74 1b4v n THR 394 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1b4v n ASP 395 N 0.50 -5.16 -4.00 3.42 2.03 0.32 -5.01 116.55 108.65 1b4v n ASP 395 Ca 0.11 -0.56 -0.16 0.00 0.52 0.00 0.00 54.79 54.71 1b4v n ASP 395 Cb 0.51 -5.04 -0.14 0.00 -0.72 0.00 0.00 41.12 35.74 1b4v n ASP 395 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1b4v s ARG 396 N -6.04 0.51 0.01 -0.67 1.81 -1.00 -4.98 118.95 108.58 1b4v s ARG 396 Ca 0.42 -0.36 -0.29 0.00 -1.72 0.00 0.00 55.73 53.78 1b4v s ARG 396 Cb -0.19 -0.44 -0.04 0.00 -0.45 0.00 0.00 34.95 33.84 1b4v s ARG 396 CO 0.73 0.11 0.92 0.00 -0.68 0.00 0.00 175.30 176.38 1b4v s ALA 397 N -0.46 3.21 -0.12 2.13 0.00 -1.26 -0.53 121.76 124.73 1b4v s ALA 397 Ca -0.01 0.47 -0.02 0.00 0.00 0.00 0.00 51.96 52.40 1b4v s ALA 397 Cb -0.04 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 1b4v s ALA 397 CO -0.00 -0.17 -0.04 0.15 0.00 0.00 0.00 175.76 175.71 1b4v s LYS 398 N 0.77 3.34 -0.37 0.00 1.02 0.17 -4.89 119.74 119.78 1b4v s LYS 398 Ca 0.48 -0.51 -0.23 0.00 0.02 0.00 0.00 55.97 55.74 1b4v s LYS 398 Cb -0.21 -2.82 0.01 0.00 -0.52 0.00 0.00 37.83 34.30 1b4v s LYS 398 CO 0.27 0.42 0.77 -1.17 -0.92 0.00 0.00 175.35 174.72 1b4v s LEU 399 N -0.13 4.15 -0.96 3.17 2.96 -1.26 0.03 118.68 126.63 1b4v s LEU 399 Ca 0.03 0.31 -0.20 0.00 -0.22 0.00 0.00 54.13 54.05 1b4v s LEU 399 Cb -0.13 -3.00 0.11 0.00 0.50 0.00 0.00 46.19 43.67 1b4v s LEU 399 CO 0.02 -0.73 1.21 0.20 -1.32 0.00 0.00 176.35 175.73 1b4v s ASN 400 N 1.86 6.60 -0.06 3.68 -0.87 0.69 -4.50 114.94 122.33 1b4v s ASN 400 Ca 0.31 -1.89 -0.02 0.00 -1.57 0.00 0.00 52.86 49.68 1b4v s ASN 400 Cb -0.13 -2.44 0.04 0.00 -0.02 0.00 0.00 41.25 38.69 1b4v s ASN 400 CO 0.17 -1.18 0.13 0.86 -2.57 0.00 0.00 177.10 174.51 1b4v s TRP 401 N 3.29 -0.13 0.06 2.20 -0.11 -1.26 -2.48 118.94 120.51 1b4v s TRP 401 Ca 0.36 0.43 0.05 0.00 1.22 0.00 0.00 56.10 58.16 1b4v s TRP 401 Cb -0.03 -0.12 -0.04 0.00 -1.50 0.00 0.00 33.47 31.78 1b4v s TRP 401 CO -0.10 -0.16 -0.06 0.95 -4.62 0.00 0.00 176.95 172.97 1b4v s THR 402 N 1.21 3.66 0.36 5.86 -4.23 -1.26 -4.00 115.64 117.24 1b4v s THR 402 Ca -0.09 -1.00 0.11 0.00 -1.18 0.00 0.00 61.69 59.53 1b4v s THR 402 Cb -0.12 -2.68 0.33 0.00 1.34 0.00 0.00 72.50 71.38 1b4v s THR 402 CO -0.05 0.22 1.84 -0.09 -0.54 0.00 0.00 174.62 175.99 1b4v h ARG 403 N 3.90 0.61 0.00 3.99 2.43 -1.92 0.26 114.38 123.65 1b4v h ARG 403 Ca -0.48 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 1b4v h ARG 403 Cb 1.17 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 1b4v h ARG 403 CO 0.55 0.40 0.00 0.38 -1.51 0.00 0.00 179.97 179.79 1b4v h ASP 404 N 0.63 0.00 0.56 -3.80 2.03 -1.95 -1.52 116.42 112.37 1b4v h ASP 404 Ca 0.49 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.79 1b4v h ASP 404 Cb 0.91 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.41 1b4v h ASP 404 CO -0.24 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 177.97 1b4v n GLN 405 N -2.86 0.11 -0.17 4.15 6.02 0.08 -1.80 117.38 122.92 1b4v n GLN 405 Ca -0.01 0.38 0.11 0.00 -0.01 0.00 0.00 57.00 57.47 1b4v n GLN 405 Cb 0.16 -1.73 0.26 0.00 1.02 0.00 0.00 30.24 29.95 1b4v n GLN 405 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1b4v n ASN 406 N -1.94 2.98 -0.18 1.08 5.03 -0.57 -4.48 115.26 117.18 1b4v n ASN 406 Ca 0.02 -1.93 -0.02 0.00 0.87 0.00 0.00 54.58 53.53 1b4v n ASN 406 Cb 0.18 -0.22 0.08 0.00 -1.02 0.00 0.00 39.78 38.80 1b4v n ASN 406 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1b4v h ALA 407 N 4.36 0.68 -0.52 5.41 0.00 -1.50 -0.19 119.26 127.51 1b4v h ALA 407 Ca 0.00 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1b4v h ALA 407 Cb 0.84 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 1b4v h ALA 407 CO 0.00 -0.21 0.22 -1.35 0.00 0.00 0.00 179.25 177.91 1b4v h PRO 408 N 0.37 0.74 -0.24 0.00 0.11 -1.82 0.31 132.00 131.46 1b4v h PRO 408 Ca 0.27 -0.10 -0.03 0.00 0.11 0.00 0.00 66.00 66.25 1b4v h PRO 408 Cb 0.31 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.28 1b4v h PRO 408 CO -0.28 0.60 0.03 0.00 -0.21 0.00 0.00 178.00 178.14 1b4v h ALA 409 N 1.51 0.32 -0.58 -0.75 0.00 -1.54 -1.89 119.26 116.34 1b4v h ALA 409 Ca 0.18 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1b4v h ALA 409 Cb 0.13 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1b4v h ALA 409 CO -0.02 0.02 0.27 0.28 0.00 0.00 0.00 179.25 179.79 1b4v h VAL 410 N 0.20 1.21 -0.54 0.00 2.07 -0.74 -1.77 116.25 116.68 1b4v h VAL 410 Ca 0.07 -0.61 0.03 0.00 0.82 0.00 0.00 66.70 67.01 1b4v h VAL 410 Cb 0.35 0.55 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 1b4v h VAL 410 CO 0.01 0.24 0.31 0.78 0.02 0.00 0.00 177.57 178.93 1b4v h ASN 411 N 0.78 0.49 -0.27 0.57 -0.26 -0.81 0.15 115.58 116.24 1b4v h ASN 411 Ca 0.20 0.01 -0.06 0.00 -0.56 0.00 0.00 56.30 55.89 1b4v h ASN 411 Cb 0.14 -0.09 -0.01 0.00 -1.06 0.00 0.00 38.32 37.30 1b4v h ASN 411 CO -0.02 0.34 -0.06 0.00 -1.06 0.00 0.00 177.43 176.63 1b4v h ALA 412 N 1.26 0.38 -0.61 -0.83 0.00 -1.17 -1.28 119.26 117.01 1b4v h ALA 412 Ca 0.23 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1b4v h ALA 412 Cb 0.06 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1b4v h ALA 412 CO -0.12 0.18 0.27 0.00 0.00 0.00 0.00 179.25 179.58 1b4v h ALA 413 N 0.78 0.79 -0.44 0.00 0.00 -1.11 -2.57 119.26 116.71 1b4v h ALA 413 Ca 0.07 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1b4v h ALA 413 Cb 0.52 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1b4v h ALA 413 CO 0.03 0.38 0.10 -0.22 0.00 0.00 0.00 179.25 179.53 1b4v h LYS 414 N 0.84 0.72 -0.88 0.00 3.64 -0.62 -2.08 116.57 118.18 1b4v h LYS 414 Ca 0.21 -0.18 0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1b4v h LYS 414 Cb 0.16 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.83 1b4v h LYS 414 CO -0.02 0.72 0.56 0.00 -2.27 0.00 0.00 179.45 178.44 1b4v h ALA 415 N 0.96 1.19 0.46 5.00 0.00 -1.07 0.12 119.26 125.92 1b4v h ALA 415 Ca 0.14 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1b4v h ALA 415 Cb 0.33 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1b4v h ALA 415 CO 0.00 0.37 -0.22 1.25 0.00 0.00 0.00 179.25 180.66 1b4v h LEU 416 N 1.07 -0.52 -2.05 0.00 5.85 -1.27 -3.05 115.31 115.35 1b4v h LEU 416 Ca 0.37 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 1b4v h LEU 416 Cb 0.07 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 1b4v h LEU 416 CO -0.14 -0.16 -0.03 -0.26 -0.34 0.00 0.00 178.44 177.51 1b4v h PHE 417 N -0.94 0.00 -0.33 1.25 0.04 -1.28 -1.75 116.94 113.94 1b4v h PHE 417 Ca -0.06 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.60 1b4v h PHE 417 Cb 0.58 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.72 1b4v h PHE 417 CO 0.01 0.03 -0.22 -0.44 -0.60 0.00 0.00 178.31 177.09 1b4v h ASP 418 N 0.00 0.65 -0.69 2.17 3.45 -0.74 0.56 116.42 121.82 1b4v h ASP 418 Ca -0.00 -0.22 -0.07 0.00 0.43 0.00 0.00 57.03 57.17 1b4v h ASP 418 Cb 0.32 -0.18 -0.03 0.00 -0.56 0.00 0.00 39.33 38.88 1b4v h ASP 418 CO 0.00 0.87 0.17 0.03 -1.57 0.00 0.00 179.24 178.74 1b4v h ARG 419 N 0.57 1.10 -0.29 3.56 3.08 -1.21 0.11 114.38 121.31 1b4v h ARG 419 Ca 0.08 -0.26 -0.12 0.00 0.07 0.00 0.00 59.98 59.75 1b4v h ARG 419 Cb 0.69 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.59 1b4v h ARG 419 CO 0.05 0.98 -0.28 0.82 -1.07 0.00 0.00 179.97 180.47 1b4v h ILE 420 N 1.04 1.30 -0.73 2.04 2.04 -1.31 -2.02 117.51 119.86 1b4v h ILE 420 Ca 0.22 -1.44 -0.03 0.00 1.00 0.00 0.00 64.86 64.61 1b4v h ILE 420 Cb 0.36 1.58 -0.03 0.00 -0.74 0.00 0.00 36.82 37.99 1b4v h ILE 420 CO 0.00 0.46 0.35 0.78 0.00 0.00 0.00 178.15 179.74 1b4v h ASN 421 N 0.43 0.96 -0.47 1.72 2.35 -0.67 -2.16 115.58 117.74 1b4v h ASN 421 Ca 0.05 -0.13 -0.04 0.00 -0.55 0.00 0.00 56.30 55.62 1b4v h ASN 421 Cb 0.85 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.95 1b4v h ASN 421 CO 0.07 0.82 0.15 0.50 -1.65 0.00 0.00 177.43 177.32 1b4v h LYS 422 N 1.02 0.72 0.00 0.81 3.64 -0.71 0.39 116.57 122.44 1b4v h LYS 422 Ca 0.25 -0.15 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1b4v h LYS 422 Cb 0.12 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1b4v h LYS 422 CO -0.03 0.69 -0.23 0.00 -2.27 0.00 0.00 179.45 177.60 1b4v h ALA 423 N 1.00 1.18 -0.00 5.00 0.00 -1.18 -3.26 119.26 121.99 1b4v h ALA 423 Ca 0.15 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1b4v h ALA 423 Cb 0.26 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1b4v h ALA 423 CO -0.01 0.29 -0.33 0.09 0.00 0.00 0.00 179.25 179.29 1b4v n ASN 424 N -3.63 0.87 -1.33 0.00 3.02 -0.83 -4.92 115.26 108.44 1b4v n ASN 424 Ca -0.01 -0.94 -0.12 0.00 -0.03 0.00 0.00 54.58 53.49 1b4v n ASN 424 Cb 0.36 0.72 -0.01 0.00 -0.61 0.00 0.00 39.78 40.24 1b4v n ASN 424 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1b4v n GLY 425 N 1.06 -0.11 3.87 7.41 0.00 0.13 -5.02 105.19 112.52 1b4v n GLY 425 Ca 0.03 -0.40 -0.21 0.00 0.00 0.00 0.00 46.02 45.45 1b4v n GLY 425 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1b4v s THR 426 N -2.58 2.79 0.27 2.61 -4.23 -0.93 -5.05 115.64 108.53 1b4v s THR 426 Ca 0.00 -1.36 0.05 0.00 -1.18 0.00 0.00 61.69 59.19 1b4v s THR 426 Cb 0.00 -3.03 -0.06 0.00 1.34 0.00 0.00 72.50 70.76 1b4v s THR 426 CO 0.00 -0.03 -0.00 0.27 -0.54 0.00 0.00 174.62 174.31 1b4v s ILE 427 N -2.45 1.27 0.70 2.99 -4.36 -1.26 -4.66 121.20 113.43 1b4v s ILE 427 Ca 0.47 -2.05 -0.11 0.00 -0.26 0.00 0.00 60.65 58.69 1b4v s ILE 427 Cb -0.03 -2.50 0.01 0.00 1.25 0.00 0.00 42.46 41.19 1b4v s ILE 427 CO 0.27 -0.23 1.07 -0.31 0.24 0.00 0.00 174.94 175.99 1b4v s TYR 428 N -3.26 3.30 0.07 1.37 2.02 -1.26 -1.18 117.35 118.41 1b4v s TYR 428 Ca 0.31 1.17 -0.17 0.00 -0.37 0.00 0.00 57.07 58.02 1b4v s TYR 428 Cb 0.06 -2.96 -0.06 0.00 -0.40 0.00 0.00 41.96 38.59 1b4v s TYR 428 CO 0.11 -1.16 0.52 1.03 -1.57 0.00 0.00 175.55 174.49 1b4v s ARG 429 N -5.24 4.07 -0.04 -0.62 1.81 -0.66 -4.64 118.95 113.63 1b4v s ARG 429 Ca 0.58 0.59 0.06 0.00 -1.72 0.00 0.00 55.73 55.23 1b4v s ARG 429 Cb -0.12 -3.16 0.09 0.00 -0.45 0.00 0.00 34.95 31.31 1b4v s ARG 429 CO 0.53 0.62 1.00 0.66 -0.68 0.00 0.00 175.30 177.43 1b4v n TYR 430 N 1.52 0.00 -0.41 -0.53 4.02 -1.26 -4.25 117.16 116.25 1b4v n TYR 430 Ca -0.10 -0.58 0.00 0.00 -0.01 0.00 0.00 57.90 57.21 1b4v n TYR 430 Cb 0.51 -0.08 0.00 0.00 -0.02 0.00 0.00 39.34 39.76 1b4v n TYR 430 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 176.86 175.45 1b4v n ASP 431 N -0.72 1.28 0.16 7.72 5.75 -1.26 -2.94 116.55 126.54 1b4v n ASP 431 Ca 0.05 -1.68 0.05 0.00 -0.01 0.00 0.00 54.79 53.20 1b4v n ASP 431 Cb 0.42 -0.01 0.06 0.00 -1.03 0.00 0.00 41.12 40.55 1b4v n ASP 431 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1b4v h LEU 432 N 0.00 0.00 -0.90 -2.12 3.38 -1.85 -3.36 115.31 110.46 1b4v h LEU 432 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1b4v h LEU 432 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1b4v h LEU 432 CO 0.00 0.35 -0.28 0.49 0.09 0.00 0.00 178.44 179.09 1b4v n PHE 433 N -3.16 0.00 -3.23 1.13 3.01 -1.26 -4.26 117.46 109.69 1b4v n PHE 433 Ca 0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1b4v n PHE 433 Cb 0.68 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.15 1b4v n PHE 433 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1b4v n GLY 434 N 1.07 -0.47 1.19 1.37 0.00 -1.26 -4.96 105.19 102.13 1b4v n GLY 434 Ca 0.06 -1.30 0.11 0.00 0.00 0.00 0.00 46.02 44.89 1b4v n GLY 434 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1b4v n THR 435 N 9.00 0.80 0.33 2.61 -2.24 -1.26 -4.39 114.28 119.13 1b4v n THR 435 Ca 0.00 -0.84 0.07 0.00 -2.27 0.00 0.00 64.05 61.01 1b4v n THR 435 Cb 0.00 0.53 0.22 0.00 -2.10 0.00 0.00 70.33 68.98 1b4v n THR 435 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b4v n GLN 436 N 1.41 2.39 -3.44 -0.78 3.00 -1.26 -4.93 117.38 113.76 1b4v n GLN 436 Ca 0.21 -1.79 -0.24 0.00 -0.01 0.00 0.00 57.00 55.17 1b4v n GLN 436 Cb 0.56 -1.49 0.06 0.00 0.00 0.00 0.00 30.24 29.37 1b4v n GLN 436 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1b4v n LEU 437 N 0.81 -3.08 -4.69 1.08 4.32 -1.24 -4.97 117.00 109.22 1b4v n LEU 437 Ca 0.16 -0.48 -0.38 0.00 -0.02 0.00 0.00 56.01 55.29 1b4v n LEU 437 Cb 0.49 -2.97 -0.07 0.00 -1.62 0.00 0.00 43.42 39.26 1b4v n LEU 437 CO 0.13 0.50 0.17 -0.54 -1.22 0.00 0.00 177.39 176.44 1b4v s LYS 438 N -6.15 4.24 0.15 3.23 1.02 -1.15 -4.89 119.74 116.18 1b4v s LYS 438 Ca 0.51 0.36 0.23 0.00 0.02 0.00 0.00 55.97 57.09 1b4v s LYS 438 Cb -0.23 -3.51 0.08 0.00 -0.52 0.00 0.00 37.83 33.65 1b4v s LYS 438 CO 0.63 -0.00 1.09 0.00 -0.92 0.00 0.00 175.35 176.14 1b4v n ALA 439 N 4.28 2.77 -4.01 5.17 0.00 -1.26 -4.35 120.51 123.11 1b4v n ALA 439 Ca -0.07 -0.27 -0.30 0.00 0.00 0.00 0.00 53.44 52.80 1b4v n ALA 439 Cb 0.51 -1.09 -0.16 0.00 0.00 0.00 0.00 19.45 18.71 1b4v n ALA 439 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1b4v s PHE 440 N -3.30 2.12 -0.34 0.00 0.40 -1.26 -3.98 117.98 111.62 1b4v s PHE 440 Ca 0.01 -1.19 -0.29 0.00 -0.60 0.00 0.00 56.93 54.87 1b4v s PHE 440 Cb 0.11 -1.57 0.02 0.00 0.51 0.00 0.00 43.02 42.09 1b4v s PHE 440 CO 0.78 -0.66 1.08 0.00 0.70 0.00 0.00 175.22 177.12 1b4v s ALA 441 N 1.50 3.45 -0.07 5.36 0.00 0.56 -4.89 121.76 127.67 1b4v s ALA 441 Ca 0.05 -0.12 0.10 0.00 0.00 0.00 0.00 51.96 51.98 1b4v s ALA 441 Cb -0.13 -3.70 0.15 0.00 0.00 0.00 0.00 23.12 19.44 1b4v s ALA 441 CO -0.11 -1.60 1.07 -0.40 0.00 0.00 0.00 175.76 174.73 1b4v n ASP 442 N 7.00 2.11 -1.99 0.00 5.68 -1.26 -2.53 116.55 125.56 1b4v n ASP 442 Ca 0.12 -2.55 -0.03 0.00 -0.50 0.00 0.00 54.79 51.83 1b4v n ASP 442 Cb 0.47 -0.23 0.06 0.00 -1.14 0.00 0.00 41.12 40.29 1b4v n ASP 442 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 1b4v n ASP 443 N -0.97 2.17 -4.23 -1.12 5.68 -1.26 -4.83 116.55 111.99 1b4v n ASP 443 Ca 0.08 -2.66 -0.13 0.00 -0.50 0.00 0.00 54.79 51.58 1b4v n ASP 443 Cb 0.46 -0.41 -0.10 0.00 -1.14 0.00 0.00 41.12 39.93 1b4v n ASP 443 CO 0.00 0.00 0.00 0.72 -1.33 0.00 0.00 177.20 176.59 1b4v s PHE 444 N -2.69 1.16 -0.22 2.11 -0.71 -1.26 -1.06 117.98 115.31 1b4v s PHE 444 Ca 0.36 -0.90 -0.11 0.00 -1.04 0.00 0.00 56.93 55.23 1b4v s PHE 444 Cb 0.36 -0.64 0.08 0.00 -1.21 0.00 0.00 43.02 41.61 1b4v s PHE 444 CO -0.06 -0.09 0.52 0.00 -1.34 0.00 0.00 175.22 174.25 1b4v n TYR 446 N 4.61 0.00 -3.33 0.00 4.01 -1.26 -0.56 117.16 120.63 1b4v n TYR 446 Ca -0.19 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.25 1b4v n TYR 446 Cb 0.55 -0.55 -0.06 0.00 -0.31 0.00 0.00 39.34 38.97 1b4v n TYR 446 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1b4v n HIS 447 N -2.29 3.35 -2.18 -0.72 8.25 -1.26 -4.86 115.22 115.50 1b4v n HIS 447 Ca -0.11 -3.81 -0.42 0.00 -0.26 0.00 0.00 57.72 53.12 1b4v n HIS 447 Cb 0.66 -0.71 -0.03 0.00 1.12 0.00 0.00 29.99 31.02 1b4v n HIS 447 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1b4v s PRO 448 N -2.56 4.30 -0.05 -0.41 0.04 -1.26 -3.53 135.00 131.53 1b4v s PRO 448 Ca 0.38 2.04 0.01 0.00 0.04 0.00 0.00 61.00 63.47 1b4v s PRO 448 Cb 0.13 -3.40 0.02 0.00 0.04 0.00 0.00 34.50 31.29 1b4v s PRO 448 CO 0.02 -0.50 -0.04 -0.51 0.04 0.00 0.00 177.00 176.00 1b4v s LEU 449 N 1.69 1.21 0.00 -3.56 1.43 -0.47 -4.64 118.68 114.34 1b4v s LEU 449 Ca 0.65 -0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.62 1b4v s LEU 449 Cb -0.35 -0.47 0.00 0.00 0.03 0.00 0.00 46.19 45.40 1b4v s LEU 449 CO 0.29 -0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.40 1b4v n GLY 450 N 4.26 0.95 0.00 -3.19 0.00 -0.36 -0.35 105.19 106.49 1b4v n GLY 450 Ca -0.21 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 43.58 1b4v n GLY 450 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b4v n GLY 451 N -0.50 1.43 2.44 -0.02 0.00 -0.88 -4.31 105.19 103.35 1b4v n GLY 451 Ca 0.00 -0.27 -0.13 0.00 0.00 0.00 0.00 46.02 45.61 1b4v n GLY 451 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b4v n VAL 453 N 0.12 0.07 -1.68 0.00 0.31 -1.04 -3.78 118.33 112.33 1b4v n VAL 453 Ca 0.16 -0.02 -0.46 0.00 -0.01 0.00 0.00 64.34 64.01 1b4v n VAL 453 Cb 0.73 -1.25 -0.04 0.00 -0.91 0.00 0.00 33.84 32.37 1b4v n VAL 453 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1b4v n LEU 454 N 2.98 3.29 0.00 7.52 7.94 -0.01 -1.15 117.00 137.57 1b4v n LEU 454 Ca 0.17 1.05 0.00 0.00 -1.11 0.00 0.00 56.01 56.12 1b4v n LEU 454 Cb 0.25 -1.43 0.00 0.00 0.53 0.00 0.00 43.42 42.77 1b4v n LEU 454 CO 0.63 -0.18 0.00 0.61 -1.11 0.00 0.00 177.39 177.34 1b4v n GLY 455 N 3.75 2.38 0.45 -3.96 0.00 -0.41 -4.82 105.19 102.58 1b4v n GLY 455 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.18 1b4v n GLY 455 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1b4v n LYS 456 N -2.00 0.13 0.11 1.61 4.76 -0.30 -4.71 118.16 117.76 1b4v n LYS 456 Ca 0.00 0.05 0.12 0.00 -2.87 0.00 0.00 58.31 55.61 1b4v n LYS 456 Cb 0.00 -0.60 0.19 0.00 -1.84 0.00 0.00 35.03 32.77 1b4v n LYS 456 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1b4v h ALA 457 N -0.93 0.74 -2.37 7.82 0.00 -1.45 -3.45 119.26 119.63 1b4v h ALA 457 Ca 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.46 1b4v h ALA 457 Cb 0.24 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.90 1b4v h ALA 457 CO 0.00 0.00 -0.53 0.95 0.00 0.00 0.00 179.25 179.67 1b4v s THR 458 N -3.20 0.28 0.00 0.00 -4.23 -1.22 -1.48 115.64 105.80 1b4v s THR 458 Ca 0.06 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.57 1b4v s THR 458 Cb 0.11 -2.47 0.00 0.00 1.34 0.00 0.00 72.50 71.47 1b4v s THR 458 CO 0.70 0.00 0.00 -0.90 -0.54 0.00 0.00 174.62 173.88 1b4v n ASP 459 N -1.15 0.00 0.00 3.99 5.75 0.22 -1.29 116.55 124.07 1b4v n ASP 459 Ca 0.01 -0.88 0.08 0.00 -0.01 0.00 0.00 54.79 53.99 1b4v n ASP 459 Cb 0.64 0.00 0.46 0.00 -1.03 0.00 0.00 41.12 41.19 1b4v n ASP 459 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1b4v n ASP 460 N -2.65 0.00 -0.07 -1.12 8.00 -1.26 -2.31 116.55 117.14 1b4v n ASP 460 Ca 0.00 -0.88 0.02 0.00 0.71 0.00 0.00 54.79 54.64 1b4v n ASP 460 Cb 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.13 1b4v n ASP 460 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1b4v n TYR 461 N -0.85 0.00 -0.61 1.24 4.02 -1.26 -4.91 117.16 114.79 1b4v n TYR 461 Ca 0.12 -0.41 0.00 0.00 -0.01 0.00 0.00 57.90 57.59 1b4v n TYR 461 Cb 0.05 -0.06 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 1b4v n TYR 461 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1b4v n GLY 462 N -0.49 0.74 3.65 2.72 0.00 -1.09 -4.77 105.19 105.96 1b4v n GLY 462 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1b4v n GLY 462 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b4v s ARG 463 N -0.39 4.12 0.11 1.61 0.52 -1.26 -1.28 118.95 122.38 1b4v s ARG 463 Ca 0.00 1.73 -0.31 0.00 -0.52 0.00 0.00 55.73 56.63 1b4v s ARG 463 Cb 0.00 -3.87 -0.10 0.00 0.52 0.00 0.00 34.95 31.51 1b4v s ARG 463 CO 0.00 -0.87 1.78 0.08 0.02 0.00 0.00 175.30 176.32 1b4v s VAL 464 N 3.96 2.66 0.24 3.52 1.01 -0.25 -0.61 120.40 130.92 1b4v s VAL 464 Ca 0.61 0.16 -0.31 0.00 0.00 0.00 0.00 61.98 62.44 1b4v s VAL 464 Cb -0.24 -3.10 -0.12 0.00 0.00 0.00 0.00 36.38 32.91 1b4v s VAL 464 CO 0.21 -0.00 1.64 0.00 0.00 0.00 0.00 175.10 176.95 1b4v n ALA 465 N 5.65 2.46 -0.06 5.51 0.00 -0.55 -2.39 120.51 131.12 1b4v n ALA 465 Ca 0.17 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.01 1b4v n ALA 465 Cb 0.39 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.37 1b4v n ALA 465 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b4v n GLY 466 N 3.15 0.56 3.06 0.00 0.00 -1.26 -4.38 105.19 106.31 1b4v n GLY 466 Ca 0.13 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 1b4v n GLY 466 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1b4v s TYR 467 N -2.24 0.31 -0.00 1.61 1.51 -1.01 -4.89 117.35 112.64 1b4v s TYR 467 Ca 0.00 -0.66 0.01 0.00 -1.01 0.00 0.00 57.07 55.41 1b4v s TYR 467 Cb 0.00 -0.23 -0.04 0.00 -0.11 0.00 0.00 41.96 41.59 1b4v s TYR 467 CO 0.00 -0.30 0.03 0.15 -1.11 0.00 0.00 175.55 174.31 1b4v s LYS 468 N -2.51 2.87 -1.76 -0.62 -0.14 -1.26 -4.53 119.74 111.79 1b4v s LYS 468 Ca -0.06 -0.57 0.00 0.00 -1.36 0.00 0.00 55.97 53.98 1b4v s LYS 468 Cb -0.02 -2.73 0.00 0.00 -1.68 0.00 0.00 37.83 33.40 1b4v s LYS 468 CO -0.05 0.63 0.00 0.09 -0.76 0.00 0.00 175.35 175.27 1b4v n ASN 469 N 1.34 -5.08 -4.14 2.83 5.03 -1.26 -4.98 115.26 109.00 1b4v n ASN 469 Ca -0.14 0.33 -0.33 0.00 0.87 0.00 0.00 54.58 55.31 1b4v n ASN 469 Cb 0.53 -4.12 -0.16 0.00 -1.02 0.00 0.00 39.78 35.01 1b4v n ASN 469 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1b4v s LEU 470 N -4.16 2.19 0.06 3.41 2.96 -1.26 -1.47 118.68 120.41 1b4v s LEU 470 Ca 0.00 -0.63 0.04 0.00 -0.22 0.00 0.00 54.13 53.32 1b4v s LEU 470 Cb 0.00 -1.50 -0.03 0.00 0.50 0.00 0.00 46.19 45.16 1b4v s LEU 470 CO 0.00 0.00 -0.12 -0.31 -1.32 0.00 0.00 176.35 174.60 1b4v s TYR 471 N 1.28 1.07 -0.07 5.38 1.51 0.33 -1.09 117.35 125.76 1b4v s TYR 471 Ca 0.04 -0.48 0.04 0.00 -1.01 0.00 0.00 57.07 55.67 1b4v s TYR 471 Cb -0.13 -0.61 -0.02 0.00 -0.11 0.00 0.00 41.96 41.09 1b4v s TYR 471 CO -0.12 0.02 -0.18 0.08 -1.11 0.00 0.00 175.55 174.24 1b4v s VAL 472 N -1.33 2.71 0.00 0.71 1.01 -0.40 0.11 120.40 123.20 1b4v s VAL 472 Ca -0.04 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1b4v s VAL 472 Cb -0.10 -2.05 0.00 0.00 0.00 0.00 0.00 36.38 34.23 1b4v s VAL 472 CO 0.02 0.57 0.29 0.35 0.00 0.00 0.00 175.10 176.33 1b4v n THR 473 N 2.78 0.00 -2.15 3.92 -2.24 -0.23 -4.56 114.28 111.80 1b4v n THR 473 Ca -0.17 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.31 1b4v n THR 473 Cb 0.52 1.39 0.00 0.00 -2.10 0.00 0.00 70.33 70.14 1b4v n THR 473 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1b4v n ASP 474 N -0.01 0.66 0.26 3.42 3.85 -1.26 -4.24 116.55 119.22 1b4v n ASP 474 Ca 0.00 0.00 0.17 0.00 -0.71 0.00 0.00 54.79 54.25 1b4v n ASP 474 Cb 0.10 0.00 0.91 0.00 -1.35 0.00 0.00 41.12 40.78 1b4v n ASP 474 CO 0.00 0.00 0.00 1.23 -1.01 0.00 0.00 177.20 177.42 1b4v h GLY 475 N 0.00 0.00 2.00 6.12 0.00 -1.88 -1.64 103.07 107.67 1b4v h GLY 475 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1b4v h GLY 475 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 176.54 178.02 1b4v h SER 476 N 0.00 0.00 1.03 0.19 4.64 -1.80 -1.45 113.55 116.16 1b4v h SER 476 Ca 0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 1b4v h SER 476 Cb 0.04 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.11 1b4v h SER 476 CO 0.00 0.00 -0.67 -0.07 -0.87 0.00 0.00 176.83 175.22 1b4v h LEU 477 N 0.00 0.00 -9.53 5.97 3.38 -1.38 -0.61 115.31 113.14 1b4v h LEU 477 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 1b4v h LEU 477 Cb 0.34 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.09 1b4v h LEU 477 CO 0.00 0.67 0.58 -0.63 0.09 0.00 0.00 178.44 179.14 1b4v s ILE 478 N -3.13 3.84 -0.90 1.22 -1.09 -1.04 -0.83 121.20 119.28 1b4v s ILE 478 Ca 0.01 1.37 -0.06 0.00 -2.23 0.00 0.00 60.65 59.75 1b4v s ILE 478 Cb 0.10 -3.88 -0.05 0.00 -1.58 0.00 0.00 42.46 37.05 1b4v s ILE 478 CO 0.76 0.13 2.09 -0.81 -1.23 0.00 0.00 174.94 175.89 1b4v n PRO 479 N 3.59 2.05 -0.35 2.79 -0.04 -1.26 -1.23 135.00 140.56 1b4v n PRO 479 Ca 0.08 -1.44 0.00 0.00 -0.04 0.00 0.00 63.50 62.10 1b4v n PRO 479 Cb 0.45 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 1b4v n PRO 479 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1b4v n GLY 480 N 3.77 0.21 3.63 0.55 0.00 -1.21 -4.90 105.19 107.24 1b4v n GLY 480 Ca 0.44 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.35 1b4v n GLY 480 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1b4v s SER 481 N -2.17 -0.67 0.00 1.61 0.15 -1.26 -2.35 113.70 109.01 1b4v s SER 481 Ca 0.00 1.25 0.00 0.00 0.70 0.00 0.00 55.95 57.90 1b4v s SER 481 Cb 0.00 1.27 0.00 0.00 -1.71 0.00 0.00 66.02 65.58 1b4v s SER 481 CO 0.00 -0.21 0.03 1.33 1.20 0.00 0.00 173.24 175.58 1b4v n VAL 482 N 2.82 0.00 -0.76 4.45 0.24 -1.26 -4.99 118.33 118.82 1b4v n VAL 482 Ca -0.15 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 61.92 1b4v n VAL 482 Cb 0.56 1.06 0.00 0.00 -1.47 0.00 0.00 33.84 33.99 1b4v n VAL 482 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1b4v n GLY 483 N 0.41 1.35 3.58 7.63 0.00 -1.26 -4.63 105.19 112.27 1b4v n GLY 483 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 1b4v n GLY 483 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b4v s VAL 484 N -3.64 0.00 -0.01 1.61 -7.23 -1.26 -4.69 120.40 105.18 1b4v s VAL 484 Ca 0.00 -1.44 -0.32 0.00 -1.81 0.00 0.00 61.98 58.41 1b4v s VAL 484 Cb 0.00 -2.60 -0.11 0.00 0.56 0.00 0.00 36.38 34.24 1b4v s VAL 484 CO 0.00 0.00 1.90 0.59 -0.31 0.00 0.00 175.10 177.28 1b4v n ASN 485 N -1.19 3.78 0.28 4.85 3.02 -1.26 -4.91 115.26 119.83 1b4v n ASN 485 Ca -0.02 0.95 0.16 0.00 -0.03 0.00 0.00 54.58 55.65 1b4v n ASN 485 Cb 0.61 -1.45 0.82 0.00 -0.61 0.00 0.00 39.78 39.15 1b4v n ASN 485 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1b4v h PRO 486 N 9.56 0.00 0.00 3.52 0.14 -1.89 -3.39 132.00 139.95 1b4v h PRO 486 Ca -0.49 0.00 -0.04 0.00 0.14 0.00 0.00 66.00 65.61 1b4v h PRO 486 Cb 1.25 0.00 -0.01 0.00 0.14 0.00 0.00 31.00 32.39 1b4v h PRO 486 CO 0.94 0.06 -0.19 0.27 0.14 0.00 0.00 178.00 179.22 1b4v h PHE 487 N 0.00 0.00 -0.27 1.56 -5.15 -1.90 -2.02 116.94 109.15 1b4v h PHE 487 Ca -0.00 0.00 -0.17 0.00 -0.20 0.00 0.00 57.97 57.60 1b4v h PHE 487 Cb 0.32 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.49 1b4v h PHE 487 CO 0.00 0.19 -0.52 0.28 -2.00 0.00 0.00 178.31 176.27 1b4v h VAL 488 N 0.00 1.29 -0.28 0.88 2.07 -1.80 -1.23 116.25 117.18 1b4v h VAL 488 Ca -0.00 -1.72 -0.03 0.00 0.82 0.00 0.00 66.70 65.77 1b4v h VAL 488 Cb 0.52 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.91 1b4v h VAL 488 CO 0.03 0.55 0.04 0.74 0.02 0.00 0.00 177.57 178.95 1b4v h THR 489 N 0.61 1.23 -0.92 2.57 2.02 -1.67 0.57 112.91 117.33 1b4v h THR 489 Ca 0.02 -0.80 0.02 0.00 0.77 0.00 0.00 66.41 66.41 1b4v h THR 489 Cb 1.10 1.21 -0.05 0.00 -1.74 0.00 0.00 68.15 68.68 1b4v h THR 489 CO 0.11 0.26 0.61 0.40 0.37 0.00 0.00 175.52 177.27 1b4v h ILE 490 N 0.29 1.22 -0.13 3.11 2.04 -1.33 0.50 117.51 123.20 1b4v h ILE 490 Ca 0.09 -0.42 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 1b4v h ILE 490 Cb 0.34 -0.12 -0.00 0.00 -0.74 0.00 0.00 36.82 36.30 1b4v h ILE 490 CO 0.01 0.22 -0.04 0.74 0.00 0.00 0.00 178.15 179.08 1b4v h THR 491 N 1.23 1.30 -0.51 -0.27 2.02 -0.95 -1.71 112.91 114.01 1b4v h THR 491 Ca 0.34 -1.01 -0.03 0.00 0.77 0.00 0.00 66.41 66.48 1b4v h THR 491 Cb -0.11 1.70 -0.02 0.00 -1.74 0.00 0.00 68.15 67.98 1b4v h THR 491 CO -0.08 0.29 0.20 0.00 0.37 0.00 0.00 175.52 176.30 1b4v h ALA 492 N 0.69 0.66 -0.69 6.16 0.00 -0.62 -1.32 119.26 124.14 1b4v h ALA 492 Ca 0.03 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1b4v h ALA 492 Cb 0.48 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1b4v h ALA 492 CO 0.01 0.27 0.27 1.25 0.00 0.00 0.00 179.25 181.06 1b4v h LEU 493 N 0.68 0.93 -0.96 0.00 5.85 -0.92 -1.69 115.31 119.20 1b4v h LEU 493 Ca 0.17 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.67 1b4v h LEU 493 Cb 0.20 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 1b4v h LEU 493 CO -0.01 0.83 -0.13 0.00 -0.34 0.00 0.00 178.44 178.79 1b4v h ALA 494 N 1.30 1.13 -0.41 1.25 0.00 -0.89 0.24 119.26 121.88 1b4v h ALA 494 Ca 0.23 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 1b4v h ALA 494 Cb 0.20 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1b4v h ALA 494 CO -0.02 0.55 0.05 0.93 0.00 0.00 0.00 179.25 180.75 1b4v h GLU 495 N 0.55 0.69 -0.21 0.00 4.39 -0.70 -1.39 114.58 117.91 1b4v h GLU 495 Ca 0.10 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.59 1b4v h GLU 495 Cb 0.55 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 1b4v h GLU 495 CO 0.03 0.74 0.09 -0.09 -1.16 0.00 0.00 179.01 178.63 1b4v h ARG 496 N 0.53 0.31 0.21 2.33 2.43 -0.90 -2.77 114.38 116.52 1b4v h ARG 496 Ca 0.12 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 1b4v h ARG 496 Cb 0.40 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.90 1b4v h ARG 496 CO 0.01 0.36 -0.10 -0.91 -1.51 0.00 0.00 179.97 177.82 1b4v h ASN 497 N 0.19 -0.24 -0.35 -3.80 -0.26 -0.90 -2.97 115.58 107.26 1b4v h ASN 497 Ca 0.07 -0.16 -0.05 0.00 -0.56 0.00 0.00 56.30 55.60 1b4v h ASN 497 Cb 0.16 0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 37.46 1b4v h ASN 497 CO -0.01 0.03 0.07 1.62 -1.06 0.00 0.00 177.43 178.08 1b4v h VAL 498 N -0.52 1.21 -0.44 2.81 3.04 -1.33 -0.90 116.25 120.12 1b4v h VAL 498 Ca -0.03 -0.78 -0.02 0.00 -1.01 0.00 0.00 66.70 64.86 1b4v h VAL 498 Cb 0.39 0.81 -0.02 0.00 -2.01 0.00 0.00 31.29 30.46 1b4v h VAL 498 CO 0.05 0.28 0.21 -0.08 -1.01 0.00 0.00 177.57 177.01 1b4v h GLU 499 N 0.64 0.64 -0.35 4.17 4.81 -1.51 0.19 114.58 123.16 1b4v h GLU 499 Ca 0.14 -0.10 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 1b4v h GLU 499 Cb 0.30 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.56 1b4v h GLU 499 CO 0.00 0.56 -0.04 -0.09 -0.73 0.00 0.00 179.01 178.71 1b4v h ARG 500 N 0.57 0.65 -0.40 1.92 9.65 -1.33 -2.11 114.38 123.34 1b4v h ARG 500 Ca 0.15 -0.23 0.00 0.00 -1.10 0.00 0.00 59.98 58.80 1b4v h ARG 500 Cb 0.13 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.64 1b4v h ARG 500 CO -0.02 0.79 0.26 0.82 2.80 0.00 0.00 179.97 184.62 1b4v h ILE 501 N 0.45 1.11 -0.79 1.20 2.04 -0.97 -0.39 117.51 120.16 1b4v h ILE 501 Ca 0.09 -0.22 -0.04 0.00 1.00 0.00 0.00 64.86 65.69 1b4v h ILE 501 Cb 0.52 0.54 -0.04 0.00 -0.74 0.00 0.00 36.82 37.11 1b4v h ILE 501 CO 0.03 0.11 0.34 0.40 0.00 0.00 0.00 178.15 179.03 1b4v h ILE 502 N 0.54 1.26 -0.24 -0.67 2.04 -0.90 0.34 117.51 119.88 1b4v h ILE 502 Ca 0.15 -0.78 -0.03 0.00 1.00 0.00 0.00 64.86 65.20 1b4v h ILE 502 Cb -0.04 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.32 1b4v h ILE 502 CO -0.03 0.32 0.03 0.11 0.00 0.00 0.00 178.15 178.58 1b4v h LYS 503 N 1.14 0.40 0.03 2.37 1.57 -0.96 -3.03 116.57 118.09 1b4v h LYS 503 Ca 0.27 -0.11 -0.33 0.00 -1.87 0.00 0.00 60.65 58.61 1b4v h LYS 503 Cb 0.18 -0.04 -0.05 0.00 0.08 0.00 0.00 32.23 32.40 1b4v h LYS 503 CO -0.03 0.55 -1.92 1.04 -0.57 0.00 0.00 179.45 178.52 1b4v n GLN 504 N -4.69 0.67 -0.10 3.15 1.13 -0.19 -4.68 117.38 112.67 1b4v n GLN 504 Ca -0.03 0.24 -0.12 0.00 -1.94 0.00 0.00 57.00 55.14 1b4v n GLN 504 Cb 0.21 -1.72 -0.13 0.00 0.11 0.00 0.00 30.24 28.71 1b4v n GLN 504 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 1b4v n ASP 505 N -3.11 1.26 -0.43 1.08 9.92 0.12 -5.08 116.55 120.30 1b4v n ASP 505 Ca -0.24 -0.05 0.14 0.00 -0.53 0.00 0.00 54.79 54.11 1b4v n ASP 505 Cb 1.06 0.41 0.57 0.00 -0.64 0.00 0.00 41.12 42.52 1b4v n ASP 505 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85