#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3m1c s LEU 50 N 0.00 2.04 -0.27 0.55 2.96 -1.26 -5.03 118.68 117.67 3m1c s LEU 50 Ca 0.00 -0.78 -0.07 0.00 -0.22 0.00 0.00 54.13 53.06 3m1c s LEU 50 Cb 0.00 -1.15 -0.02 0.00 0.50 0.00 0.00 46.19 45.53 3m1c s LEU 50 CO 0.00 -0.14 0.07 0.26 -1.32 0.00 0.00 176.35 175.22 3m1c s TRP 51 N 1.47 3.10 -0.39 5.38 0.52 -1.26 -5.00 118.94 122.76 3m1c s TRP 51 Ca 0.00 -0.62 0.10 0.00 0.02 0.00 0.00 56.10 55.60 3m1c s TRP 51 Cb -0.16 -2.25 0.30 0.00 -1.15 0.00 0.00 33.47 30.22 3m1c s TRP 51 CO -0.08 -0.44 0.64 -0.11 0.02 0.00 0.00 176.95 176.98 3m1c n LEU 52 N 4.91 0.63 -4.76 2.99 7.94 -1.26 -3.22 117.00 124.23 3m1c n LEU 52 Ca -0.16 -4.88 -0.34 0.00 -1.11 0.00 0.00 56.01 49.52 3m1c n LEU 52 Cb 0.50 0.65 0.05 0.00 0.53 0.00 0.00 43.42 45.15 3m1c n LEU 52 CO 0.31 2.19 0.78 -2.16 -1.11 0.00 0.00 177.39 177.40 3m1c s PRO 53 N -1.90 2.75 -1.07 1.96 0.04 -1.26 -4.86 135.00 130.67 3m1c s PRO 53 Ca 0.38 1.60 -0.17 0.00 0.04 0.00 0.00 61.00 62.85 3m1c s PRO 53 Cb 0.27 -1.93 0.14 0.00 0.04 0.00 0.00 34.50 33.02 3m1c s PRO 53 CO -0.09 -1.33 1.31 1.21 0.04 0.00 0.00 177.00 178.14 3m1c s ASN 54 N -2.13 6.81 0.55 6.66 3.84 -0.05 -4.68 114.94 125.93 3m1c s ASN 54 Ca 0.72 -2.40 -0.21 0.00 0.21 0.00 0.00 52.86 51.17 3m1c s ASN 54 Cb -0.25 -2.42 -0.05 0.00 -0.55 0.00 0.00 41.25 37.98 3m1c s ASN 54 CO 0.38 -0.98 1.30 0.42 -2.79 0.00 0.00 177.10 175.44 3m1c s THR 55 N 2.50 2.32 0.00 -5.21 -4.23 -1.26 -3.69 115.64 106.08 3m1c s THR 55 Ca 0.39 0.23 0.00 0.00 -1.18 0.00 0.00 61.69 61.13 3m1c s THR 55 Cb -0.03 -3.11 0.00 0.00 1.34 0.00 0.00 72.50 70.70 3m1c s THR 55 CO -0.05 -0.01 0.00 -2.65 -0.54 0.00 0.00 174.62 171.37 3m1c n PRO 56 N -1.08 0.60 -3.88 3.99 -0.02 -1.26 -4.97 135.00 128.37 3m1c n PRO 56 Ca 0.11 0.00 -0.15 0.00 -2.02 0.00 0.00 63.50 61.43 3m1c n PRO 56 Cb 0.46 0.00 -0.16 0.00 -0.02 0.00 0.00 33.50 33.79 3m1c n PRO 56 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3m1c s ASP 57 N -1.00 0.22 0.57 2.55 -1.08 -1.26 -4.62 116.67 112.05 3m1c s ASP 57 Ca 0.00 -0.00 0.23 0.00 -0.52 0.00 0.00 52.55 52.26 3m1c s ASP 57 Cb 0.00 -0.11 0.80 0.00 -1.46 0.00 0.00 42.92 42.14 3m1c s ASP 57 CO 0.00 -0.08 1.19 0.00 0.52 0.00 0.00 175.17 176.80 3m1c n ALA 58 N 3.88 0.88 0.07 3.66 0.00 -1.26 0.57 120.51 128.30 3m1c n ALA 58 Ca -0.24 0.30 -0.18 0.00 0.00 0.00 0.00 53.44 53.33 3m1c n ALA 58 Cb 0.52 -0.53 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 3m1c n ALA 58 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3m1c h SER 59 N 0.00 0.72 -0.69 0.00 0.02 -1.95 -3.45 113.55 108.21 3m1c h SER 59 Ca 0.43 -0.61 -0.56 0.00 -0.84 0.00 0.00 61.79 60.22 3m1c h SER 59 Cb 2.69 -0.22 0.03 0.00 0.14 0.00 0.00 62.40 65.04 3m1c h SER 59 CO -0.00 1.42 0.15 0.47 -1.14 0.00 0.00 176.83 177.72 3m1c n ASP 60 N -3.77 0.20 0.24 3.07 9.92 0.19 -4.82 116.55 121.59 3m1c n ASP 60 Ca -0.10 0.80 0.13 0.00 -0.53 0.00 0.00 54.79 55.10 3m1c n ASP 60 Cb 0.90 -0.62 0.43 0.00 -0.64 0.00 0.00 41.12 41.19 3m1c n ASP 60 CO 0.00 0.00 0.00 1.55 0.13 0.00 0.00 177.20 178.88 3m1c h PRO 61 N 2.39 0.00 0.00 -0.24 0.13 -1.90 -3.13 132.00 129.25 3m1c h PRO 61 Ca -0.34 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.79 3m1c h PRO 61 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 3m1c h PRO 61 CO 0.50 0.07 0.00 1.04 -0.23 0.00 0.00 178.00 179.38 3m1c n GLN 62 N -3.15 0.00 -0.12 0.86 6.02 -1.26 -4.72 117.38 115.01 3m1c n GLN 62 Ca 0.02 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 57.00 3m1c n GLN 62 Cb 0.43 -0.02 0.04 0.00 1.02 0.00 0.00 30.24 31.71 3m1c n GLN 62 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 3m1c n ARG 63 N -1.47 1.38 -0.29 -1.09 1.85 -1.26 -4.34 116.66 111.43 3m1c n ARG 63 Ca 0.00 -0.38 -0.05 0.00 -1.00 0.00 0.00 57.85 56.42 3m1c n ARG 63 Cb 0.00 -1.45 0.07 0.00 -1.05 0.00 0.00 32.46 30.02 3m1c n ARG 63 CO 0.00 0.00 0.00 0.78 -0.01 0.00 0.00 177.63 178.40 3m1c h GLY 64 N 4.49 1.22 0.86 2.89 0.00 -1.78 -1.58 103.07 109.17 3m1c h GLY 64 Ca 0.02 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.78 3m1c h GLY 64 CO 0.08 0.55 0.00 0.54 0.00 0.00 0.00 176.54 177.72 3m1c n ARG 65 N -4.38 0.47 -0.33 4.80 1.74 -1.26 -2.29 116.66 115.41 3m1c n ARG 65 Ca 0.08 0.00 0.07 0.00 -0.77 0.00 0.00 57.85 57.23 3m1c n ARG 65 Cb 0.11 -1.43 0.22 0.00 -1.02 0.00 0.00 32.46 30.35 3m1c n ARG 65 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3m1c n LEU 66 N -0.93 3.51 -4.76 0.55 4.77 -0.59 -4.90 117.00 114.66 3m1c n LEU 66 Ca 0.10 -2.36 -0.33 0.00 -0.03 0.00 0.00 56.01 53.39 3m1c n LEU 66 Cb 0.04 -0.38 0.07 0.00 -2.33 0.00 0.00 43.42 40.82 3m1c n LEU 66 CO 0.07 0.74 0.74 0.00 -1.33 0.00 0.00 177.39 177.61 3m1c s ALA 67 N -1.65 2.35 0.38 -1.18 0.00 -0.97 -1.90 121.76 118.79 3m1c s ALA 67 Ca 0.34 0.54 -0.24 0.00 0.00 0.00 0.00 51.96 52.59 3m1c s ALA 67 Cb 0.22 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.91 3m1c s ALA 67 CO 0.16 -1.50 1.04 -2.14 0.00 0.00 0.00 175.76 173.32 3m1c s PRO 68 N -4.24 4.25 0.07 0.00 0.02 -1.26 -4.67 135.00 129.17 3m1c s PRO 68 Ca 0.67 1.50 -0.37 0.00 0.02 0.00 0.00 61.00 62.82 3m1c s PRO 68 Cb -0.21 -2.60 -0.16 0.00 0.02 0.00 0.00 34.50 31.54 3m1c s PRO 68 CO 0.45 -0.07 1.39 -0.35 -0.33 0.00 0.00 177.00 178.10 3m1c n PRO 69 N 0.07 1.26 -0.56 5.54 -0.04 -1.26 -4.83 135.00 135.18 3m1c n PRO 69 Ca 0.04 0.46 0.45 0.00 -0.04 0.00 0.00 63.50 64.41 3m1c n PRO 69 Cb 0.49 -2.12 0.73 0.00 -0.04 0.00 0.00 33.50 32.57 3m1c n PRO 69 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3m1c n GLY 70 N 2.73 -0.90 0.37 0.55 0.00 -1.26 -1.50 105.19 105.18 3m1c n GLY 70 Ca 0.19 0.74 0.13 0.00 0.00 0.00 0.00 46.02 47.08 3m1c n GLY 70 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3m1c h GLU 71 N 0.00 0.70 0.00 1.61 4.81 -2.03 -2.54 114.58 117.12 3m1c h GLU 71 Ca 0.91 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 60.04 3m1c h GLU 71 Cb 3.19 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 32.40 3m1c h GLU 71 CO -0.31 0.46 -0.26 -0.07 -0.73 0.00 0.00 179.01 178.11 3m1c h LEU 72 N 0.72 0.00 -2.09 1.64 3.38 -1.63 -3.47 115.31 113.86 3m1c h LEU 72 Ca 0.54 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 58.16 3m1c h LEU 72 Cb 0.89 0.00 0.13 0.00 0.09 0.00 0.00 40.66 41.77 3m1c h LEU 72 CO -0.31 0.26 -0.83 0.59 0.09 0.00 0.00 178.44 178.23 3m1c n ASN 73 N -3.44 -3.30 -4.34 -0.43 3.02 -0.96 -4.86 115.26 100.95 3m1c n ASN 73 Ca -0.00 -0.76 -0.43 0.00 -0.03 0.00 0.00 54.58 53.36 3m1c n ASN 73 Cb 0.44 -4.58 0.00 0.00 -0.61 0.00 0.00 39.78 35.03 3m1c n ASN 73 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 3m1c n LEU 74 N -3.96 5.50 -4.90 3.41 4.77 -1.26 -4.79 117.00 115.77 3m1c n LEU 74 Ca -0.21 -4.24 -0.28 0.00 -0.03 0.00 0.00 56.01 51.25 3m1c n LEU 74 Cb 0.65 -1.66 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 3m1c n LEU 74 CO 0.64 0.64 0.46 0.42 -1.33 0.00 0.00 177.39 178.22 3m1c s THR 75 N 2.62 4.84 0.57 -5.08 -4.23 -1.26 -4.86 115.64 108.23 3m1c s THR 75 Ca 0.47 0.23 0.29 0.00 -1.18 0.00 0.00 61.69 61.51 3m1c s THR 75 Cb 0.03 -3.85 0.42 0.00 1.34 0.00 0.00 72.50 70.45 3m1c s THR 75 CO 0.02 -0.85 1.89 0.00 -0.54 0.00 0.00 174.62 175.14 3m1c h THR 76 N 0.17 0.46 0.00 3.99 1.03 -1.99 0.20 112.91 116.77 3m1c h THR 76 Ca -0.47 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.93 3m1c h THR 76 Cb 1.21 0.60 0.00 0.00 -1.07 0.00 0.00 68.15 68.88 3m1c h THR 76 CO 0.62 0.00 -0.01 0.00 -0.01 0.00 0.00 175.52 176.11 3m1c h ALA 77 N 1.50 0.99 0.00 0.00 0.00 -1.96 -3.35 119.26 116.44 3m1c h ALA 77 Ca 0.29 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 55.01 3m1c h ALA 77 Cb 1.37 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 19.13 3m1c h ALA 77 CO -0.00 0.00 -1.87 -1.13 0.00 0.00 0.00 179.25 176.25 3m1c n SER 78 N -2.42 1.66 -0.07 0.00 3.41 0.61 -4.63 113.62 112.18 3m1c n SER 78 Ca 0.05 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.84 3m1c n SER 78 Cb 0.45 1.03 0.60 0.00 -0.26 0.00 0.00 64.21 66.03 3m1c n SER 78 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3m1c h VAL 79 N 0.00 0.77 -0.07 -3.33 2.07 -1.47 -3.35 116.25 110.86 3m1c h VAL 79 Ca -0.28 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.17 3m1c h VAL 79 Cb 1.56 0.56 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 3m1c h VAL 79 CO 0.02 0.04 0.00 -2.65 0.02 0.00 0.00 177.57 174.99 3m1c n PRO 80 N -4.42 1.06 0.00 1.57 -0.02 -1.20 -3.45 135.00 128.54 3m1c n PRO 80 Ca 0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 3m1c n PRO 80 Cb 0.55 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.03 3m1c n PRO 80 CO 0.00 0.00 0.00 -0.12 1.98 0.00 0.00 175.50 177.36 3m1c n MET 81 N 0.00 0.00 0.00 -0.52 0.00 -1.26 -4.72 117.12 110.62 3m1c n MET 81 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 3m1c n MET 81 Cb 0.00 -2.33 0.00 0.00 0.00 0.00 0.00 33.22 30.89 3m1c n MET 81 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 3m1c n LEU 82 N 0.00 0.00 -2.07 -0.89 4.77 -1.22 -4.91 117.00 112.68 3m1c n LEU 82 Ca 0.00 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.91 3m1c n LEU 82 Cb 0.00 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.12 3m1c n LEU 82 CO 0.00 0.00 0.03 0.54 -1.33 0.00 0.00 177.39 176.63 3m1c n ARG 83 N 14.00 -2.05 0.00 3.23 1.74 -1.26 -4.86 116.66 127.46 3m1c n ARG 83 Ca 0.00 0.35 0.10 0.00 -0.77 0.00 0.00 57.85 57.53 3m1c n ARG 83 Cb 0.00 -3.65 -0.09 0.00 -1.02 0.00 0.00 32.46 27.70 3m1c n ARG 83 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 3m1c n TRP 84 N -2.25 0.00 -2.03 -1.55 8.01 -1.26 -4.98 117.44 113.39 3m1c n TRP 84 Ca -0.09 0.00 -0.42 0.00 -1.31 0.00 0.00 57.50 55.68 3m1c n TRP 84 Cb 0.56 0.00 -0.03 0.00 -2.01 0.00 0.00 31.31 29.83 3m1c n TRP 84 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.69 176.21 3m1c s TYR 85 N -2.83 2.67 -0.11 -5.99 5.04 -1.26 -4.92 117.35 109.94 3m1c s TYR 85 Ca 0.10 0.54 -0.02 0.00 -2.44 0.00 0.00 57.07 55.25 3m1c s TYR 85 Cb 0.16 -3.85 0.04 0.00 0.35 0.00 0.00 41.96 38.66 3m1c s TYR 85 CO 0.78 -3.30 0.01 0.00 -1.34 0.00 0.00 175.55 171.71 3m1c s ALA 86 N 2.32 0.80 0.14 3.97 0.00 -1.26 -5.08 121.76 122.65 3m1c s ALA 86 Ca 0.70 -0.32 -0.26 0.00 0.00 0.00 0.00 51.96 52.07 3m1c s ALA 86 Cb -0.37 -0.90 -0.06 0.00 0.00 0.00 0.00 23.12 21.79 3m1c s ALA 86 CO 0.30 -0.71 1.36 0.39 0.00 0.00 0.00 175.76 177.11 3m1c n GLU 87 N 5.12 -0.37 0.00 0.00 1.02 -1.26 0.31 120.64 125.45 3m1c n GLU 87 Ca -0.08 1.34 0.03 0.00 -0.02 0.00 0.00 57.16 58.43 3m1c n GLU 87 Cb 0.49 -1.97 0.19 0.00 -0.02 0.00 0.00 31.44 30.13 3m1c n GLU 87 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 3m1c n ARG 88 N -5.00 0.39 -4.18 3.49 1.74 -1.26 -4.78 116.66 107.07 3m1c n ARG 88 Ca 0.02 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.93 3m1c n ARG 88 Cb 0.22 -1.26 -0.11 0.00 -1.02 0.00 0.00 32.46 30.29 3m1c n ARG 88 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3m1c s PHE 89 N -2.00 1.14 -0.08 -1.55 0.08 0.15 -1.43 117.98 114.29 3m1c s PHE 89 Ca 0.10 -0.55 0.05 0.00 0.12 0.00 0.00 56.93 56.64 3m1c s PHE 89 Cb 0.04 -0.63 -0.01 0.00 -0.57 0.00 0.00 43.02 41.86 3m1c s PHE 89 CO 0.07 0.04 -0.23 0.00 -0.10 0.00 0.00 175.22 175.00 3m1c s PHE 91 N 0.00 2.89 -0.23 0.00 -0.12 -1.26 -1.31 117.98 117.96 3m1c s PHE 91 Ca -0.08 -0.09 0.01 0.00 -0.05 0.00 0.00 56.93 56.72 3m1c s PHE 91 Cb -0.15 -1.47 0.06 0.00 -0.63 0.00 0.00 43.02 40.82 3m1c s PHE 91 CO 0.05 0.47 -0.07 0.08 -0.05 0.00 0.00 175.22 175.71 3m1c s VAL 92 N -1.39 1.61 -0.68 -2.49 1.01 -0.02 -4.97 120.40 113.48 3m1c s VAL 92 Ca 0.25 -1.21 -0.21 0.00 0.00 0.00 0.00 61.98 60.81 3m1c s VAL 92 Cb -0.11 -1.82 0.08 0.00 0.00 0.00 0.00 36.38 34.54 3m1c s VAL 92 CO 0.17 -0.04 0.94 -0.22 0.00 0.00 0.00 175.10 175.95 3m1c s LEU 93 N 1.37 4.64 -0.05 3.92 2.96 -1.26 -1.02 118.68 129.24 3m1c s LEU 93 Ca -0.05 -1.18 -0.18 0.00 -0.22 0.00 0.00 54.13 52.50 3m1c s LEU 93 Cb -0.18 -2.40 -0.05 0.00 0.50 0.00 0.00 46.19 44.06 3m1c s LEU 93 CO -0.06 -1.35 0.49 -0.69 -1.32 0.00 0.00 176.35 173.42 3m1c s VAL 94 N 3.67 5.05 0.01 1.68 1.01 0.18 -4.97 120.40 127.03 3m1c s VAL 94 Ca 0.21 1.01 0.01 0.00 0.00 0.00 0.00 61.98 63.21 3m1c s VAL 94 Cb -0.17 -3.82 -0.01 0.00 0.00 0.00 0.00 36.38 32.38 3m1c s VAL 94 CO 0.07 0.43 -0.03 0.42 0.00 0.00 0.00 175.10 175.99 3m1c s THR 95 N -0.14 0.24 0.00 3.92 -4.23 -1.26 -1.02 115.64 113.15 3m1c s THR 95 Ca 0.27 -0.33 0.00 0.00 -1.18 0.00 0.00 61.69 60.45 3m1c s THR 95 Cb -0.17 -0.25 0.00 0.00 1.34 0.00 0.00 72.50 73.42 3m1c s THR 95 CO 0.13 -0.06 0.00 0.35 -0.54 0.00 0.00 174.62 174.50 3m1c n THR 96 N 2.65 0.00 0.25 3.99 -2.24 -1.26 -5.01 114.28 112.67 3m1c n THR 96 Ca -0.15 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.73 3m1c n THR 96 Cb 0.58 -0.55 0.68 0.00 -2.10 0.00 0.00 70.33 68.94 3m1c n THR 96 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3m1c h ALA 97 N 0.45 1.50 -0.27 6.98 0.00 -2.02 -3.15 119.26 122.74 3m1c h ALA 97 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3m1c h ALA 97 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.77 3m1c h ALA 97 CO 0.00 0.15 0.00 0.39 0.00 0.00 0.00 179.25 179.79 3m1c n GLU 98 N -3.95 2.11 -1.93 0.00 1.02 -1.26 -4.92 120.64 111.71 3m1c n GLU 98 Ca -0.02 -1.17 -0.41 0.00 -0.02 0.00 0.00 57.16 55.53 3m1c n GLU 98 Cb 0.21 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.11 3m1c n GLU 98 CO 0.00 0.00 0.00 0.12 1.18 0.00 0.00 177.13 178.43 3m1c s PHE 99 N -1.65 2.85 -0.33 -0.32 5.36 -1.20 -2.16 117.98 120.53 3m1c s PHE 99 Ca 0.21 1.10 0.23 0.00 -0.96 0.00 0.00 56.93 57.51 3m1c s PHE 99 Cb 0.13 -3.90 0.05 0.00 -0.34 0.00 0.00 43.02 38.96 3m1c s PHE 99 CO 0.10 -2.77 1.06 -2.30 -1.46 0.00 0.00 175.22 169.85 3m1c n PRO 100 N 1.42 0.52 -0.32 10.12 -0.02 -1.26 -4.88 135.00 140.58 3m1c n PRO 100 Ca 0.04 0.09 0.21 0.00 -2.02 0.00 0.00 63.50 61.82 3m1c n PRO 100 Cb 0.40 -1.77 0.41 0.00 -0.02 0.00 0.00 33.50 32.52 3m1c n PRO 100 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3m1c h ARG 101 N 0.00 0.16 -4.32 -0.52 3.08 -1.87 -2.02 114.38 108.89 3m1c h ARG 101 Ca 0.00 -0.01 -0.73 0.00 0.07 0.00 0.00 59.98 59.31 3m1c h ARG 101 Cb 0.93 -0.04 -0.24 0.00 0.08 0.00 0.00 29.97 30.70 3m1c h ARG 101 CO 0.00 0.11 -0.36 0.34 -1.07 0.00 0.00 179.97 178.99 3m1c s ASP 102 N -4.89 6.01 0.00 7.04 3.68 -0.92 -4.95 116.67 122.64 3m1c s ASP 102 Ca -0.11 -1.43 0.18 0.00 2.13 0.00 0.00 52.55 53.32 3m1c s ASP 102 Cb 0.30 -2.13 1.06 0.00 -1.45 0.00 0.00 42.92 40.70 3m1c s ASP 102 CO 0.78 -0.64 1.47 -2.65 0.13 0.00 0.00 175.17 174.26 3m1c n PRO 103 N 5.13 0.61 -0.57 4.34 -0.02 -0.76 -3.97 135.00 139.76 3m1c n PRO 103 Ca -0.12 0.00 0.07 0.00 -2.02 0.00 0.00 63.50 61.43 3m1c n PRO 103 Cb 0.43 -1.45 -0.03 0.00 -0.02 0.00 0.00 33.50 32.42 3m1c n PRO 103 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3m1c n GLY 104 N 0.21 -2.61 3.69 -1.23 0.00 -1.26 -4.18 105.19 99.82 3m1c n GLY 104 Ca 0.13 -1.31 -0.24 0.00 0.00 0.00 0.00 46.02 44.60 3m1c n GLY 104 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3m1c s GLN 105 N -3.05 2.48 -0.26 1.61 -2.07 -0.19 -0.88 119.66 117.30 3m1c s GLN 105 Ca 0.00 -1.24 0.00 0.00 -1.82 0.00 0.00 55.36 52.30 3m1c s GLN 105 Cb 0.00 -2.32 0.04 0.00 -1.09 0.00 0.00 33.01 29.65 3m1c s GLN 105 CO 0.00 0.40 -0.08 -1.17 -1.32 0.00 0.00 175.29 173.12 3m1c s LEU 106 N -3.50 3.37 0.08 2.60 2.96 -1.24 -0.65 118.68 122.30 3m1c s LEU 106 Ca 0.31 -1.15 0.03 0.00 -0.22 0.00 0.00 54.13 53.10 3m1c s LEU 106 Cb -0.08 -1.62 -0.04 0.00 0.50 0.00 0.00 46.19 44.96 3m1c s LEU 106 CO 0.21 -0.17 0.07 -0.76 -1.32 0.00 0.00 176.35 174.38 3m1c s LEU 107 N 1.22 3.78 -0.09 -0.68 1.43 -0.19 -4.31 118.68 119.84 3m1c s LEU 107 Ca -0.04 -0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.04 3m1c s LEU 107 Cb -0.18 -2.46 0.02 0.00 0.03 0.00 0.00 46.19 43.60 3m1c s LEU 107 CO -0.05 0.17 -0.10 -0.31 0.23 0.00 0.00 176.35 176.30 3m1c s TYR 108 N -1.39 1.48 -0.02 0.29 2.02 -0.80 -0.84 117.35 118.09 3m1c s TYR 108 Ca 0.29 -0.66 0.03 0.00 -0.37 0.00 0.00 57.07 56.36 3m1c s TYR 108 Cb -0.12 -1.16 -0.00 0.00 -0.40 0.00 0.00 41.96 40.27 3m1c s TYR 108 CO 0.22 -0.41 -0.11 -1.50 -1.57 0.00 0.00 175.55 172.18 3m1c s ILE 109 N 1.24 0.89 0.22 2.71 2.07 -0.42 -4.41 121.20 123.51 3m1c s ILE 109 Ca -0.04 -0.44 -0.30 0.00 -1.41 0.00 0.00 60.65 58.47 3m1c s ILE 109 Cb -0.14 -0.78 -0.09 0.00 0.13 0.00 0.00 42.46 41.58 3m1c s ILE 109 CO -0.03 0.27 1.39 -2.16 -1.91 0.00 0.00 174.94 172.49 3m1c s PRO 110 N 0.05 4.32 0.29 3.50 0.04 -1.26 -0.28 135.00 141.65 3m1c s PRO 110 Ca -0.01 2.20 0.03 0.00 0.04 0.00 0.00 61.00 63.25 3m1c s PRO 110 Cb -0.08 -3.15 0.70 0.00 0.04 0.00 0.00 34.50 32.01 3m1c s PRO 110 CO 0.00 -0.35 1.71 0.87 0.04 0.00 0.00 177.00 179.27 3m1c h LYS 111 N 5.24 0.43 -0.20 4.56 1.57 -1.54 -0.52 116.57 126.10 3m1c h LYS 111 Ca -0.45 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.36 3m1c h LYS 111 Cb 1.22 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.42 3m1c h LYS 111 CO 0.78 0.28 0.23 1.79 -0.57 0.00 0.00 179.45 181.96 3m1c h THR 112 N 0.44 0.42 0.00 -0.16 1.35 -1.91 0.40 112.91 113.45 3m1c h THR 112 Ca 0.55 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.41 3m1c h THR 112 Cb 1.00 0.81 0.00 0.00 -1.73 0.00 0.00 68.15 68.23 3m1c h THR 112 CO -0.50 0.00 0.00 -1.22 -0.25 0.00 0.00 175.52 173.55 3m1c n TYR 113 N -3.72 0.02 0.83 4.73 0.53 -0.20 -2.40 117.16 116.94 3m1c n TYR 113 Ca 0.02 0.01 0.09 0.00 -1.02 0.00 0.00 57.90 56.99 3m1c n TYR 113 Cb 0.36 -0.51 -0.11 0.00 -1.03 0.00 0.00 39.34 38.05 3m1c n TYR 113 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 3m1c n LEU 114 N -1.51 0.83 -4.32 7.72 4.77 0.14 -5.09 117.00 119.54 3m1c n LEU 114 Ca 0.05 -0.47 -0.37 0.00 -0.03 0.00 0.00 56.01 55.19 3m1c n LEU 114 Cb 0.25 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.21 3m1c n LEU 114 CO 0.19 0.21 -0.27 -0.76 -1.33 0.00 0.00 177.39 175.43 3m1c s LEU 115 N -2.98 3.95 -0.06 2.23 1.43 -1.01 -5.09 118.68 117.15 3m1c s LEU 115 Ca 0.06 -0.82 0.03 0.00 -1.03 0.00 0.00 54.13 52.37 3m1c s LEU 115 Cb 0.14 -1.87 -0.05 0.00 0.03 0.00 0.00 46.19 44.43 3m1c s LEU 115 CO 0.78 -0.22 -0.01 0.00 0.23 0.00 0.00 176.35 177.12 3m1c n ALA 137 N 4.85 1.87 -0.08 4.21 0.00 -1.26 -4.94 120.51 125.16 3m1c n ALA 137 Ca -0.14 -0.31 -0.14 0.00 0.00 0.00 0.00 53.44 52.85 3m1c n ALA 137 Cb 0.47 0.23 -0.07 0.00 0.00 0.00 0.00 19.45 20.08 3m1c n ALA 137 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3m1c n GLU 138 N -2.40 0.37 -3.45 0.00 2.13 -1.26 -4.95 120.64 111.08 3m1c n GLU 138 Ca -0.10 0.12 -0.22 0.00 0.66 0.00 0.00 57.16 57.63 3m1c n GLU 138 Cb 0.65 -1.21 -0.11 0.00 0.27 0.00 0.00 31.44 31.03 3m1c n GLU 138 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 3m1c s VAL 139 N -2.31 -0.27 -0.06 6.31 1.01 -1.26 -4.10 120.40 119.73 3m1c s VAL 139 Ca -0.22 -0.65 0.06 0.00 0.00 0.00 0.00 61.98 61.17 3m1c s VAL 139 Cb 0.07 -0.97 -0.01 0.00 0.00 0.00 0.00 36.38 35.46 3m1c s VAL 139 CO 0.33 -0.58 -0.23 0.42 0.00 0.00 0.00 175.10 175.04 3m1c s THR 140 N 2.18 2.27 0.06 3.92 -4.23 -0.72 -4.94 115.64 114.18 3m1c s THR 140 Ca 0.10 -1.00 -0.30 0.00 -1.18 0.00 0.00 61.69 59.31 3m1c s THR 140 Cb -0.15 -1.84 -0.05 0.00 1.34 0.00 0.00 72.50 71.80 3m1c s THR 140 CO -0.32 0.57 1.16 -1.10 -0.54 0.00 0.00 174.62 174.39 3m1c s GLN 141 N -0.26 4.46 -0.51 3.99 -0.21 -1.26 0.01 119.66 125.88 3m1c s GLN 141 Ca -0.00 1.71 -0.18 0.00 0.02 0.00 0.00 55.36 56.91 3m1c s GLN 141 Cb -0.13 -3.36 0.07 0.00 1.00 0.00 0.00 33.01 30.59 3m1c s GLN 141 CO 0.03 -0.20 0.56 -0.51 -2.12 0.00 0.00 175.29 173.05 3m1c s LEU 142 N 0.95 5.28 -0.13 2.90 1.43 -0.25 -4.93 118.68 123.93 3m1c s LEU 142 Ca 0.57 -1.15 -0.05 0.00 -1.03 0.00 0.00 54.13 52.47 3m1c s LEU 142 Cb -0.28 -2.34 -0.04 0.00 0.03 0.00 0.00 46.19 43.56 3m1c s LEU 142 CO 0.29 -0.85 0.07 -0.54 0.23 0.00 0.00 176.35 175.55 3m1c s LYS 143 N 2.30 3.43 0.00 1.70 1.02 -1.26 -4.17 119.74 122.77 3m1c s LYS 143 Ca 0.11 -0.28 0.00 0.00 0.02 0.00 0.00 55.97 55.82 3m1c s LYS 143 Cb -0.22 -3.07 0.00 0.00 -0.52 0.00 0.00 37.83 34.03 3m1c s LYS 143 CO 0.09 0.62 0.00 0.41 -0.92 0.00 0.00 175.35 175.55 3m1c n GLY 144 N 2.45 -1.60 0.11 -3.33 0.00 -1.26 -4.82 105.19 96.73 3m1c n GLY 144 Ca -0.19 -2.18 -0.13 0.00 0.00 0.00 0.00 46.02 43.53 3m1c n GLY 144 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3m1c n LEU 145 N 0.00 1.10 -4.29 0.99 4.77 -1.26 -4.69 117.00 113.61 3m1c n LEU 145 Ca 0.00 0.02 -0.25 0.00 -0.03 0.00 0.00 56.01 55.75 3m1c n LEU 145 Cb 0.00 -0.03 -0.13 0.00 -2.33 0.00 0.00 43.42 40.93 3m1c n LEU 145 CO 0.00 0.63 -0.52 -0.94 -1.33 0.00 0.00 177.39 175.23 3m1c s SER 146 N -5.94 2.61 -1.01 -1.43 1.04 -1.26 -3.46 113.70 104.25 3m1c s SER 146 Ca -0.17 -0.68 -0.01 0.00 0.48 0.00 0.00 55.95 55.57 3m1c s SER 146 Cb 0.07 -0.15 0.32 0.00 0.10 0.00 0.00 66.02 66.36 3m1c s SER 146 CO 0.76 0.08 1.80 1.41 0.98 0.00 0.00 173.24 178.27 3m1c n HIS 147 N 1.11 2.83 -2.56 5.02 -0.00 -1.26 -5.01 115.22 115.34 3m1c n HIS 147 Ca -0.19 -2.61 -0.43 0.00 -0.00 0.00 0.00 57.72 54.49 3m1c n HIS 147 Cb 0.53 -1.17 -0.02 0.00 -0.00 0.00 0.00 29.99 29.33 3m1c n HIS 147 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 3m1c s ASN 148 N -1.42 6.95 0.49 0.41 3.84 -1.22 -4.92 114.94 119.07 3m1c s ASN 148 Ca 0.40 1.33 0.19 0.00 0.21 0.00 0.00 52.86 54.99 3m1c s ASN 148 Cb 0.20 -2.54 1.24 0.00 -0.55 0.00 0.00 41.25 39.60 3m1c s ASN 148 CO -0.14 -0.82 2.07 -0.65 -2.79 0.00 0.00 177.10 174.78 3m1c h PRO 149 N 8.09 0.00 0.00 0.43 0.11 -1.96 -2.09 132.00 136.58 3m1c h PRO 149 Ca -0.22 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.89 3m1c h PRO 149 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3m1c h PRO 149 CO 1.00 0.12 -0.12 0.41 -0.21 0.00 0.00 178.00 179.19 3m1c n GLY 150 N -1.09 -1.54 0.36 -0.55 0.00 -1.26 -4.20 105.19 96.92 3m1c n GLY 150 Ca -0.03 -0.12 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 3m1c n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1c h ALA 151 N 2.77 -0.19 -0.94 4.61 0.00 -1.65 0.83 119.26 124.69 3m1c h ALA 151 Ca 0.00 0.12 0.24 0.00 0.00 0.00 0.00 54.91 55.27 3m1c h ALA 151 Cb 0.61 0.81 -0.06 0.00 0.00 0.00 0.00 17.79 19.15 3m1c h ALA 151 CO 0.00 -0.75 0.64 1.03 0.00 0.00 0.00 179.25 180.17 3m1c h SER 152 N -0.23 0.28 1.17 0.00 0.87 -1.79 -0.43 113.55 113.42 3m1c h SER 152 Ca 0.19 0.04 -0.14 0.00 -1.23 0.00 0.00 61.79 60.65 3m1c h SER 152 Cb 0.56 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.48 3m1c h SER 152 CO -0.63 0.09 -0.66 0.00 -0.53 0.00 0.00 176.83 175.11 3m1c h ALA 153 N 1.59 0.63 -0.01 6.23 0.00 -1.11 -2.25 119.26 124.34 3m1c h ALA 153 Ca 0.49 -0.60 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 3m1c h ALA 153 Cb 1.45 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.14 3m1c h ALA 153 CO -0.14 0.82 -0.17 -0.07 0.00 0.00 0.00 179.25 179.69 3m1c h LEU 154 N 0.00 0.16 -2.79 0.00 3.38 -0.84 -3.11 115.31 112.11 3m1c h LEU 154 Ca -0.01 -0.75 -0.00 0.00 0.09 0.00 0.00 57.88 57.21 3m1c h LEU 154 Cb 1.42 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 42.12 3m1c h LEU 154 CO 0.09 0.89 -0.00 -0.07 0.09 0.00 0.00 178.44 179.43 3m1c h LEU 155 N -0.55 0.00 0.00 1.67 3.38 -1.15 -1.14 115.31 117.52 3m1c h LEU 155 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3m1c h LEU 155 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 3m1c h LEU 155 CO 0.03 0.00 -0.78 0.03 0.09 0.00 0.00 178.44 177.82 3m1c h ARG 156 N 0.00 0.00 -7.34 1.13 3.08 -1.44 -3.49 114.38 106.32 3m1c h ARG 156 Ca -0.00 0.00 -0.43 0.00 0.07 0.00 0.00 59.98 59.62 3m1c h ARG 156 Cb 0.03 0.00 0.18 0.00 0.08 0.00 0.00 29.97 30.27 3m1c h ARG 156 CO 0.00 0.00 0.13 -1.54 -1.07 0.00 0.00 179.97 177.49 3m1c s SER 157 N -5.23 1.37 0.00 7.04 1.04 -0.43 -4.97 113.70 112.52 3m1c s SER 157 Ca 0.02 0.89 0.16 0.00 0.48 0.00 0.00 55.95 57.50 3m1c s SER 157 Cb 0.10 -1.33 0.47 0.00 0.10 0.00 0.00 66.02 65.35 3m1c s SER 157 CO 0.76 -3.88 1.39 0.54 0.98 0.00 0.00 173.24 173.03 3m1c n ARG 158 N -4.63 2.79 -1.63 4.02 1.74 -1.26 -4.98 116.66 112.70 3m1c n ARG 158 Ca 0.09 -2.34 -0.51 0.00 -0.77 0.00 0.00 57.85 54.33 3m1c n ARG 158 Cb 0.58 -1.41 -0.06 0.00 -1.02 0.00 0.00 32.46 30.56 3m1c n ARG 158 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3m1c n ALA 159 N 1.06 -0.09 -0.25 7.54 0.00 -1.26 -0.28 120.51 127.23 3m1c n ALA 159 Ca 0.18 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.08 3m1c n ALA 159 Cb 0.52 -2.20 0.00 0.00 0.00 0.00 0.00 19.45 17.77 3m1c n ALA 159 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.50 178.41 3m1c n TRP 160 N 3.40 0.00 -0.08 0.00 7.02 -0.04 -4.75 117.44 122.98 3m1c n TRP 160 Ca 0.19 0.00 -0.21 0.00 -1.02 0.00 0.00 57.50 56.46 3m1c n TRP 160 Cb 0.22 -0.44 -0.12 0.00 -2.42 0.00 0.00 31.31 28.54 3m1c n TRP 160 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 3m1c h VAL 161 N 0.00 0.93 0.00 -0.99 2.07 -1.02 -3.45 116.25 113.80 3m1c h VAL 161 Ca 0.00 -2.22 0.00 0.00 0.82 0.00 0.00 66.70 65.30 3m1c h VAL 161 Cb 0.00 2.34 0.00 0.00 -1.52 0.00 0.00 31.29 32.11 3m1c h VAL 161 CO 0.00 0.41 -0.85 0.35 0.02 0.00 0.00 177.57 177.50 3m1c n THR 162 N -4.31 0.00 -4.37 2.57 -2.24 -0.82 -5.08 114.28 100.03 3m1c n THR 162 Ca -0.31 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.28 3m1c n THR 162 Cb 0.72 0.17 -0.10 0.00 -2.10 0.00 0.00 70.33 69.02 3m1c n THR 162 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 3m1c s PHE 163 N -1.73 1.81 -0.46 4.78 -0.12 -1.25 -5.10 117.98 115.90 3m1c s PHE 163 Ca 0.00 -0.53 0.02 0.00 -0.05 0.00 0.00 56.93 56.36 3m1c s PHE 163 Cb 0.00 -0.83 0.12 0.00 -0.63 0.00 0.00 43.02 41.68 3m1c s PHE 163 CO 0.00 0.42 0.21 0.00 -0.05 0.00 0.00 175.22 175.79 3m1c s ALA 164 N -2.90 3.19 -1.48 1.99 0.00 -1.26 -0.86 121.76 120.43 3m1c s ALA 164 Ca 0.24 -2.90 0.30 0.00 0.00 0.00 0.00 51.96 49.60 3m1c s ALA 164 Cb -0.01 -2.22 1.44 0.00 0.00 0.00 0.00 23.12 22.33 3m1c s ALA 164 CO 0.08 -1.88 2.00 0.00 0.00 0.00 0.00 175.76 175.96 3m1c n ALA 165 N 3.81 2.57 -3.13 0.00 0.00 -1.26 -3.84 120.51 118.67 3m1c n ALA 165 Ca 0.04 -0.18 -0.21 0.00 0.00 0.00 0.00 53.44 53.09 3m1c n ALA 165 Cb 0.38 -1.45 -0.05 0.00 0.00 0.00 0.00 19.45 18.34 3m1c n ALA 165 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m1c n ALA 166 N -1.20 1.84 -0.72 0.00 0.00 -1.26 -3.61 120.51 115.57 3m1c n ALA 166 Ca 0.14 -3.12 -0.30 0.00 0.00 0.00 0.00 53.44 50.16 3m1c n ALA 166 Cb 0.25 -0.90 0.18 0.00 0.00 0.00 0.00 19.45 18.98 3m1c n ALA 166 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3m1c s PRO 167 N -1.13 0.65 -0.03 0.00 0.02 -1.25 -4.89 135.00 128.37 3m1c s PRO 167 Ca 0.35 1.33 -0.30 0.00 0.02 0.00 0.00 61.00 62.41 3m1c s PRO 167 Cb 0.21 -1.70 -0.08 0.00 0.02 0.00 0.00 34.50 32.95 3m1c s PRO 167 CO -0.12 -2.81 2.01 -0.51 -0.33 0.00 0.00 177.00 175.24 3m1c s ASP 168 N -2.71 6.23 -0.27 2.53 1.01 -1.26 -4.95 116.67 117.25 3m1c s ASP 168 Ca 0.67 2.47 -0.29 0.00 0.71 0.00 0.00 52.55 56.11 3m1c s ASP 168 Cb -0.23 -2.53 0.01 0.00 1.01 0.00 0.00 42.92 41.19 3m1c s ASP 168 CO 0.59 -1.26 1.08 0.00 0.21 0.00 0.00 175.17 175.79 3m1c s ARG 169 N 4.87 4.17 -1.14 8.23 1.70 -1.26 -4.98 118.95 130.54 3m1c s ARG 169 Ca 0.90 1.26 -0.11 0.00 -0.47 0.00 0.00 55.73 57.31 3m1c s ARG 169 Cb -0.40 -3.70 0.23 0.00 -0.57 0.00 0.00 34.95 30.51 3m1c s ARG 169 CO 0.40 -0.76 1.24 -2.00 -1.08 0.00 0.00 175.30 173.09 3m1c s GLU 170 N 3.44 4.13 -1.65 3.89 2.12 -1.26 -4.55 118.70 124.83 3m1c s GLU 170 Ca 0.46 -2.91 0.00 0.00 0.36 0.00 0.00 54.97 52.88 3m1c s GLU 170 Cb -0.14 -4.77 0.00 0.00 0.26 0.00 0.00 34.13 29.47 3m1c s GLU 170 CO 0.11 -1.47 0.00 0.41 -0.54 0.00 0.00 175.26 173.77 3m1c n GLY 171 N 3.37 1.55 3.67 -1.50 0.00 -1.26 -4.92 105.19 106.10 3m1c n GLY 171 Ca 0.29 -0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 3m1c n GLY 171 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3m1c s LEU 172 N -3.53 4.41 -0.03 0.99 2.96 -1.26 -4.96 118.68 117.27 3m1c s LEU 172 Ca 0.00 2.64 0.07 0.00 -0.22 0.00 0.00 54.13 56.62 3m1c s LEU 172 Cb 0.00 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.13 3m1c s LEU 172 CO 0.00 -1.02 -0.23 -0.89 -1.32 0.00 0.00 176.35 172.89 3m1c s THR 173 N 3.81 1.85 -0.65 3.68 2.01 -1.26 -4.88 115.64 120.20 3m1c s THR 173 Ca 0.84 -0.99 0.01 0.00 0.31 0.00 0.00 61.69 61.86 3m1c s THR 173 Cb -0.42 -1.55 0.16 0.00 0.01 0.00 0.00 72.50 70.70 3m1c s THR 173 CO 0.38 0.52 0.45 -0.36 -0.69 0.00 0.00 174.62 174.92 3m1c s PHE 174 N -0.41 3.44 0.66 4.92 0.08 -1.26 -5.05 117.98 120.36 3m1c s PHE 174 Ca 0.05 -3.04 -0.17 0.00 0.12 0.00 0.00 56.93 53.88 3m1c s PHE 174 Cb -0.10 -2.99 -0.02 0.00 -0.57 0.00 0.00 43.02 39.35 3m1c s PHE 174 CO 0.00 -0.73 1.10 -2.30 -0.10 0.00 0.00 175.22 173.19 3m1c n PRO 175 N 2.86 0.85 -1.58 0.24 -0.02 -1.26 -4.09 135.00 132.01 3m1c n PRO 175 Ca 0.12 0.34 -0.36 0.00 -2.02 0.00 0.00 63.50 61.58 3m1c n PRO 175 Cb 0.35 -2.33 0.08 0.00 -0.02 0.00 0.00 33.50 31.59 3m1c n PRO 175 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3m1c s ARG 176 N -3.18 2.32 0.13 -0.52 3.52 -1.26 -4.87 118.95 115.09 3m1c s ARG 176 Ca 0.78 1.94 0.07 0.00 -0.13 0.00 0.00 55.73 58.40 3m1c s ARG 176 Cb -0.38 -1.83 -0.04 0.00 -1.56 0.00 0.00 34.95 31.14 3m1c s ARG 176 CO 0.45 -1.75 -0.17 0.20 -0.81 0.00 0.00 175.30 173.22 3m1c s GLY 177 N -1.66 1.22 0.86 8.12 0.00 -1.26 -5.08 107.32 109.51 3m1c s GLY 177 Ca 0.79 -1.33 -0.12 0.00 0.00 0.00 0.00 44.72 44.06 3m1c s GLY 177 CO 0.42 -1.37 1.03 1.22 0.00 0.00 0.00 173.10 174.40 3m1c n ASP 178 N 0.63 0.24 0.00 1.64 9.92 -1.26 -1.11 116.55 126.61 3m1c n ASP 178 Ca -0.16 0.50 0.00 0.00 -0.53 0.00 0.00 54.79 54.60 3m1c n ASP 178 Cb 0.56 -1.44 0.00 0.00 -0.64 0.00 0.00 41.12 39.60 3m1c n ASP 178 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 3m1c n ASP 179 N -3.10 0.00 -4.69 -2.24 4.64 -1.26 -4.93 116.55 104.97 3m1c n ASP 179 Ca 0.12 0.00 -0.42 0.00 -1.38 0.00 0.00 54.79 53.11 3m1c n ASP 179 Cb 0.51 -0.16 -0.03 0.00 -1.04 0.00 0.00 41.12 40.41 3m1c n ASP 179 CO 0.00 0.00 0.00 -0.83 -0.82 0.00 0.00 177.20 175.55 3m1c s GLY 180 N -0.86 1.48 0.17 0.27 0.00 -0.27 -3.11 107.32 105.00 3m1c s GLY 180 Ca 0.00 1.29 -0.33 0.00 0.00 0.00 0.00 44.72 45.68 3m1c s GLY 180 CO 0.00 2.98 1.16 0.00 0.00 0.00 0.00 173.10 177.24 3m1c n ALA 181 N 5.65 -0.88 -2.39 3.20 0.00 -1.15 -4.54 120.51 120.39 3m1c n ALA 181 Ca 0.17 0.47 -0.20 0.00 0.00 0.00 0.00 53.44 53.87 3m1c n ALA 181 Cb 0.40 -2.02 -0.10 0.00 0.00 0.00 0.00 19.45 17.73 3m1c n ALA 181 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3m1c s THR 182 N -0.18 1.62 0.46 0.00 -4.23 -0.86 -4.28 115.64 108.17 3m1c s THR 182 Ca 0.74 -2.15 0.24 0.00 -1.18 0.00 0.00 61.69 59.34 3m1c s THR 182 Cb -0.86 -2.31 0.43 0.00 1.34 0.00 0.00 72.50 71.10 3m1c s THR 182 CO 0.52 -0.40 1.84 -0.33 -0.54 0.00 0.00 174.62 175.71 3m1c h GLU 183 N 2.39 0.23 -0.02 3.99 5.08 -1.96 -1.38 114.58 122.91 3m1c h GLU 183 Ca -0.39 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 57.95 3m1c h GLU 183 Cb 1.23 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 30.42 3m1c h GLU 183 CO 0.65 0.16 -0.01 0.00 -1.00 0.00 0.00 179.01 178.81 3m1c h ARG 184 N 0.24 0.04 -3.59 2.33 3.08 -2.00 -3.40 114.38 111.08 3m1c h ARG 184 Ca 0.50 -0.02 -0.64 0.00 0.07 0.00 0.00 59.98 59.90 3m1c h ARG 184 Cb 1.55 -0.00 -0.41 0.00 0.08 0.00 0.00 29.97 31.19 3m1c h ARG 184 CO -0.14 0.42 -0.66 -1.01 -1.07 0.00 0.00 179.97 177.51 3m1c s HIS 185 N -4.64 3.18 -1.12 3.04 3.76 -0.54 -4.98 115.29 113.99 3m1c s HIS 185 Ca -0.15 -3.08 0.08 0.00 -0.15 0.00 0.00 55.06 51.76 3m1c s HIS 185 Cb 0.03 -2.76 0.37 0.00 1.11 0.00 0.00 32.58 31.33 3m1c s HIS 185 CO 0.68 -0.78 1.23 -2.30 -0.85 0.00 0.00 174.74 172.72 3m1c n PRO 186 N 3.36 0.03 -0.07 8.40 -0.02 -1.09 -2.02 135.00 143.60 3m1c n PRO 186 Ca 0.05 0.32 -0.05 0.00 -2.02 0.00 0.00 63.50 61.79 3m1c n PRO 186 Cb 0.34 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 32.19 3m1c n PRO 186 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3m1c n ASP 187 N -1.44 1.06 0.00 2.55 10.43 -1.26 -4.65 116.55 123.24 3m1c n ASP 187 Ca 0.03 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.39 3m1c n ASP 187 Cb 0.09 1.04 0.00 0.00 1.84 0.00 0.00 41.12 44.09 3m1c n ASP 187 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3m1c n GLY 188 N 1.93 4.28 0.20 0.44 0.00 -0.86 -3.44 105.19 107.75 3m1c n GLY 188 Ca -0.22 -1.03 -0.14 0.00 0.00 0.00 0.00 46.02 44.63 3m1c n GLY 188 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3m1c h ARG 189 N 0.00 -0.41 -0.66 1.61 3.08 -1.76 -3.22 114.38 113.03 3m1c h ARG 189 Ca 0.00 0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.08 3m1c h ARG 189 Cb 0.00 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.14 3m1c h ARG 189 CO 0.00 -0.13 0.00 0.54 -1.07 0.00 0.00 179.97 179.31 3m1c n ARG 190 N -5.17 3.59 -1.67 0.04 1.74 -1.26 -4.96 116.66 108.96 3m1c n ARG 190 Ca -0.10 -2.73 -0.37 0.00 -0.77 0.00 0.00 57.85 53.88 3m1c n ARG 190 Cb 0.25 -1.86 0.06 0.00 -1.02 0.00 0.00 32.46 29.89 3m1c n ARG 190 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3m1c n ASN 191 N 1.10 1.45 -3.57 0.55 5.15 -1.22 -4.77 115.26 113.95 3m1c n ASN 191 Ca 0.25 0.81 -0.29 0.00 -0.60 0.00 0.00 54.58 54.75 3m1c n ASN 191 Cb 0.85 -1.48 -0.12 0.00 -0.53 0.00 0.00 39.78 38.50 3m1c n ASN 191 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3m1c s ALA 192 N -1.45 1.53 0.59 5.20 0.00 -1.26 -4.99 121.76 121.38 3m1c s ALA 192 Ca 0.80 -2.24 -0.19 0.00 0.00 0.00 0.00 51.96 50.33 3m1c s ALA 192 Cb -0.39 -1.74 -0.04 0.00 0.00 0.00 0.00 23.12 20.95 3m1c s ALA 192 CO 0.43 -2.08 1.15 -2.30 0.00 0.00 0.00 175.76 172.96 3m1c n PRO 193 N 3.74 1.16 -2.14 0.00 -0.02 -1.26 -4.69 135.00 131.79 3m1c n PRO 193 Ca 0.11 0.44 -0.42 0.00 -2.02 0.00 0.00 63.50 61.61 3m1c n PRO 193 Cb 0.36 -2.35 -0.03 0.00 -0.02 0.00 0.00 33.50 31.46 3m1c n PRO 193 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3m1c s PRO 194 N -2.92 4.26 0.70 0.52 0.05 -1.26 -4.97 135.00 131.38 3m1c s PRO 194 Ca 0.76 2.06 -0.12 0.00 0.05 0.00 0.00 61.00 63.76 3m1c s PRO 194 Cb -0.41 -3.57 0.02 0.00 0.05 0.00 0.00 34.50 30.58 3m1c s PRO 194 CO 0.46 -0.61 1.07 -2.14 0.05 0.00 0.00 177.00 175.83 3m1c s PRO 195 N 2.41 2.77 0.46 0.56 0.02 -1.26 -5.02 135.00 134.95 3m1c s PRO 195 Ca 0.66 1.09 -0.12 0.00 0.02 0.00 0.00 61.00 62.66 3m1c s PRO 195 Cb -0.34 -1.96 -0.06 0.00 0.02 0.00 0.00 34.50 32.15 3m1c s PRO 195 CO 0.28 -1.24 0.85 0.20 -0.33 0.00 0.00 177.00 176.76 3m1c s GLY 196 N -3.44 1.91 0.19 0.52 0.00 -1.26 -5.00 107.32 100.25 3m1c s GLY 196 Ca 0.60 -0.12 -0.33 0.00 0.00 0.00 0.00 44.72 44.88 3m1c s GLY 196 CO 0.52 0.10 1.61 -1.55 0.00 0.00 0.00 173.10 173.78 3m1c n PRO 197 N -1.56 2.40 -0.63 2.90 -0.04 -1.26 -4.92 135.00 131.88 3m1c n PRO 197 Ca 0.04 0.86 -0.30 0.00 -0.04 0.00 0.00 63.50 64.05 3m1c n PRO 197 Cb 0.54 -2.65 0.19 0.00 -0.04 0.00 0.00 33.50 31.54 3m1c n PRO 197 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3m1c n PRO 198 N 3.38 -0.93 -1.65 0.54 -0.02 -1.26 -4.85 135.00 130.21 3m1c n PRO 198 Ca 0.15 -0.21 -0.53 0.00 -2.02 0.00 0.00 63.50 60.89 3m1c n PRO 198 Cb 0.32 -2.33 -0.06 0.00 -0.02 0.00 0.00 33.50 31.40 3m1c n PRO 198 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3m1c n ALA 199 N -4.43 -0.37 -3.42 3.55 0.00 -1.26 -2.40 120.51 112.17 3m1c n ALA 199 Ca 0.10 0.45 -0.19 0.00 0.00 0.00 0.00 53.44 53.79 3m1c n ALA 199 Cb 0.52 -2.18 0.07 0.00 0.00 0.00 0.00 19.45 17.87 3m1c n ALA 199 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1c n GLY 200 N 3.37 -0.35 3.72 0.00 0.00 -1.26 -5.02 105.19 105.65 3m1c n GLY 200 Ca 0.22 0.12 -0.35 0.00 0.00 0.00 0.00 46.02 46.00 3m1c n GLY 200 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3m1c s THR 201 N -3.30 4.94 0.88 2.61 -4.23 -1.01 -5.10 115.64 110.43 3m1c s THR 201 Ca 0.35 0.01 -0.11 0.00 -1.18 0.00 0.00 61.69 60.75 3m1c s THR 201 Cb -0.15 -3.18 0.12 0.00 1.34 0.00 0.00 72.50 70.63 3m1c s THR 201 CO 0.65 0.53 1.09 -2.84 -0.54 0.00 0.00 174.62 173.52 3m1c s PRO 202 N -0.29 1.40 -0.47 3.99 0.02 -1.26 -4.98 135.00 133.42 3m1c s PRO 202 Ca 0.09 0.97 0.04 0.00 0.02 0.00 0.00 61.00 62.11 3m1c s PRO 202 Cb -0.12 -1.81 0.16 0.00 0.02 0.00 0.00 34.50 32.75 3m1c s PRO 202 CO 0.01 -2.18 0.35 1.03 -0.33 0.00 0.00 177.00 175.88 3m1c s ARG 203 N -4.88 1.21 1.07 5.54 0.52 -1.26 -4.36 118.95 116.78 3m1c s ARG 203 Ca 0.63 -2.27 -0.12 0.00 -0.52 0.00 0.00 55.73 53.45 3m1c s ARG 203 Cb -0.18 -1.87 0.23 0.00 0.52 0.00 0.00 34.95 33.65 3m1c s ARG 203 CO 0.57 -1.33 1.06 -1.01 0.02 0.00 0.00 175.30 174.61 3m1c s HIS 204 N -0.12 1.61 0.39 -0.53 3.76 -1.03 -3.96 115.29 115.42 3m1c s HIS 204 Ca 0.29 1.27 -0.03 0.00 -0.15 0.00 0.00 55.06 56.44 3m1c s HIS 204 Cb -0.02 -3.17 -0.04 0.00 1.11 0.00 0.00 32.58 30.46 3m1c s HIS 204 CO -0.16 -3.39 0.66 -1.25 -0.85 0.00 0.00 174.74 169.75 3m1c s PRO 205 N -4.62 3.55 -1.50 8.40 0.05 -1.26 -3.35 135.00 136.27 3m1c s PRO 205 Ca 0.67 -0.02 -0.12 0.00 0.05 0.00 0.00 61.00 61.59 3m1c s PRO 205 Cb -0.23 -2.53 0.01 0.00 0.05 0.00 0.00 34.50 31.80 3m1c s PRO 205 CO 0.62 0.01 2.48 0.25 0.05 0.00 0.00 177.00 180.40 3m1c n THR 206 N -1.80 3.95 0.07 1.26 -2.24 -1.26 -3.66 114.28 110.59 3m1c n THR 206 Ca -0.02 -3.04 0.00 0.00 -2.27 0.00 0.00 64.05 58.72 3m1c n THR 206 Cb 0.55 -2.56 0.00 0.00 -2.10 0.00 0.00 70.33 66.22 3m1c n THR 206 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3m1c n THR 207 N 4.21 0.00 -1.05 4.28 -2.24 -1.26 -4.46 114.28 113.76 3m1c n THR 207 Ca 0.61 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 62.16 3m1c n THR 207 Cb 0.32 -0.16 -0.08 0.00 -2.10 0.00 0.00 70.33 68.30 3m1c n THR 207 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3m1c n ASN 208 N -2.80 6.44 -4.34 3.42 3.02 -1.24 -4.89 115.26 114.87 3m1c n ASN 208 Ca 0.00 -2.45 -0.41 0.00 -0.03 0.00 0.00 54.58 51.69 3m1c n ASN 208 Cb 0.00 -1.37 -0.11 0.00 -0.61 0.00 0.00 39.78 37.69 3m1c n ASN 208 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3m1c s LEU 209 N 0.08 4.91 0.37 3.41 1.43 -1.26 -4.91 118.68 122.71 3m1c s LEU 209 Ca 0.62 -1.19 0.05 0.00 -1.03 0.00 0.00 54.13 52.57 3m1c s LEU 209 Cb 0.22 -2.02 -0.01 0.00 0.03 0.00 0.00 46.19 44.42 3m1c s LEU 209 CO -0.03 -0.45 0.52 -0.94 0.23 0.00 0.00 176.35 175.68 3m1c s SER 210 N 1.80 5.93 0.51 2.29 1.04 -1.26 -4.97 113.70 119.05 3m1c s SER 210 Ca 0.02 -0.06 0.29 0.00 0.48 0.00 0.00 55.95 56.67 3m1c s SER 210 Cb -0.21 -1.31 1.36 0.00 0.10 0.00 0.00 66.02 65.97 3m1c s SER 210 CO 0.05 -0.51 2.01 0.16 0.98 0.00 0.00 173.24 175.93 3m1c h ILE 211 N 0.76 0.43 -0.12 -1.02 3.07 -1.98 -1.30 117.51 117.35 3m1c h ILE 211 Ca -0.46 -0.66 -0.05 0.00 1.55 0.00 0.00 64.86 65.23 3m1c h ILE 211 Cb 1.26 1.47 -0.00 0.00 -0.27 0.00 0.00 36.82 39.27 3m1c h ILE 211 CO 0.54 0.12 -0.13 0.00 -1.05 0.00 0.00 178.15 177.63 3m1c h ALA 212 N 1.88 0.18 -0.50 0.16 0.00 -2.00 -2.14 119.26 116.84 3m1c h ALA 212 Ca -0.00 -0.32 0.10 0.00 0.00 0.00 0.00 54.91 54.69 3m1c h ALA 212 Cb 0.46 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.12 3m1c h ALA 212 CO 0.02 0.06 -0.09 0.45 0.00 0.00 0.00 179.25 179.68 3m1c h HIS 213 N -0.08 -0.21 -0.54 0.00 3.86 -1.78 -1.26 115.15 115.15 3m1c h HIS 213 Ca 0.02 0.04 0.06 0.00 -1.16 0.00 0.00 60.37 59.33 3m1c h HIS 213 Cb 0.67 0.17 -0.03 0.00 1.06 0.00 0.00 27.41 29.28 3m1c h HIS 213 CO 0.09 -0.19 0.36 1.25 0.86 0.00 0.00 177.93 180.29 3m1c h LEU 214 N 0.02 0.45 0.00 2.43 5.85 -1.13 -1.69 115.31 121.24 3m1c h LEU 214 Ca 0.24 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.91 3m1c h LEU 214 Cb 0.37 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.31 3m1c h LEU 214 CO -0.49 0.29 -0.20 -0.74 -0.34 0.00 0.00 178.44 176.96 3m1c h HIS 215 N 0.51 0.20 0.00 1.25 2.76 -0.59 -3.02 115.15 116.26 3m1c h HIS 215 Ca 0.23 -0.11 0.00 0.00 -2.20 0.00 0.00 60.37 58.29 3m1c h HIS 215 Cb 0.26 -0.02 0.00 0.00 1.55 0.00 0.00 27.41 29.20 3m1c h HIS 215 CO -0.00 0.92 0.00 0.09 -1.30 0.00 0.00 177.93 177.64 3m1c n ASN 216 N -4.54 3.72 0.17 3.26 3.02 -0.61 -4.47 115.26 115.80 3m1c n ASN 216 Ca -0.10 -2.12 0.13 0.00 -0.03 0.00 0.00 54.58 52.47 3m1c n ASN 216 Cb 0.49 -0.69 0.51 0.00 -0.61 0.00 0.00 39.78 39.47 3m1c n ASN 216 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3m1c h ALA 217 N 1.69 1.00 -0.02 5.41 0.00 -1.18 -1.52 119.26 124.64 3m1c h ALA 217 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3m1c h ALA 217 Cb 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3m1c h ALA 217 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.12 3m1c n SER 218 N -2.48 0.19 -0.40 0.00 3.41 -1.26 -1.01 113.62 112.06 3m1c n SER 218 Ca 0.02 -1.60 0.00 0.00 -0.26 0.00 0.00 58.87 57.04 3m1c n SER 218 Cb 0.29 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.22 3m1c n SER 218 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 3m1c n VAL 219 N -0.59 0.00 -4.00 -3.33 0.31 -0.59 -4.91 118.33 105.22 3m1c n VAL 219 Ca 0.11 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 64.09 3m1c n VAL 219 Cb 0.08 0.33 -0.14 0.00 -0.91 0.00 0.00 33.84 33.20 3m1c n VAL 219 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3m1c s THR 220 N 0.00 3.50 -0.12 2.52 2.01 -1.07 -5.05 115.64 117.42 3m1c s THR 220 Ca 0.00 -0.46 -0.04 0.00 0.31 0.00 0.00 61.69 61.50 3m1c s THR 220 Cb 0.00 -2.59 -0.04 0.00 0.01 0.00 0.00 72.50 69.89 3m1c s THR 220 CO 0.00 0.43 0.04 0.26 -0.69 0.00 0.00 174.62 174.65 3m1c s TRP 221 N 1.31 3.25 -0.08 4.92 0.52 -1.26 -0.97 118.94 126.63 3m1c s TRP 221 Ca 0.04 0.18 -0.01 0.00 0.02 0.00 0.00 56.10 56.34 3m1c s TRP 221 Cb -0.14 -1.89 -0.03 0.00 -1.15 0.00 0.00 33.47 30.25 3m1c s TRP 221 CO -0.01 0.41 -0.03 -0.51 0.02 0.00 0.00 176.95 176.82 3m1c s LEU 222 N -0.53 3.38 0.24 2.99 1.43 -0.19 -2.46 118.68 123.54 3m1c s LEU 222 Ca 0.10 0.06 -0.30 0.00 -1.03 0.00 0.00 54.13 52.96 3m1c s LEU 222 Cb -0.12 -1.76 -0.09 0.00 0.03 0.00 0.00 46.19 44.26 3m1c s LEU 222 CO 0.02 0.37 1.13 0.00 0.23 0.00 0.00 176.35 178.10 3m1c s ALA 223 N -0.81 3.41 0.20 4.21 0.00 -1.21 -0.32 121.76 127.22 3m1c s ALA 223 Ca 0.12 0.91 0.06 0.00 0.00 0.00 0.00 51.96 53.05 3m1c s ALA 223 Cb -0.11 -3.36 0.08 0.00 0.00 0.00 0.00 23.12 19.73 3m1c s ALA 223 CO 0.02 -0.24 1.45 0.00 0.00 0.00 0.00 175.76 176.99 3m1c h ALA 224 N 4.42 0.66 -2.07 0.00 0.00 -1.88 -3.39 119.26 116.99 3m1c h ALA 224 Ca -0.46 -0.70 -0.57 0.00 0.00 0.00 0.00 54.91 53.19 3m1c h ALA 224 Cb 1.21 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3m1c h ALA 224 CO 0.70 0.93 1.26 1.03 0.00 0.00 0.00 179.25 183.17 3m1c s ARG 225 N -3.26 3.65 0.00 0.00 0.52 -1.26 -0.45 118.95 118.15 3m1c s ARG 225 Ca -0.01 1.93 0.00 0.00 -0.52 0.00 0.00 55.73 57.13 3m1c s ARG 225 Cb 0.11 -4.16 0.00 0.00 0.52 0.00 0.00 34.95 31.42 3m1c s ARG 225 CO 0.80 -1.49 0.00 0.41 0.02 0.00 0.00 175.30 175.05 3m1c n GLY 226 N 4.99 0.16 0.33 -3.53 0.00 -1.26 -4.84 105.19 101.03 3m1c n GLY 226 Ca 0.22 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.07 3m1c n GLY 226 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3m1c n LEU 227 N 0.00 1.60 -4.74 0.99 7.94 -0.39 -4.70 117.00 117.71 3m1c n LEU 227 Ca 0.00 0.27 -0.37 0.00 -1.11 0.00 0.00 56.01 54.80 3m1c n LEU 227 Cb 0.00 -0.64 0.05 0.00 0.53 0.00 0.00 43.42 43.36 3m1c n LEU 227 CO 0.00 0.14 0.93 -0.76 -1.11 0.00 0.00 177.39 176.59 3m1c s LEU 228 N -7.37 3.73 0.26 -1.96 1.02 0.40 -0.52 118.68 114.25 3m1c s LEU 228 Ca -0.27 2.66 -0.31 0.00 0.02 0.00 0.00 54.13 56.23 3m1c s LEU 228 Cb 0.08 -4.44 -0.13 0.00 0.02 0.00 0.00 46.19 41.72 3m1c s LEU 228 CO 0.36 -1.72 1.48 -1.14 0.02 0.00 0.00 176.35 175.35 3m1c n ARG 229 N -1.42 2.30 -2.90 1.70 0.63 -0.30 -3.96 116.66 112.73 3m1c n ARG 229 Ca 0.13 0.82 -0.41 0.00 -0.92 0.00 0.00 57.85 57.47 3m1c n ARG 229 Cb 0.47 -2.53 -0.04 0.00 0.45 0.00 0.00 32.46 30.81 3m1c n ARG 229 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3m1c s THR 230 N -0.06 4.94 0.42 5.15 -4.23 -1.26 -4.85 115.64 115.75 3m1c s THR 230 Ca 0.66 1.68 -0.26 0.00 -1.18 0.00 0.00 61.69 62.59 3m1c s THR 230 Cb -0.59 -4.15 -0.09 0.00 1.34 0.00 0.00 72.50 69.01 3m1c s THR 230 CO 0.49 0.14 1.45 -2.65 -0.54 0.00 0.00 174.62 173.52 3m1c n PRO 231 N 4.38 2.41 -3.79 3.99 -0.02 -1.26 -4.98 135.00 135.73 3m1c n PRO 231 Ca 0.03 0.85 -0.12 0.00 -2.02 0.00 0.00 63.50 62.24 3m1c n PRO 231 Cb 0.50 -2.64 -0.08 0.00 -0.02 0.00 0.00 33.50 31.25 3m1c n PRO 231 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3m1c s GLY 232 N -0.34 -0.08 0.65 -1.23 0.00 -1.22 -4.93 107.32 100.17 3m1c s GLY 232 Ca 0.58 0.02 -0.18 0.00 0.00 0.00 0.00 44.72 45.15 3m1c s GLY 232 CO 0.60 -0.17 1.27 -2.13 0.00 0.00 0.00 173.10 172.66 3m1c n ARG 233 N 0.92 1.07 -3.63 2.90 0.63 -1.26 -2.33 116.66 114.95 3m1c n ARG 233 Ca -0.20 0.42 -0.14 0.00 -0.92 0.00 0.00 57.85 57.01 3m1c n ARG 233 Cb 0.58 -2.51 -0.07 0.00 0.45 0.00 0.00 32.46 30.91 3m1c n ARG 233 CO 0.00 0.00 0.00 -0.47 -2.51 0.00 0.00 177.63 174.65 3m1c s TYR 234 N -1.42 -0.78 -0.21 -0.14 5.04 0.84 -4.80 117.35 115.89 3m1c s TYR 234 Ca 0.82 1.91 -0.05 0.00 -2.44 0.00 0.00 57.07 57.31 3m1c s TYR 234 Cb -0.38 0.27 -0.02 0.00 0.35 0.00 0.00 41.96 42.18 3m1c s TYR 234 CO 0.41 -0.38 0.01 0.08 -1.34 0.00 0.00 175.55 174.33 3m1c s VAL 235 N 0.39 3.98 -0.27 3.14 1.01 -1.26 -0.51 120.40 126.88 3m1c s VAL 235 Ca -0.00 -0.30 -0.13 0.00 0.00 0.00 0.00 61.98 61.54 3m1c s VAL 235 Cb -0.05 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.48 3m1c s VAL 235 CO 0.01 0.42 0.30 -0.47 0.00 0.00 0.00 175.10 175.36 3m1c s TYR 236 N 1.07 3.24 -0.33 5.22 5.04 0.06 -4.95 117.35 126.71 3m1c s TYR 236 Ca 0.02 0.30 -0.11 0.00 -2.44 0.00 0.00 57.07 54.85 3m1c s TYR 236 Cb -0.14 -2.49 -0.01 0.00 0.35 0.00 0.00 41.96 39.67 3m1c s TYR 236 CO 0.02 -0.19 0.19 -0.51 -1.34 0.00 0.00 175.55 173.71 3m1c s LEU 237 N 1.91 4.29 0.35 6.97 1.43 -1.26 -1.86 118.68 130.52 3m1c s LEU 237 Ca 0.12 -0.53 -0.29 0.00 -1.03 0.00 0.00 54.13 52.41 3m1c s LEU 237 Cb -0.16 -2.05 -0.11 0.00 0.03 0.00 0.00 46.19 43.90 3m1c s LEU 237 CO 0.10 -0.22 1.49 -0.24 0.23 0.00 0.00 176.35 177.71 3m1c n SER 238 N 5.02 3.67 0.11 2.29 2.88 -1.26 -4.86 113.62 121.47 3m1c n SER 238 Ca -0.13 1.21 0.09 0.00 -1.33 0.00 0.00 58.87 58.70 3m1c n SER 238 Cb 0.49 -1.60 0.43 0.00 -0.75 0.00 0.00 64.21 62.78 3m1c n SER 238 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 3m1c n PRO 239 N 0.89 0.12 0.20 -1.46 -0.02 -1.26 -2.33 135.00 131.13 3m1c n PRO 239 Ca 0.04 0.51 0.10 0.00 -2.02 0.00 0.00 63.50 62.13 3m1c n PRO 239 Cb 0.38 -1.80 0.13 0.00 -0.02 0.00 0.00 33.50 32.19 3m1c n PRO 239 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3m1c h SER 240 N 0.00 0.00 -1.96 2.55 4.64 -1.97 -3.46 113.55 113.35 3m1c h SER 240 Ca 0.00 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.03 3m1c h SER 240 Cb 0.13 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.13 3m1c h SER 240 CO 0.00 0.09 -0.30 0.00 -0.87 0.00 0.00 176.83 175.75 3m1c n ALA 241 N -2.13 -0.36 -1.12 5.18 0.00 -0.98 -4.65 120.51 116.44 3m1c n ALA 241 Ca 0.03 0.20 0.07 0.00 0.00 0.00 0.00 53.44 53.75 3m1c n ALA 241 Cb 0.57 -1.55 0.21 0.00 0.00 0.00 0.00 19.45 18.68 3m1c n ALA 241 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3m1c n SER 242 N -0.98 3.02 -3.80 0.00 7.64 -1.26 -4.86 113.62 113.37 3m1c n SER 242 Ca -0.15 -3.20 -0.12 0.00 1.01 0.00 0.00 58.87 56.41 3m1c n SER 242 Cb 0.52 -0.51 -0.10 0.00 -1.01 0.00 0.00 64.21 63.11 3m1c n SER 242 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3m1c s THR 243 N -2.93 0.05 0.35 0.44 2.01 -1.26 -0.35 115.64 113.96 3m1c s THR 243 Ca 0.39 -0.43 -0.29 0.00 0.31 0.00 0.00 61.69 61.67 3m1c s THR 243 Cb 0.33 -0.49 -0.11 0.00 0.01 0.00 0.00 72.50 72.24 3m1c s THR 243 CO 0.05 -0.23 1.52 0.26 -0.69 0.00 0.00 174.62 175.52 3m1c s TRP 244 N -0.97 2.63 0.29 4.92 0.23 -1.26 -4.75 118.94 120.03 3m1c s TRP 244 Ca -0.10 1.06 -0.28 0.00 -2.03 0.00 0.00 56.10 54.74 3m1c s TRP 244 Cb -0.05 -4.04 -0.14 0.00 0.03 0.00 0.00 33.47 29.27 3m1c s TRP 244 CO 0.02 -3.17 1.05 -2.30 0.96 0.00 0.00 176.95 173.51 3m1c n PRO 245 N 0.93 1.46 -4.12 4.98 -0.02 -1.26 -4.78 135.00 132.18 3m1c n PRO 245 Ca 0.03 0.51 -0.34 0.00 -2.02 0.00 0.00 63.50 61.68 3m1c n PRO 245 Cb 0.39 -1.91 -0.11 0.00 -0.02 0.00 0.00 33.50 31.84 3m1c n PRO 245 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3m1c s VAL 246 N -1.04 4.34 -0.17 -1.45 1.01 -0.78 -1.09 120.40 121.22 3m1c s VAL 246 Ca 0.58 -0.19 -0.19 0.00 0.00 0.00 0.00 61.98 62.19 3m1c s VAL 246 Cb -0.69 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 3m1c s VAL 246 CO 0.60 0.45 0.52 -0.83 0.00 0.00 0.00 175.10 175.84 3m1c s GLY 247 N 0.57 2.17 0.21 4.51 0.00 0.10 -0.76 107.32 114.13 3m1c s GLY 247 Ca 0.01 -0.32 -0.01 0.00 0.00 0.00 0.00 44.72 44.39 3m1c s GLY 247 CO 0.02 1.01 0.16 -1.34 0.00 0.00 0.00 173.10 172.95 3m1c s VAL 248 N 1.36 0.00 -0.46 1.40 -7.23 0.33 -1.76 120.40 114.04 3m1c s VAL 248 Ca 0.25 -1.97 -0.12 0.00 -1.81 0.00 0.00 61.98 58.33 3m1c s VAL 248 Cb -0.15 -2.49 0.09 0.00 0.56 0.00 0.00 36.38 34.39 3m1c s VAL 248 CO 0.10 0.00 0.34 0.26 -0.31 0.00 0.00 175.10 175.49 3m1c s TRP 249 N -4.12 3.30 0.34 2.82 0.52 -1.26 -0.11 118.94 120.44 3m1c s TRP 249 Ca 0.38 -1.32 -0.26 0.00 0.02 0.00 0.00 56.10 54.92 3m1c s TRP 249 Cb 0.06 -3.18 -0.10 0.00 -1.15 0.00 0.00 33.47 29.11 3m1c s TRP 249 CO 0.13 -0.86 0.99 -0.08 0.02 0.00 0.00 176.95 177.15 3m1c s THR 250 N 1.52 3.98 -0.20 2.01 -1.32 -0.99 -0.31 115.64 120.34 3m1c s THR 250 Ca 0.04 1.64 0.15 0.00 -1.21 0.00 0.00 61.69 62.30 3m1c s THR 250 Cb -0.25 -3.90 0.46 0.00 -1.51 0.00 0.00 72.50 67.30 3m1c s THR 250 CO 0.04 0.13 1.36 0.35 -2.21 0.00 0.00 174.62 174.28 3m1c n THR 251 N 0.44 2.26 -0.25 5.08 -2.24 0.00 -3.42 114.28 116.15 3m1c n THR 251 Ca 0.03 -2.25 0.00 0.00 -2.27 0.00 0.00 64.05 59.55 3m1c n THR 251 Cb 0.49 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.45 3m1c n THR 251 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3m1c n GLY 252 N -0.91 -1.89 3.82 3.38 0.00 -1.24 -4.61 105.19 103.75 3m1c n GLY 252 Ca 0.23 -1.97 -0.06 0.00 0.00 0.00 0.00 46.02 44.22 3m1c n GLY 252 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3m1c s GLY 253 N -0.00 0.06 -0.06 -0.02 0.00 -1.08 -0.80 107.32 105.43 3m1c s GLY 253 Ca 0.00 -0.35 0.01 0.00 0.00 0.00 0.00 44.72 44.38 3m1c s GLY 253 CO 0.00 0.38 -0.07 -2.27 0.00 0.00 0.00 173.10 171.14 3m1c s LEU 254 N -3.07 1.42 0.02 0.66 0.20 -0.99 -0.89 118.68 116.03 3m1c s LEU 254 Ca 0.15 -0.20 0.02 0.00 0.69 0.00 0.00 54.13 54.79 3m1c s LEU 254 Cb -0.04 -0.61 -0.01 0.00 -0.43 0.00 0.00 46.19 45.10 3m1c s LEU 254 CO 0.07 -0.03 -0.07 0.00 -0.29 0.00 0.00 176.35 176.04 3m1c s ALA 255 N 0.88 0.51 0.08 5.97 0.00 -0.44 -0.97 121.76 127.80 3m1c s ALA 255 Ca -0.11 -0.49 -0.20 0.00 0.00 0.00 0.00 51.96 51.16 3m1c s ALA 255 Cb -0.15 -0.04 0.05 0.00 0.00 0.00 0.00 23.12 22.98 3m1c s ALA 255 CO 0.01 0.05 0.48 -0.59 0.00 0.00 0.00 175.76 175.70 3m1c s PHE 256 N -0.74 -0.35 -0.03 0.00 -0.12 -0.48 0.06 117.98 116.33 3m1c s PHE 256 Ca -0.04 0.24 -0.13 0.00 -0.05 0.00 0.00 56.93 56.95 3m1c s PHE 256 Cb -0.06 0.32 0.04 0.00 -0.63 0.00 0.00 43.02 42.70 3m1c s PHE 256 CO 0.00 -0.67 0.60 0.41 -0.05 0.00 0.00 175.22 175.51 3m1c n GLY 257 N 0.15 0.33 0.00 1.99 0.00 -0.94 -0.81 105.19 105.91 3m1c n GLY 257 Ca -0.18 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 44.94 3m1c n GLY 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1c n ASP 259 N -0.35 0.05 -0.41 0.00 5.68 -1.26 -3.24 116.55 117.01 3m1c n ASP 259 Ca 0.00 -1.35 0.00 0.00 -0.50 0.00 0.00 54.79 52.94 3m1c n ASP 259 Cb 0.00 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 39.95 3m1c n ASP 259 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3m1c n ALA 260 N -0.45 1.83 -3.62 2.12 0.00 -1.26 -4.99 120.51 114.14 3m1c n ALA 260 Ca 0.00 -0.32 -0.06 0.00 0.00 0.00 0.00 53.44 53.06 3m1c n ALA 260 Cb 0.01 -0.14 -0.06 0.00 0.00 0.00 0.00 19.45 19.26 3m1c n ALA 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m1c s ALA 261 N 0.00 -2.05 -0.07 0.00 0.00 -1.20 -1.27 121.76 117.17 3m1c s ALA 261 Ca 0.00 1.75 -0.03 0.00 0.00 0.00 0.00 51.96 53.68 3m1c s ALA 261 Cb 0.00 -1.31 0.04 0.00 0.00 0.00 0.00 23.12 21.85 3m1c s ALA 261 CO 0.00 -0.23 0.11 -1.17 0.00 0.00 0.00 175.76 174.47 3m1c s LEU 262 N -0.56 0.04 -0.06 0.00 2.96 0.10 -0.79 118.68 120.37 3m1c s LEU 262 Ca 0.04 0.17 0.04 0.00 -0.22 0.00 0.00 54.13 54.16 3m1c s LEU 262 Cb -0.02 0.06 -0.02 0.00 0.50 0.00 0.00 46.19 46.71 3m1c s LEU 262 CO -0.06 -0.25 -0.17 0.68 -1.32 0.00 0.00 176.35 175.23 3m1c s VAL 263 N 2.23 2.83 -0.06 1.68 -7.23 0.01 -1.00 120.40 118.85 3m1c s VAL 263 Ca 0.04 -0.80 -0.03 0.00 -1.81 0.00 0.00 61.98 59.38 3m1c s VAL 263 Cb -0.12 -2.10 0.04 0.00 0.56 0.00 0.00 36.38 34.76 3m1c s VAL 263 CO -0.05 0.58 0.08 -0.60 -0.31 0.00 0.00 175.10 174.80 3m1c s ARG 264 N -0.52 -0.04 -0.10 4.82 3.52 -0.15 -1.38 118.95 125.09 3m1c s ARG 264 Ca 0.07 0.36 -0.02 0.00 -0.13 0.00 0.00 55.73 56.01 3m1c s ARG 264 Cb -0.11 -0.63 -0.03 0.00 -1.56 0.00 0.00 34.95 32.62 3m1c s ARG 264 CO 0.01 -0.37 -0.03 0.00 -0.81 0.00 0.00 175.30 174.10 3m1c s ALA 265 N 2.19 3.11 -0.15 6.12 0.00 -0.14 -0.96 121.76 131.91 3m1c s ALA 265 Ca 0.04 -0.84 0.02 0.00 0.00 0.00 0.00 51.96 51.18 3m1c s ALA 265 Cb -0.12 -1.42 0.02 0.00 0.00 0.00 0.00 23.12 21.59 3m1c s ALA 265 CO -0.04 0.48 -0.20 0.50 0.00 0.00 0.00 175.76 176.50 3m1c s ARG 266 N -0.50 2.85 -0.04 0.00 6.06 0.29 -2.35 118.95 125.26 3m1c s ARG 266 Ca 0.08 -0.78 -0.05 0.00 -2.50 0.00 0.00 55.73 52.48 3m1c s ARG 266 Cb -0.12 -2.40 -0.04 0.00 0.06 0.00 0.00 34.95 32.45 3m1c s ARG 266 CO 0.02 -0.12 0.18 0.71 -2.50 0.00 0.00 175.30 173.60 3m1c s TYR 267 N 1.09 3.57 0.11 5.12 2.02 0.02 -0.00 117.35 129.28 3m1c s TYR 267 Ca -0.01 0.45 -0.05 0.00 -0.37 0.00 0.00 57.07 57.09 3m1c s TYR 267 Cb -0.14 -1.89 -0.02 0.00 -0.40 0.00 0.00 41.96 39.50 3m1c s TYR 267 CO -0.07 0.67 0.12 0.20 -1.57 0.00 0.00 175.55 174.90 3m1c s GLY 268 N -1.61 0.50 -0.00 0.71 0.00 0.13 -0.82 107.32 106.23 3m1c s GLY 268 Ca 0.23 -1.04 -0.30 0.00 0.00 0.00 0.00 44.72 43.61 3m1c s GLY 268 CO 0.14 -1.08 1.53 0.54 0.00 0.00 0.00 173.10 174.23 3m1c s LYS 269 N -3.95 4.23 0.00 2.90 1.02 0.58 -1.52 119.74 123.01 3m1c s LYS 269 Ca 0.13 2.12 0.00 0.00 0.02 0.00 0.00 55.97 58.24 3m1c s LYS 269 Cb 0.06 -3.70 0.00 0.00 -0.52 0.00 0.00 37.83 33.67 3m1c s LYS 269 CO -0.05 -0.70 0.00 0.41 -0.92 0.00 0.00 175.35 174.09 3m1c n GLY 270 N 3.87 0.79 3.19 -3.33 0.00 -1.26 -4.71 105.19 103.75 3m1c n GLY 270 Ca 0.15 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 3m1c n GLY 270 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3m1c s PHE 271 N -3.20 -0.19 -0.03 1.61 2.19 -0.57 -3.03 117.98 114.76 3m1c s PHE 271 Ca 0.00 0.36 0.02 0.00 0.33 0.00 0.00 56.93 57.64 3m1c s PHE 271 Cb 0.00 0.07 0.01 0.00 -1.31 0.00 0.00 43.02 41.79 3m1c s PHE 271 CO 0.00 -0.29 -0.08 1.41 1.83 0.00 0.00 175.22 178.09 3m1c s MET 272 N -0.84 0.98 -0.23 10.12 1.75 -0.68 0.19 119.30 130.60 3m1c s MET 272 Ca -0.09 -0.26 -0.02 0.00 -1.25 0.00 0.00 55.69 54.07 3m1c s MET 272 Cb -0.05 -0.91 0.01 0.00 2.84 0.00 0.00 34.83 36.72 3m1c s MET 272 CO 0.02 0.05 -0.07 0.20 -0.65 0.00 0.00 175.02 174.57 3m1c s GLY 273 N 0.43 1.59 -0.10 2.11 0.00 0.99 -0.71 107.32 111.62 3m1c s GLY 273 Ca -0.07 -1.33 -0.00 0.00 0.00 0.00 0.00 44.72 43.32 3m1c s GLY 273 CO 0.01 0.46 -0.07 -2.27 0.00 0.00 0.00 173.10 171.23 3m1c s LEU 274 N 1.37 1.14 -0.18 0.66 2.96 -0.63 0.10 118.68 124.10 3m1c s LEU 274 Ca 0.03 -0.27 -0.01 0.00 -0.22 0.00 0.00 54.13 53.66 3m1c s LEU 274 Cb -0.15 -0.78 -0.00 0.00 0.50 0.00 0.00 46.19 45.76 3m1c s LEU 274 CO -0.05 -0.12 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.05 3m1c s VAL 275 N 1.65 2.83 -0.25 1.68 1.01 -0.14 -1.85 120.40 125.33 3m1c s VAL 275 Ca 0.03 -0.70 -0.08 0.00 0.00 0.00 0.00 61.98 61.24 3m1c s VAL 275 Cb -0.13 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 3m1c s VAL 275 CO -0.07 0.49 0.08 -0.63 0.00 0.00 0.00 175.10 174.98 3m1c s ILE 276 N 1.08 4.43 0.07 2.22 1.01 -0.85 -0.98 121.20 128.18 3m1c s ILE 276 Ca 0.00 -0.13 0.07 0.00 0.00 0.00 0.00 60.65 60.59 3m1c s ILE 276 Cb -0.14 -3.08 -0.03 0.00 0.01 0.00 0.00 42.46 39.22 3m1c s ILE 276 CO -0.03 0.33 -0.18 -0.94 0.00 0.00 0.00 174.94 174.11 3m1c s SER 277 N 1.61 2.19 0.12 3.58 1.04 -0.17 -1.85 113.70 120.24 3m1c s SER 277 Ca 0.06 -0.58 0.04 0.00 0.48 0.00 0.00 55.95 55.96 3m1c s SER 277 Cb -0.15 -0.13 -0.04 0.00 0.10 0.00 0.00 66.02 65.79 3m1c s SER 277 CO 0.04 0.06 -0.11 -0.04 0.98 0.00 0.00 173.24 174.17 3m1c s MET 278 N -1.52 0.97 0.08 4.02 -1.94 -1.26 -0.72 119.30 118.94 3m1c s MET 278 Ca 0.04 -1.30 -0.28 0.00 -1.71 0.00 0.00 55.69 52.44 3m1c s MET 278 Cb -0.09 -0.64 -0.16 0.00 2.01 0.00 0.00 34.83 35.94 3m1c s MET 278 CO 0.03 0.10 1.68 -0.09 -0.01 0.00 0.00 175.02 176.72 3m1c h ARG 279 N 3.21 -0.45 -0.57 2.03 2.43 -1.55 -3.28 114.38 116.19 3m1c h ARG 279 Ca -0.37 0.03 -0.20 0.00 -0.81 0.00 0.00 59.98 58.63 3m1c h ARG 279 Cb 1.19 0.10 -0.12 0.00 -0.42 0.00 0.00 29.97 30.73 3m1c h ARG 279 CO 0.57 -0.30 0.17 -0.25 -1.51 0.00 0.00 179.97 178.65 3m1c n ASP 280 N -5.30 3.92 -3.87 -3.80 10.43 -1.26 -4.95 116.55 111.71 3m1c n ASP 280 Ca -0.10 -3.36 -0.11 0.00 2.57 0.00 0.00 54.79 53.79 3m1c n ASP 280 Cb 0.21 -0.69 -0.09 0.00 1.84 0.00 0.00 41.12 42.39 3m1c n ASP 280 CO 0.00 0.00 0.00 -0.44 -1.07 0.00 0.00 177.20 175.69 3m1c s SER 281 N -1.64 0.05 0.69 -2.24 0.01 -1.24 -5.15 113.70 104.18 3m1c s SER 281 Ca 0.50 -0.30 -0.13 0.00 1.31 0.00 0.00 55.95 57.33 3m1c s SER 281 Cb 0.42 0.23 0.01 0.00 0.21 0.00 0.00 66.02 66.89 3m1c s SER 281 CO 0.09 -0.44 1.09 -2.84 0.41 0.00 0.00 173.24 171.54 3m1c s PRO 282 N -1.89 2.75 1.02 12.44 0.02 -1.26 -4.24 135.00 143.85 3m1c s PRO 282 Ca -0.11 1.22 -0.16 0.00 0.02 0.00 0.00 61.00 61.97 3m1c s PRO 282 Cb -0.05 -1.96 0.21 0.00 0.02 0.00 0.00 34.50 32.72 3m1c s PRO 282 CO -0.01 -1.26 1.20 -2.14 -0.33 0.00 0.00 177.00 174.46 3m1c s PRO 283 N -4.48 0.19 -0.00 5.54 0.02 -1.26 -4.69 135.00 130.30 3m1c s PRO 283 Ca 0.63 -0.09 0.00 0.00 0.02 0.00 0.00 61.00 61.57 3m1c s PRO 283 Cb -0.18 -1.76 0.00 0.00 0.02 0.00 0.00 34.50 32.58 3m1c s PRO 283 CO 0.47 -2.77 -0.01 0.00 -0.33 0.00 0.00 177.00 174.36 3m1c s ALA 284 N -3.42 0.11 -0.03 -1.55 0.00 -0.77 -4.86 121.76 111.25 3m1c s ALA 284 Ca 0.70 -0.02 0.02 0.00 0.00 0.00 0.00 51.96 52.65 3m1c s ALA 284 Cb -0.09 -0.05 0.01 0.00 0.00 0.00 0.00 23.12 22.99 3m1c s ALA 284 CO 0.54 0.01 -0.07 -2.00 0.00 0.00 0.00 175.76 174.24 3m1c s GLU 285 N 0.08 0.86 -0.08 0.00 2.12 -0.99 -2.01 118.70 118.68 3m1c s GLU 285 Ca -0.01 -0.24 0.04 0.00 0.36 0.00 0.00 54.97 55.13 3m1c s GLU 285 Cb -0.02 -0.82 -0.00 0.00 0.26 0.00 0.00 34.13 33.55 3m1c s GLU 285 CO -0.00 0.06 -0.23 0.42 -0.54 0.00 0.00 175.26 174.97 3m1c s ILE 286 N 0.33 1.96 -0.20 -3.70 -1.09 -0.77 -0.34 121.20 117.39 3m1c s ILE 286 Ca -0.05 -0.98 0.01 0.00 -2.23 0.00 0.00 60.65 57.40 3m1c s ILE 286 Cb -0.09 -1.69 0.04 0.00 -1.58 0.00 0.00 42.46 39.14 3m1c s ILE 286 CO 0.00 0.54 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.50 3m1c s ILE 287 N 0.22 1.85 -0.20 2.92 1.01 0.33 -1.61 121.20 125.73 3m1c s ILE 287 Ca -0.14 -1.11 -0.10 0.00 0.00 0.00 0.00 60.65 59.30 3m1c s ILE 287 Cb -0.16 -1.86 -0.05 0.00 0.01 0.00 0.00 42.46 40.39 3m1c s ILE 287 CO 0.07 0.23 0.13 -0.69 0.00 0.00 0.00 174.94 174.68 3m1c s VAL 288 N 1.31 5.36 0.11 2.92 1.01 0.11 -1.14 120.40 130.08 3m1c s VAL 288 Ca -0.01 0.17 -0.05 0.00 0.00 0.00 0.00 61.98 62.09 3m1c s VAL 288 Cb -0.16 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 3m1c s VAL 288 CO -0.09 0.44 0.13 0.68 0.00 0.00 0.00 175.10 176.27 3m1c s VAL 289 N 0.34 0.13 0.43 2.92 -7.23 -0.79 -1.68 120.40 114.52 3m1c s VAL 289 Ca 0.08 -1.57 -0.23 0.00 -1.81 0.00 0.00 61.98 58.45 3m1c s VAL 289 Cb -0.11 -1.70 -0.12 0.00 0.56 0.00 0.00 36.38 35.01 3m1c s VAL 289 CO -0.02 -0.59 0.69 -2.65 -0.31 0.00 0.00 175.10 172.23 3m1c n PRO 290 N -0.07 0.78 0.26 4.82 -0.02 -1.17 0.05 135.00 139.65 3m1c n PRO 290 Ca -0.10 0.28 0.17 0.00 -2.02 0.00 0.00 63.50 61.83 3m1c n PRO 290 Cb 0.63 -1.68 0.90 0.00 -0.02 0.00 0.00 33.50 33.33 3m1c n PRO 290 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3m1c h ALA 291 N 0.96 1.60 -0.13 3.55 0.00 -1.52 -1.90 119.26 121.81 3m1c h ALA 291 Ca -0.42 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3m1c h ALA 291 Cb 1.38 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.18 3m1c h ALA 291 CO 0.53 -0.18 0.00 -0.40 0.00 0.00 0.00 179.25 179.20 3m1c n ASP 292 N -3.66 2.03 -4.93 0.00 5.75 -1.26 -4.69 116.55 109.78 3m1c n ASP 292 Ca -0.00 -1.72 -0.25 0.00 -0.01 0.00 0.00 54.79 52.81 3m1c n ASP 292 Cb 0.23 -0.08 -0.01 0.00 -1.03 0.00 0.00 41.12 40.23 3m1c n ASP 292 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3m1c s LYS 293 N -1.84 3.51 -0.12 0.11 -0.14 -0.71 -5.10 119.74 115.44 3m1c s LYS 293 Ca 0.34 -0.20 -0.05 0.00 -1.36 0.00 0.00 55.97 54.71 3m1c s LYS 293 Cb 0.20 -2.60 0.06 0.00 -1.68 0.00 0.00 37.83 33.81 3m1c s LYS 293 CO 0.30 0.07 0.26 0.99 -0.76 0.00 0.00 175.35 176.21 3m1c s THR 294 N -2.40 -0.25 -0.22 2.17 2.01 -1.26 -4.97 115.64 110.72 3m1c s THR 294 Ca 0.42 0.22 -0.05 0.00 0.31 0.00 0.00 61.69 62.59 3m1c s THR 294 Cb -0.10 -0.43 -0.02 0.00 0.01 0.00 0.00 72.50 71.97 3m1c s THR 294 CO 0.38 0.09 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.63 3m1c s LEU 295 N 1.91 3.13 0.33 4.42 1.43 -1.26 -5.06 118.68 123.58 3m1c s LEU 295 Ca -0.04 -0.28 -0.04 0.00 -1.03 0.00 0.00 54.13 52.74 3m1c s LEU 295 Cb -0.11 -1.80 -0.05 0.00 0.03 0.00 0.00 46.19 44.26 3m1c s LEU 295 CO -0.09 0.01 0.60 0.00 0.23 0.00 0.00 176.35 177.10 3m1c s ALA 296 N 1.30 3.59 -0.12 4.21 0.00 -1.26 -1.66 121.76 127.82 3m1c s ALA 296 Ca 0.04 -0.59 -0.27 0.00 0.00 0.00 0.00 51.96 51.14 3m1c s ALA 296 Cb -0.15 -2.33 -0.02 0.00 0.00 0.00 0.00 23.12 20.62 3m1c s ALA 296 CO 0.00 0.10 0.88 -0.98 0.00 0.00 0.00 175.76 175.76 3m1c s ARG 297 N -3.87 4.38 -0.14 0.00 1.04 -0.21 -4.48 118.95 115.68 3m1c s ARG 297 Ca 0.44 1.15 -0.04 0.00 -1.04 0.00 0.00 55.73 56.24 3m1c s ARG 297 Cb -0.10 -3.54 -0.03 0.00 -2.04 0.00 0.00 34.95 29.24 3m1c s ARG 297 CO 0.33 -0.24 -0.01 0.08 -0.04 0.00 0.00 175.30 175.42 3m1c s VAL 298 N 1.80 4.16 0.00 4.99 1.01 0.53 -4.19 120.40 128.70 3m1c s VAL 298 Ca 0.42 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.13 3m1c s VAL 298 Cb -0.18 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.39 3m1c s VAL 298 CO 0.16 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.39 3m1c n GLY 299 N 3.15 0.46 3.61 4.51 0.00 -1.26 -4.49 105.19 111.18 3m1c n GLY 299 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 3m1c n GLY 299 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3m1c s ASN 300 N -2.60 6.72 0.60 1.61 3.84 -1.26 -4.92 114.94 118.93 3m1c s ASN 300 Ca 0.00 0.68 0.36 0.00 0.21 0.00 0.00 52.86 54.11 3m1c s ASN 300 Cb 0.00 -2.46 1.91 0.00 -0.55 0.00 0.00 41.25 40.14 3m1c s ASN 300 CO 0.00 -0.81 2.22 -0.65 -2.79 0.00 0.00 177.10 175.07 3m1c h PRO 301 N 8.32 0.00 0.00 0.43 0.11 -1.99 -2.36 132.00 136.52 3m1c h PRO 301 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 3m1c h PRO 301 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3m1c h PRO 301 CO 0.97 0.03 0.00 0.25 -0.21 0.00 0.00 178.00 179.04 3m1c n THR 302 N -3.37 0.65 -2.38 -1.15 -2.24 -1.26 -3.08 114.28 101.45 3m1c n THR 302 Ca -0.02 0.16 -0.38 0.00 -2.27 0.00 0.00 64.05 61.54 3m1c n THR 302 Cb 0.15 -0.83 0.02 0.00 -2.10 0.00 0.00 70.33 67.57 3m1c n THR 302 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3m1c n ASP 303 N -1.48 6.84 0.01 3.42 8.00 -0.89 -4.78 116.55 127.68 3m1c n ASP 303 Ca 0.05 -3.75 -0.14 0.00 0.71 0.00 0.00 54.79 51.66 3m1c n ASP 303 Cb 0.22 -0.99 -0.02 0.00 -0.02 0.00 0.00 41.12 40.31 3m1c n ASP 303 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 3m1c h GLU 304 N 3.43 0.60 0.53 -1.24 5.08 -1.78 -3.36 114.58 117.85 3m1c h GLU 304 Ca 0.48 -0.49 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 3m1c h GLU 304 Cb 0.29 0.10 0.01 0.00 0.50 0.00 0.00 28.75 29.64 3m1c h GLU 304 CO 1.21 1.11 -0.26 -0.97 -1.00 0.00 0.00 179.01 179.10 3m1c h ASN 305 N 0.41 -0.61 -3.80 1.42 -1.24 -1.91 -3.45 115.58 106.40 3m1c h ASN 305 Ca -0.04 0.02 -0.30 0.00 0.71 0.00 0.00 56.30 56.69 3m1c h ASN 305 Cb 1.35 0.16 -0.29 0.00 0.73 0.00 0.00 38.32 40.27 3m1c h ASN 305 CO 0.14 -0.38 -0.74 0.00 -1.29 0.00 0.00 177.43 175.15 3m1c s ALA 306 N -4.52 0.31 0.45 1.57 0.00 -1.26 -5.14 121.76 113.18 3m1c s ALA 306 Ca -0.10 -0.11 -0.23 0.00 0.00 0.00 0.00 51.96 51.52 3m1c s ALA 306 Cb 0.01 -0.11 -0.08 0.00 0.00 0.00 0.00 23.12 22.94 3m1c s ALA 306 CO 0.31 0.05 1.15 -2.14 0.00 0.00 0.00 175.76 175.14 3m1c s PRO 307 N 0.08 3.80 -0.74 0.00 0.02 -1.26 -4.77 135.00 132.12 3m1c s PRO 307 Ca -0.00 1.74 -0.26 0.00 0.02 0.00 0.00 61.00 62.49 3m1c s PRO 307 Cb -0.03 -2.41 0.04 0.00 0.02 0.00 0.00 34.50 32.11 3m1c s PRO 307 CO -0.00 -0.51 1.23 0.00 -0.33 0.00 0.00 177.00 177.39 3m1c s ALA 308 N -1.57 2.82 0.33 -1.55 0.00 -1.26 -4.83 121.76 115.70 3m1c s ALA 308 Ca 0.63 -1.51 -0.27 0.00 0.00 0.00 0.00 51.96 50.81 3m1c s ALA 308 Cb -0.28 -4.20 -0.13 0.00 0.00 0.00 0.00 23.12 18.51 3m1c s ALA 308 CO 0.34 -3.21 1.07 1.55 0.00 0.00 0.00 175.76 175.50 3m1c n VAL 309 N 6.32 2.07 -1.77 0.00 3.14 -1.26 -1.04 118.33 125.78 3m1c n VAL 309 Ca 0.03 -0.50 -0.35 0.00 -2.96 0.00 0.00 64.34 60.57 3m1c n VAL 309 Cb 0.48 -1.15 0.06 0.00 -1.06 0.00 0.00 33.84 32.17 3m1c n VAL 309 CO 0.00 0.00 0.00 -0.76 -6.46 0.00 0.00 176.83 169.61 3m1c s LEU 310 N -0.04 3.49 1.01 6.55 1.43 -0.66 -4.75 118.68 125.71 3m1c s LEU 310 Ca 0.59 2.28 -0.12 0.00 -1.03 0.00 0.00 54.13 55.85 3m1c s LEU 310 Cb -0.64 -4.58 0.20 0.00 0.03 0.00 0.00 46.19 41.19 3m1c s LEU 310 CO 0.60 -1.81 1.08 -2.84 0.23 0.00 0.00 176.35 173.60 3m1c s PRO 311 N -3.70 0.29 0.00 1.29 0.02 -1.26 -4.85 135.00 126.80 3m1c s PRO 311 Ca 0.74 0.87 0.00 0.00 0.02 0.00 0.00 61.00 62.63 3m1c s PRO 311 Cb -0.27 -1.69 0.00 0.00 0.02 0.00 0.00 34.50 32.55 3m1c s PRO 311 CO 0.39 -2.92 0.00 0.41 -0.33 0.00 0.00 177.00 174.55 3m1c n GLY 312 N -0.26 2.66 3.67 0.52 0.00 -1.26 -2.36 105.19 108.16 3m1c n GLY 312 Ca 0.06 -1.16 -0.34 0.00 0.00 0.00 0.00 46.02 44.57 3m1c n GLY 312 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3m1c n PRO 313 N -1.21 0.26 -1.82 1.61 -0.02 -1.24 -4.51 135.00 128.06 3m1c n PRO 313 Ca 0.00 0.16 -0.33 0.00 -2.02 0.00 0.00 63.50 61.31 3m1c n PRO 313 Cb 0.00 -2.38 0.04 0.00 -0.02 0.00 0.00 33.50 31.14 3m1c n PRO 313 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3m1c s PRO 314 N -3.92 2.86 0.11 0.52 0.02 -1.26 -4.54 135.00 128.79 3m1c s PRO 314 Ca 0.73 1.44 -0.31 0.00 0.02 0.00 0.00 61.00 62.88 3m1c s PRO 314 Cb -0.30 -1.95 -0.08 0.00 0.02 0.00 0.00 34.50 32.19 3m1c s PRO 314 CO 0.51 -1.21 1.37 0.00 -0.33 0.00 0.00 177.00 177.34 3m1c s ALA 315 N -2.23 3.57 1.00 -1.55 0.00 -1.26 -4.82 121.76 116.46 3m1c s ALA 315 Ca 0.68 1.09 0.00 0.00 0.00 0.00 0.00 51.96 53.73 3m1c s ALA 315 Cb -0.21 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.38 3m1c s ALA 315 CO 0.39 -0.60 0.00 0.41 0.00 0.00 0.00 175.76 175.96 3m1c n GLY 316 N 3.47 -0.81 0.16 0.00 0.00 -0.79 -5.00 105.19 102.21 3m1c n GLY 316 Ca 0.11 -1.62 -0.12 0.00 0.00 0.00 0.00 46.02 44.38 3m1c n GLY 316 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3m1c h PRO 317 N 0.00 0.45 0.00 1.61 0.11 -1.88 -3.41 132.00 128.88 3m1c h PRO 317 Ca 0.00 -0.20 -0.08 0.00 0.11 0.00 0.00 66.00 65.83 3m1c h PRO 317 Cb 0.00 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 3m1c h PRO 317 CO 0.00 0.74 -1.34 2.89 -0.21 0.00 0.00 178.00 180.09 3m1c n ARG 318 N -4.53 2.57 -4.81 1.05 1.85 -1.26 -4.81 116.66 106.72 3m1c n ARG 318 Ca -0.05 -0.01 -0.27 0.00 -1.00 0.00 0.00 57.85 56.52 3m1c n ARG 318 Cb 0.34 -1.13 -0.15 0.00 -1.05 0.00 0.00 32.46 30.47 3m1c n ARG 318 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 3m1c s TYR 319 N -2.18 2.00 -0.11 2.89 4.12 -1.26 -1.51 117.35 121.29 3m1c s TYR 319 Ca -0.02 -0.39 0.02 0.00 0.02 0.00 0.00 57.07 56.70 3m1c s TYR 319 Cb 0.02 -1.21 -0.01 0.00 -1.52 0.00 0.00 41.96 39.24 3m1c s TYR 319 CO 0.22 0.08 -0.17 0.50 0.02 0.00 0.00 175.55 176.20 3m1c s ARG 320 N -1.07 3.16 -0.15 -0.62 3.52 0.11 -1.89 118.95 122.00 3m1c s ARG 320 Ca 0.09 -0.75 -0.04 0.00 -0.13 0.00 0.00 55.73 54.91 3m1c s ARG 320 Cb -0.09 -2.50 -0.03 0.00 -1.56 0.00 0.00 34.95 30.77 3m1c s ARG 320 CO 0.01 0.26 -0.02 0.08 -0.81 0.00 0.00 175.30 174.82 3m1c s VAL 321 N 0.20 4.02 0.11 7.11 1.01 -1.26 -1.89 120.40 129.70 3m1c s VAL 321 Ca -0.10 -0.32 0.08 0.00 0.00 0.00 0.00 61.98 61.64 3m1c s VAL 321 Cb -0.16 -2.76 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 3m1c s VAL 321 CO 0.06 0.50 -0.12 -0.36 0.00 0.00 0.00 175.10 175.18 3m1c s PHE 322 N 0.21 2.69 0.03 5.22 0.08 -0.29 -3.64 117.98 122.27 3m1c s PHE 322 Ca -0.01 -0.18 0.03 0.00 0.12 0.00 0.00 56.93 56.88 3m1c s PHE 322 Cb -0.14 -1.41 -0.02 0.00 -0.57 0.00 0.00 43.02 40.89 3m1c s PHE 322 CO 0.03 0.42 -0.08 0.14 -0.10 0.00 0.00 175.22 175.62 3m1c s VAL 323 N -1.21 0.62 0.08 -0.44 -7.23 -0.99 -0.51 120.40 110.72 3m1c s VAL 323 Ca 0.21 -0.77 0.10 0.00 -1.81 0.00 0.00 61.98 59.70 3m1c s VAL 323 Cb -0.11 -0.61 -0.03 0.00 0.56 0.00 0.00 36.38 36.19 3m1c s VAL 323 CO 0.13 -0.13 -0.26 -0.76 -0.31 0.00 0.00 175.10 173.76 3m1c s LEU 324 N -0.99 2.23 -0.40 1.32 1.02 0.53 -4.15 118.68 118.23 3m1c s LEU 324 Ca -0.03 -0.65 -0.01 0.00 0.02 0.00 0.00 54.13 53.45 3m1c s LEU 324 Cb -0.07 -1.25 0.00 0.00 0.02 0.00 0.00 46.19 44.89 3m1c s LEU 324 CO 0.00 0.23 0.34 0.61 0.02 0.00 0.00 176.35 177.55 3m1c n GLY 325 N 1.44 0.31 3.83 -3.19 0.00 -1.24 -2.36 105.19 103.99 3m1c n GLY 325 Ca -0.17 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.19 3m1c n GLY 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1c s ALA 326 N -3.11 3.02 0.00 4.61 0.00 -1.26 -4.80 121.76 120.22 3m1c s ALA 326 Ca 0.08 0.27 0.00 0.00 0.00 0.00 0.00 51.96 52.31 3m1c s ALA 326 Cb -0.03 -3.14 0.00 0.00 0.00 0.00 0.00 23.12 19.94 3m1c s ALA 326 CO 0.23 -0.21 0.00 -2.30 0.00 0.00 0.00 175.76 173.48 3m1c n PRO 327 N -1.37 1.44 -1.93 0.00 -0.02 -1.26 -4.98 135.00 126.89 3m1c n PRO 327 Ca 0.07 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.55 3m1c n PRO 327 Cb 0.54 0.00 -0.00 0.00 -0.02 0.00 0.00 33.50 34.02 3m1c n PRO 327 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3m1c n ASN 332 N 0.00 -3.81 0.24 2.55 2.85 -1.26 -5.12 115.26 110.72 3m1c n ASN 332 Ca 0.00 0.51 -0.10 0.00 -0.11 0.00 0.00 54.58 54.88 3m1c n ASN 332 Cb 0.00 -2.54 -0.05 0.00 1.24 0.00 0.00 39.78 38.43 3m1c n ASN 332 CO 0.00 0.00 0.00 1.23 -2.11 0.00 0.00 177.26 176.38 3m1c h GLY 333 N 1.13 -0.70 2.00 8.20 0.00 -2.07 -3.34 103.07 108.29 3m1c h GLY 333 Ca -0.03 0.27 -0.11 0.00 0.00 0.00 0.00 47.33 47.46 3m1c h GLY 333 CO 0.03 -0.25 -0.54 1.48 0.00 0.00 0.00 176.54 177.26 3m1c h SER 334 N -0.63 0.00 -0.65 0.19 4.64 -2.04 -2.89 113.55 112.18 3m1c h SER 334 Ca -0.06 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.39 3m1c h SER 334 Cb 0.49 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.48 3m1c h SER 334 CO 0.09 0.54 0.09 0.00 -0.87 0.00 0.00 176.83 176.69 3m1c h ALA 335 N 1.46 0.74 -0.04 5.18 0.00 -1.98 0.58 119.26 125.21 3m1c h ALA 335 Ca -0.01 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3m1c h ALA 335 Cb 1.00 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 3m1c h ALA 335 CO 0.07 -0.35 0.01 1.25 0.00 0.00 0.00 179.25 180.23 3m1c h LEU 336 N 0.20 0.06 -0.29 0.00 5.85 -1.63 -2.70 115.31 116.79 3m1c h LEU 336 Ca 0.35 -0.19 0.06 0.00 0.84 0.00 0.00 57.88 58.93 3m1c h LEU 336 Cb 0.56 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.50 3m1c h LEU 336 CO -0.49 0.24 -0.41 -0.78 -0.34 0.00 0.00 178.44 176.66 3m1c h ASP 337 N -0.12 -1.33 -0.64 1.25 -0.00 -1.09 -1.20 116.42 113.29 3m1c h ASP 337 Ca 0.01 0.20 0.11 0.00 -0.00 0.00 0.00 57.03 57.35 3m1c h ASP 337 Cb 0.20 0.57 -0.08 0.00 -0.00 0.00 0.00 39.33 40.02 3m1c h ASP 337 CO -0.00 -0.38 0.21 0.00 -0.00 0.00 0.00 179.24 179.06 3m1c h ALA 338 N 0.35 0.82 0.00 -0.78 0.00 -0.93 0.26 119.26 118.98 3m1c h ALA 338 Ca 0.12 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.10 3m1c h ALA 338 Cb 0.59 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3m1c h ALA 338 CO -0.50 -0.24 -0.17 1.25 0.00 0.00 0.00 179.25 179.60 3m1c h LEU 339 N 0.36 0.00 -0.28 0.00 5.85 -1.03 0.94 115.31 121.15 3m1c h LEU 339 Ca 0.33 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.95 3m1c h LEU 339 Cb 0.46 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.49 3m1c h LEU 339 CO -0.36 0.17 -0.23 0.03 -0.34 0.00 0.00 178.44 177.71 3m1c h ARG 340 N 0.00 0.65 -0.95 1.25 3.08 0.20 -2.29 114.38 116.32 3m1c h ARG 340 Ca -0.00 -0.32 0.03 0.00 0.07 0.00 0.00 59.98 59.76 3m1c h ARG 340 Cb 0.37 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.36 3m1c h ARG 340 CO 0.02 0.93 0.62 0.00 -1.07 0.00 0.00 179.97 180.47 3m1c h ARG 341 N 0.38 1.17 -0.04 0.04 2.47 -0.26 -2.42 114.38 115.72 3m1c h ARG 341 Ca 0.05 -0.07 -0.01 0.00 -1.26 0.00 0.00 59.98 58.69 3m1c h ARG 341 Cb 0.78 -0.26 -0.00 0.00 -1.65 0.00 0.00 29.97 28.84 3m1c h ARG 341 CO 0.06 0.77 -0.02 0.28 0.56 0.00 0.00 179.97 181.62 3m1c h VAL 342 N 1.21 1.33 0.00 2.04 2.07 -0.82 -2.17 116.25 119.90 3m1c h VAL 342 Ca 0.38 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.87 3m1c h VAL 342 Cb -0.00 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 3m1c h VAL 342 CO -0.12 0.28 0.00 0.00 0.02 0.00 0.00 177.57 177.75 3m1c n ALA 343 N -2.33 1.14 0.06 1.67 0.00 -0.87 -1.89 120.51 118.30 3m1c n ALA 343 Ca -0.08 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3m1c n ALA 343 Cb 0.24 -1.31 -0.06 0.00 0.00 0.00 0.00 19.45 18.33 3m1c n ALA 343 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3m1c h GLY 344 N 0.36 0.00 1.01 0.00 0.00 -0.88 -3.42 103.07 100.14 3m1c h GLY 344 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3m1c h GLY 344 CO 0.00 0.00 0.47 -0.97 0.00 0.00 0.00 176.54 176.04 3m1c h TYR 345 N 0.00 1.07 0.00 5.60 0.05 -1.03 -3.10 116.97 119.57 3m1c h TYR 345 Ca -0.12 -0.01 -0.05 0.00 0.05 0.00 0.00 58.73 58.60 3m1c h TYR 345 Cb 1.55 -0.35 -0.01 0.00 1.01 0.00 0.00 36.73 38.94 3m1c h TYR 345 CO 0.00 0.73 -0.24 -1.35 -1.05 0.00 0.00 178.16 176.24 3m1c h PRO 346 N 1.10 0.00 -0.01 4.88 0.11 -1.81 -2.56 132.00 133.72 3m1c h PRO 346 Ca 0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.40 3m1c h PRO 346 Cb -0.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.10 3m1c h PRO 346 CO -0.05 0.24 -0.10 0.39 -0.21 0.00 0.00 178.00 178.28 3m1c n GLU 347 N -4.00 1.23 0.03 1.05 1.02 -1.17 -4.40 120.64 114.39 3m1c n GLU 347 Ca -0.02 -0.65 -0.07 0.00 -0.02 0.00 0.00 57.16 56.40 3m1c n GLU 347 Cb 0.32 -1.49 -0.12 0.00 -0.02 0.00 0.00 31.44 30.13 3m1c n GLU 347 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 3m1c h GLU 348 N 1.59 0.00 -3.30 3.49 5.08 -1.53 -3.06 114.58 116.85 3m1c h GLU 348 Ca 0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3m1c h GLU 348 Cb 0.45 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.61 3m1c h GLU 348 CO 0.00 0.76 0.05 0.45 -1.00 0.00 0.00 179.01 179.27 3m1c s SER 349 N -6.42 -0.23 0.00 1.42 0.15 -1.22 -4.13 113.70 103.27 3m1c s SER 349 Ca -0.01 -0.61 0.00 0.00 0.70 0.00 0.00 55.95 56.03 3m1c s SER 349 Cb 0.09 0.62 0.00 0.00 -1.71 0.00 0.00 66.02 65.03 3m1c s SER 349 CO 0.82 -1.15 0.67 0.35 1.20 0.00 0.00 173.24 175.13 3m1c n THR 350 N -0.38 0.32 -3.64 6.45 -2.24 -1.26 -4.87 114.28 108.65 3m1c n THR 350 Ca -0.06 -0.66 -0.39 0.00 -2.27 0.00 0.00 64.05 60.66 3m1c n THR 350 Cb 0.61 0.85 -0.12 0.00 -2.10 0.00 0.00 70.33 69.58 3m1c n THR 350 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3m1c s ASN 351 N -0.34 5.58 0.64 3.42 2.47 -1.26 -4.53 114.94 120.92 3m1c s ASN 351 Ca 0.01 -0.80 0.33 0.00 0.42 0.00 0.00 52.86 52.82 3m1c s ASN 351 Cb 0.00 -1.99 1.80 0.00 -1.45 0.00 0.00 41.25 39.61 3m1c s ASN 351 CO 0.00 -0.29 2.07 0.10 -3.72 0.00 0.00 177.10 175.26 3m1c h TYR 352 N 8.37 0.00 -0.04 0.43 -0.00 -1.81 -1.58 116.97 122.35 3m1c h TYR 352 Ca -0.28 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.40 3m1c h TYR 352 Cb 1.12 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.85 3m1c h TYR 352 CO 0.60 0.00 -0.17 0.00 -0.00 0.00 0.00 178.16 178.60 3m1c h ALA 353 N 1.60 0.07 -0.66 0.10 0.00 -1.92 -2.98 119.26 115.48 3m1c h ALA 353 Ca 0.04 -0.39 0.19 0.00 0.00 0.00 0.00 54.91 54.75 3m1c h ALA 353 Cb 0.52 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 3m1c h ALA 353 CO -0.00 0.02 0.52 1.96 0.00 0.00 0.00 179.25 181.75 3m1c h GLN 354 N -0.40 0.00 0.12 0.00 4.20 -1.57 0.05 115.11 117.52 3m1c h GLN 354 Ca -0.01 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 3m1c h GLN 354 Cb 0.82 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.60 3m1c h GLN 354 CO 0.03 0.00 -0.06 1.88 -0.67 0.00 0.00 178.83 180.02 3m1c h TYR 355 N 0.00 -0.15 -0.94 2.96 0.05 -1.62 -2.90 116.97 114.38 3m1c h TYR 355 Ca 0.31 -0.00 0.22 0.00 0.05 0.00 0.00 58.73 59.31 3m1c h TYR 355 Cb 1.36 0.05 -0.17 0.00 1.01 0.00 0.00 36.73 38.97 3m1c h TYR 355 CO 0.00 0.26 -0.10 0.52 -1.05 0.00 0.00 178.16 177.80 3m1c h MET 356 N -0.95 0.02 -0.07 4.88 2.86 -1.24 0.15 114.93 120.58 3m1c h MET 356 Ca -0.02 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3m1c h MET 356 Cb 0.48 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.13 3m1c h MET 356 CO 0.03 0.01 0.04 1.03 1.06 0.00 0.00 176.91 179.08 3m1c h SER 357 N 0.02 0.09 0.32 1.22 0.87 -1.05 -0.93 113.55 114.08 3m1c h SER 357 Ca 0.51 -0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.92 3m1c h SER 357 Cb 0.92 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.84 3m1c h SER 357 CO -0.91 0.12 -0.38 -0.09 -0.53 0.00 0.00 176.83 175.04 3m1c h ARG 358 N 0.04 0.09 -0.05 2.24 2.43 -1.08 -1.78 114.38 116.28 3m1c h ARG 358 Ca 0.02 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3m1c h ARG 358 Cb 0.05 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.60 3m1c h ARG 358 CO -0.00 0.47 0.03 0.00 -1.51 0.00 0.00 179.97 178.95 3m1c h ALA 359 N 1.53 0.06 0.00 2.80 0.00 -0.16 0.65 119.26 124.14 3m1c h ALA 359 Ca 0.01 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3m1c h ALA 359 Cb 0.72 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3m1c h ALA 359 CO 0.05 -0.45 -0.27 1.88 0.00 0.00 0.00 179.25 180.46 3m1c h TYR 360 N 0.06 0.00 0.02 0.00 0.05 -0.68 -1.92 116.97 114.50 3m1c h TYR 360 Ca 0.02 0.00 -0.13 0.00 0.05 0.00 0.00 58.73 58.67 3m1c h TYR 360 Cb -0.01 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.74 3m1c h TYR 360 CO -0.08 0.27 -0.51 0.00 -1.05 0.00 0.00 178.16 176.80 3m1c h ALA 361 N 1.73 0.03 -0.02 3.88 0.00 -0.99 -3.19 119.26 120.70 3m1c h ALA 361 Ca -0.00 -0.56 -0.02 0.00 0.00 0.00 0.00 54.91 54.33 3m1c h ALA 361 Cb 0.59 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 3m1c h ALA 361 CO 0.04 0.26 -0.06 0.93 0.00 0.00 0.00 179.25 180.41 3m1c h GLU 362 N -0.31 0.02 -0.07 0.00 5.08 -0.63 -2.37 114.58 116.31 3m1c h GLU 362 Ca -0.07 -0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.19 3m1c h GLU 362 Cb 1.27 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 3m1c h GLU 362 CO 0.10 0.09 -0.40 0.35 -1.00 0.00 0.00 179.01 178.14 3m1c h PHE 363 N 0.02 0.16 0.00 4.33 3.57 -1.39 -2.71 116.94 120.93 3m1c h PHE 363 Ca 0.01 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.46 3m1c h PHE 363 Cb 0.13 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.83 3m1c h PHE 363 CO 0.00 0.53 0.00 1.28 -2.23 0.00 0.00 178.31 177.89 3m1c n LEU 364 N -4.04 0.76 -0.98 0.59 4.77 -0.90 -3.70 117.00 113.51 3m1c n LEU 364 Ca -0.02 0.59 0.09 0.00 -0.03 0.00 0.00 56.01 56.64 3m1c n LEU 364 Cb 0.46 -0.38 0.24 0.00 -2.33 0.00 0.00 43.42 41.41 3m1c n LEU 364 CO 0.41 -0.25 0.70 0.61 -1.33 0.00 0.00 177.39 177.53 3m1c n GLY 365 N 1.05 1.47 3.76 -0.72 0.00 -1.02 -4.65 105.19 105.08 3m1c n GLY 365 Ca 0.05 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.08 3m1c n GLY 365 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3m1c s GLU 366 N -1.31 4.49 0.33 1.61 -1.05 -1.24 -4.97 118.70 116.56 3m1c s GLU 366 Ca 0.36 2.00 -0.29 0.00 -0.15 0.00 0.00 54.97 56.89 3m1c s GLU 366 Cb 0.19 -3.15 -0.10 0.00 -0.44 0.00 0.00 34.13 30.63 3m1c s GLU 366 CO 0.25 -0.02 1.31 0.34 0.95 0.00 0.00 175.26 178.09 3m1c s ASP 367 N -0.51 6.76 0.46 0.83 -1.08 -1.26 -4.79 116.67 117.09 3m1c s ASP 367 Ca 0.48 2.70 0.26 0.00 -0.52 0.00 0.00 52.55 55.47 3m1c s ASP 367 Cb -0.36 -2.65 0.82 0.00 -1.46 0.00 0.00 42.92 39.28 3m1c s ASP 367 CO 0.45 -0.54 1.78 -0.65 0.52 0.00 0.00 175.17 176.73 3m1c h PRO 368 N 3.40 0.00 -0.80 4.34 0.11 -1.91 -3.38 132.00 133.76 3m1c h PRO 368 Ca -0.49 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.66 3m1c h PRO 368 Cb 1.23 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.29 3m1c h PRO 368 CO 0.66 0.10 0.50 0.78 -0.21 0.00 0.00 178.00 179.83 3m1c h GLY 369 N 2.78 1.16 2.00 -0.55 0.00 -1.99 -2.21 103.07 104.26 3m1c h GLY 369 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.95 3m1c h GLY 369 CO 0.01 0.32 0.00 1.44 0.00 0.00 0.00 176.54 178.31 3m1c n SER 370 N -4.60 0.50 0.00 0.19 7.64 -1.26 -4.93 113.62 111.16 3m1c n SER 370 Ca 0.10 0.66 0.00 0.00 1.01 0.00 0.00 58.87 60.63 3m1c n SER 370 Cb 0.10 -0.75 0.00 0.00 -1.01 0.00 0.00 64.21 62.54 3m1c n SER 370 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3m1c n GLY 371 N -0.49 1.99 0.60 0.23 0.00 -0.83 -1.67 105.19 105.02 3m1c n GLY 371 Ca 0.01 0.02 0.05 0.00 0.00 0.00 0.00 46.02 46.11 3m1c n GLY 371 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3m1c n THR 372 N 0.00 0.86 -1.49 2.61 -2.24 -1.26 -5.00 114.28 107.76 3m1c n THR 372 Ca 0.00 -0.93 -0.30 0.00 -2.27 0.00 0.00 64.05 60.55 3m1c n THR 372 Cb 0.00 0.60 0.10 0.00 -2.10 0.00 0.00 70.33 68.93 3m1c n THR 372 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3m1c s ASP 373 N -0.99 4.29 0.54 3.42 1.01 -0.67 -4.41 116.67 119.87 3m1c s ASP 373 Ca 0.21 1.34 -0.20 0.00 0.71 0.00 0.00 52.55 54.61 3m1c s ASP 373 Cb 0.11 -2.06 -0.05 0.00 1.01 0.00 0.00 42.92 41.93 3m1c s ASP 373 CO 0.15 -2.10 1.17 0.00 0.21 0.00 0.00 175.17 174.61 3m1c s ALA 374 N -3.12 2.71 -0.51 5.23 0.00 -1.26 -4.45 121.76 120.36 3m1c s ALA 374 Ca 0.61 0.93 0.03 0.00 0.00 0.00 0.00 51.96 53.54 3m1c s ALA 374 Cb -0.15 -3.40 0.14 0.00 0.00 0.00 0.00 23.12 19.71 3m1c s ALA 374 CO 0.55 -0.90 0.31 1.03 0.00 0.00 0.00 175.76 176.74 3m1c s ARG 375 N -3.16 1.64 0.22 0.00 0.52 -0.41 -4.98 118.95 112.77 3m1c s ARG 375 Ca 0.72 -2.43 -0.07 0.00 -0.52 0.00 0.00 55.73 53.43 3m1c s ARG 375 Cb -0.28 -2.67 0.32 0.00 0.52 0.00 0.00 34.95 32.84 3m1c s ARG 375 CO 0.31 -1.20 1.77 -1.35 0.02 0.00 0.00 175.30 174.85 3m1c h PRO 376 N 6.29 0.54 -0.02 3.54 0.11 -1.96 -1.39 132.00 139.12 3m1c h PRO 376 Ca 0.04 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 66.15 3m1c h PRO 376 Cb 0.88 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 31.82 3m1c h PRO 376 CO 0.56 0.36 -0.24 0.77 -0.21 0.00 0.00 178.00 179.24 3m1c h SER 377 N 0.56 -0.71 -0.03 -2.05 0.02 -1.94 -2.03 113.55 107.36 3m1c h SER 377 Ca 0.34 0.10 -0.00 0.00 -0.84 0.00 0.00 61.79 61.39 3m1c h SER 377 Cb 0.37 0.30 -0.00 0.00 0.14 0.00 0.00 62.40 63.21 3m1c h SER 377 CO -0.28 -0.30 0.02 0.25 -1.14 0.00 0.00 176.83 175.38 3m1c h LEU 378 N -0.36 0.04 -1.11 5.07 5.85 -1.84 -2.91 115.31 120.06 3m1c h LEU 378 Ca 0.07 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.77 3m1c h LEU 378 Cb 0.45 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.43 3m1c h LEU 378 CO -0.23 0.06 0.60 0.15 -0.34 0.00 0.00 178.44 178.69 3m1c h PHE 379 N 0.01 1.14 -0.42 1.25 3.04 -1.08 0.17 116.94 121.05 3m1c h PHE 379 Ca 0.01 0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.99 3m1c h PHE 379 Cb 0.03 -0.38 -0.02 0.00 2.56 0.00 0.00 35.95 38.14 3m1c h PHE 379 CO -0.07 0.70 0.27 -1.49 -2.02 0.00 0.00 178.31 175.71 3m1c h TRP 380 N 1.21 0.52 -0.24 0.41 4.06 -1.27 0.21 115.95 120.84 3m1c h TRP 380 Ca 0.34 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 61.29 3m1c h TRP 380 Cb -0.10 -0.18 -0.01 0.00 -1.00 0.00 0.00 29.16 27.88 3m1c h TRP 380 CO -0.00 0.33 0.09 0.00 -3.56 0.00 0.00 178.44 175.29 3m1c h ARG 381 N 0.56 0.37 -0.16 0.49 3.08 -0.98 -1.26 114.38 116.47 3m1c h ARG 381 Ca 0.15 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 3m1c h ARG 381 Cb -0.06 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 3m1c h ARG 381 CO -0.03 0.42 0.07 -0.07 -1.07 0.00 0.00 179.97 179.29 3m1c h LEU 382 N 0.23 0.23 -1.33 3.04 3.38 -0.54 -1.21 115.31 119.11 3m1c h LEU 382 Ca 0.08 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.82 3m1c h LEU 382 Cb 0.20 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3m1c h LEU 382 CO -0.00 0.32 -0.34 0.00 0.09 0.00 0.00 178.44 178.51 3m1c h ALA 383 N 0.91 1.41 0.02 1.53 0.00 -0.55 -2.27 119.26 120.31 3m1c h ALA 383 Ca 0.05 -0.31 -0.22 0.00 0.00 0.00 0.00 54.91 54.44 3m1c h ALA 383 Cb 0.17 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 3m1c h ALA 383 CO -0.00 0.42 -0.95 0.78 0.00 0.00 0.00 179.25 179.50 3m1c h GLY 384 N 1.06 0.28 0.97 0.00 0.00 -1.04 -2.38 103.07 101.96 3m1c h GLY 384 Ca -0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 47.33 46.76 3m1c h GLY 384 CO 0.04 0.46 0.17 1.41 0.00 0.00 0.00 176.54 178.62 3m1c h LEU 385 N 0.13 0.73 -0.20 3.11 3.38 -0.74 -1.60 115.31 120.12 3m1c h LEU 385 Ca -0.06 -0.20 -0.15 0.00 0.09 0.00 0.00 57.88 57.55 3m1c h LEU 385 Cb 1.60 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 42.16 3m1c h LEU 385 CO 0.15 0.74 -0.48 0.25 0.09 0.00 0.00 178.44 179.19 3m1c h LEU 386 N 0.69 0.76 -0.65 1.67 5.85 -1.43 -1.12 115.31 121.09 3m1c h LEU 386 Ca 0.16 -0.57 -0.01 0.00 0.84 0.00 0.00 57.88 58.31 3m1c h LEU 386 Cb 0.26 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 3m1c h LEU 386 CO -0.01 1.19 0.38 0.00 -0.34 0.00 0.00 178.44 179.66 3m1c h ALA 387 N 0.59 0.83 0.00 1.25 0.00 -1.47 -2.12 119.26 118.34 3m1c h ALA 387 Ca -0.00 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 3m1c h ALA 387 Cb 1.09 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3m1c h ALA 387 CO 0.10 0.32 -0.22 0.77 0.00 0.00 0.00 179.25 180.22 3m1c h SER 388 N 0.88 0.00 0.25 0.00 0.02 -1.21 -2.13 113.55 111.36 3m1c h SER 388 Ca 0.23 0.00 -0.23 0.00 -0.84 0.00 0.00 61.79 60.95 3m1c h SER 388 Cb -0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3m1c h SER 388 CO -0.04 0.22 -0.92 0.77 -1.14 0.00 0.00 176.83 175.72 3m1c h SER 389 N 0.00 0.61 0.29 3.07 4.64 -0.56 -1.44 113.55 120.16 3m1c h SER 389 Ca -0.00 -0.47 -0.06 0.00 -0.47 0.00 0.00 61.79 60.78 3m1c h SER 389 Cb 0.45 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 3m1c h SER 389 CO 0.03 1.26 -0.30 1.23 -0.87 0.00 0.00 176.83 178.19 3m1c h GLY 390 N 1.07 0.01 1.10 -0.77 0.00 -1.15 0.28 103.07 103.61 3m1c h GLY 390 Ca -0.08 -0.01 -0.15 0.00 0.00 0.00 0.00 47.33 47.09 3m1c h GLY 390 CO 0.16 0.01 -0.37 -2.75 0.00 0.00 0.00 176.54 173.59 3m1c h PHE 391 N 0.01 1.07 -0.14 5.60 3.57 -1.16 -1.50 116.94 124.38 3m1c h PHE 391 Ca -0.00 -0.32 -0.14 0.00 3.53 0.00 0.00 57.97 61.04 3m1c h PHE 391 Cb 0.53 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 3m1c h PHE 391 CO 0.00 1.14 -0.50 0.00 -2.23 0.00 0.00 178.31 176.72 3m1c h ALA 392 N 0.75 0.87 0.59 2.41 0.00 -0.47 -2.37 119.26 121.04 3m1c h ALA 392 Ca 0.05 -0.48 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 3m1c h ALA 392 Cb 0.97 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.67 3m1c h ALA 392 CO 0.09 0.67 -0.28 0.35 0.00 0.00 0.00 179.25 180.08 3m1c h PHE 393 N 0.30 -0.73 -0.02 0.00 3.57 -0.40 0.12 116.94 119.78 3m1c h PHE 393 Ca 0.01 -0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.50 3m1c h PHE 393 Cb 0.99 0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.97 3m1c h PHE 393 CO 0.03 -0.45 0.02 -0.24 -2.23 0.00 0.00 178.31 175.43 3m1c h VAL 394 N -1.21 0.66 0.09 1.41 3.04 -1.37 -1.81 116.25 117.07 3m1c h VAL 394 Ca -0.08 0.00 -0.00 0.00 -1.01 0.00 0.00 66.70 65.60 3m1c h VAL 394 Cb 0.61 0.98 0.00 0.00 -2.01 0.00 0.00 31.29 30.88 3m1c h VAL 394 CO 0.13 0.00 -0.04 0.78 -1.01 0.00 0.00 177.57 177.43 3m1c h ASN 395 N 0.00 -0.11 -1.00 3.17 2.35 -1.34 -3.17 115.58 115.48 3m1c h ASN 395 Ca 0.01 -0.48 0.20 0.00 -0.55 0.00 0.00 56.30 55.48 3m1c h ASN 395 Cb 0.05 0.03 -0.10 0.00 0.05 0.00 0.00 38.32 38.34 3m1c h ASN 395 CO -0.00 0.53 0.61 0.00 -1.65 0.00 0.00 177.43 176.93 3m1c h ALA 396 N -0.21 1.76 -0.46 -0.83 0.00 -0.54 -1.94 119.26 117.04 3m1c h ALA 396 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3m1c h ALA 396 Cb 0.58 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3m1c h ALA 396 CO 0.02 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.14 3m1c n ALA 397 N -2.35 -0.39 -0.34 0.00 0.00 -0.70 -2.55 120.51 114.17 3m1c n ALA 397 Ca 0.23 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.82 3m1c n ALA 397 Cb 0.61 0.03 0.29 0.00 0.00 0.00 0.00 19.45 20.38 3m1c n ALA 397 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3m1c n HIS 398 N -1.84 0.63 0.00 0.00 -0.00 -1.19 -0.26 115.22 112.56 3m1c n HIS 398 Ca 0.00 1.17 0.00 0.00 -0.00 0.00 0.00 57.72 58.89 3m1c n HIS 398 Cb 0.00 -1.23 0.00 0.00 -0.00 0.00 0.00 29.99 28.76 3m1c n HIS 398 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3m1c n ALA 399 N -3.16 0.00 -0.47 -1.41 0.00 -0.73 -1.71 120.51 113.02 3m1c n ALA 399 Ca 0.23 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.69 3m1c n ALA 399 Cb 0.76 0.30 0.29 0.00 0.00 0.00 0.00 19.45 20.79 3m1c n ALA 399 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 3m1c n HIS 400 N -1.45 1.69 -3.98 0.00 1.44 -1.13 -4.96 115.22 106.84 3m1c n HIS 400 Ca 0.00 -0.68 -0.41 0.00 -2.01 0.00 0.00 57.72 54.62 3m1c n HIS 400 Cb 0.00 -0.47 0.02 0.00 0.12 0.00 0.00 29.99 29.66 3m1c n HIS 400 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 3m1c n ASP 401 N 0.31 -4.43 -3.63 4.39 4.64 0.65 -4.83 116.55 113.65 3m1c n ASP 401 Ca 0.24 -1.20 -0.04 0.00 -1.38 0.00 0.00 54.79 52.41 3m1c n ASP 401 Cb 1.03 -1.82 -0.05 0.00 -1.04 0.00 0.00 41.12 39.24 3m1c n ASP 401 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 3m1c s ALA 402 N -3.40 -2.08 -0.11 -1.67 0.00 -1.13 -3.73 121.76 109.64 3m1c s ALA 402 Ca 0.38 1.80 0.01 0.00 0.00 0.00 0.00 51.96 54.14 3m1c s ALA 402 Cb -0.20 -1.37 0.02 0.00 0.00 0.00 0.00 23.12 21.57 3m1c s ALA 402 CO 0.95 -0.24 -0.12 0.42 0.00 0.00 0.00 175.76 176.77 3m1c s ILE 403 N -0.85 1.31 0.16 0.00 1.01 0.56 -4.55 121.20 118.85 3m1c s ILE 403 Ca 0.06 -0.50 -0.32 0.00 0.00 0.00 0.00 60.65 59.89 3m1c s ILE 403 Cb -0.02 -1.24 -0.11 0.00 0.01 0.00 0.00 42.46 41.10 3m1c s ILE 403 CO -0.07 0.41 1.68 -0.60 0.00 0.00 0.00 174.94 176.36 3m1c s ARG 404 N 1.31 4.17 0.44 2.79 3.52 -1.26 -1.02 118.95 128.89 3m1c s ARG 404 Ca -0.01 2.49 0.16 0.00 -0.13 0.00 0.00 55.73 58.24 3m1c s ARG 404 Cb -0.14 -3.24 1.08 0.00 -1.56 0.00 0.00 34.95 31.09 3m1c s ARG 404 CO -0.05 -0.72 1.95 1.25 -0.81 0.00 0.00 175.30 176.92 3m1c h LEU 405 N 7.29 0.34 -0.90 -0.88 5.85 -1.15 0.96 115.31 126.82 3m1c h LEU 405 Ca -0.43 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.19 3m1c h LEU 405 Cb 1.20 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.17 3m1c h LEU 405 CO 0.94 0.19 -0.44 0.77 -0.34 0.00 0.00 178.44 179.56 3m1c h SER 406 N 0.37 0.25 -0.06 1.25 4.64 -1.32 -2.39 113.55 116.29 3m1c h SER 406 Ca 0.33 -0.11 -0.07 0.00 -0.47 0.00 0.00 61.79 61.47 3m1c h SER 406 Cb 0.77 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.79 3m1c h SER 406 CO -0.09 0.66 -0.22 0.44 -0.87 0.00 0.00 176.83 176.75 3m1c h ASP 407 N 0.20 0.30 -0.42 4.97 3.45 -1.15 -1.82 116.42 121.94 3m1c h ASP 407 Ca 0.01 -0.62 0.09 0.00 0.43 0.00 0.00 57.03 56.94 3m1c h ASP 407 Cb 0.86 -0.09 -0.09 0.00 -0.56 0.00 0.00 39.33 39.44 3m1c h ASP 407 CO 0.07 0.87 -0.23 0.25 -1.57 0.00 0.00 179.24 178.63 3m1c h LEU 408 N -0.25 -0.79 -0.73 1.55 5.85 -1.20 0.24 115.31 119.98 3m1c h LEU 408 Ca -0.01 0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 3m1c h LEU 408 Cb 0.85 0.41 -0.02 0.00 0.37 0.00 0.00 40.66 42.26 3m1c h LEU 408 CO 0.05 -0.26 0.06 -0.07 -0.34 0.00 0.00 178.44 177.88 3m1c h LEU 409 N -0.15 0.99 -0.22 2.25 3.38 -1.46 -0.95 115.31 119.16 3m1c h LEU 409 Ca 0.20 -0.25 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 3m1c h LEU 409 Cb 0.47 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.95 3m1c h LEU 409 CO -0.52 1.01 -0.30 1.23 0.09 0.00 0.00 178.44 179.95 3m1c h GLY 410 N 1.02 0.64 0.77 0.83 0.00 -1.01 -0.81 103.07 104.52 3m1c h GLY 410 Ca 0.19 -0.70 0.03 0.00 0.00 0.00 0.00 47.33 46.84 3m1c h GLY 410 CO 0.02 0.63 0.13 -2.75 0.00 0.00 0.00 176.54 174.56 3m1c h PHE 411 N 0.27 0.23 -0.49 5.60 3.57 -0.41 0.31 116.94 126.01 3m1c h PHE 411 Ca 0.02 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.48 3m1c h PHE 411 Cb 0.88 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.54 3m1c h PHE 411 CO 0.08 0.11 0.07 -0.07 -2.23 0.00 0.00 178.31 176.28 3m1c h LEU 412 N 0.27 0.73 0.15 0.59 3.38 -1.11 -1.18 115.31 118.14 3m1c h LEU 412 Ca 0.14 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3m1c h LEU 412 Cb 0.09 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3m1c h LEU 412 CO -0.13 0.75 -0.07 0.00 0.09 0.00 0.00 178.44 179.08 3m1c h ALA 413 N 1.34 -0.20 -0.01 1.53 0.00 -0.78 -2.97 119.26 118.17 3m1c h ALA 413 Ca 0.16 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 3m1c h ALA 413 Cb 0.34 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3m1c h ALA 413 CO 0.01 -0.30 -0.35 0.45 0.00 0.00 0.00 179.25 179.06 3m1c h HIS 414 N -0.84 0.02 0.24 0.00 3.86 -0.41 -0.62 115.15 117.40 3m1c h HIS 414 Ca -0.02 -0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.19 3m1c h HIS 414 Cb 0.53 -0.00 -0.03 0.00 1.06 0.00 0.00 27.41 28.97 3m1c h HIS 414 CO 0.09 0.36 -0.30 0.77 0.86 0.00 0.00 177.93 179.71 3m1c h SER 415 N 0.01 -0.83 -0.81 2.45 0.02 -1.31 0.23 113.55 113.32 3m1c h SER 415 Ca -0.00 0.08 0.05 0.00 -0.84 0.00 0.00 61.79 61.08 3m1c h SER 415 Cb 0.62 0.29 -0.05 0.00 0.14 0.00 0.00 62.40 63.40 3m1c h SER 415 CO 0.05 -0.42 0.53 -0.09 -1.14 0.00 0.00 176.83 175.76 3m1c h ARG 416 N -0.60 0.89 0.04 3.45 2.43 -1.25 -1.26 114.38 118.08 3m1c h ARG 416 Ca 0.00 -0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.11 3m1c h ARG 416 Cb 0.57 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 3m1c h ARG 416 CO -0.10 0.59 -0.02 0.28 -1.51 0.00 0.00 179.97 179.21 3m1c h VAL 417 N 0.92 1.33 -0.62 0.20 2.07 -0.71 -3.24 116.25 116.20 3m1c h VAL 417 Ca 0.34 -1.46 -0.02 0.00 0.82 0.00 0.00 66.70 66.38 3m1c h VAL 417 Cb 0.17 2.27 -0.03 0.00 -1.52 0.00 0.00 31.29 32.17 3m1c h VAL 417 CO -0.11 0.36 0.32 -0.07 0.02 0.00 0.00 177.57 178.09 3m1c h LEU 418 N -0.74 0.78 -1.79 2.57 3.38 -0.46 -2.23 115.31 116.82 3m1c h LEU 418 Ca -0.01 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 57.94 3m1c h LEU 418 Cb 0.63 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3m1c h LEU 418 CO 0.01 0.67 0.32 0.00 0.09 0.00 0.00 178.44 179.52 3m1c h ALA 419 N 1.15 2.12 0.10 1.53 0.00 -1.33 0.16 119.26 122.99 3m1c h ALA 419 Ca 0.22 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.95 3m1c h ALA 419 Cb 0.07 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 17.84 3m1c h ALA 419 CO -0.03 -0.22 -0.71 0.78 0.00 0.00 0.00 179.25 179.06 3m1c h GLY 420 N 0.24 0.34 2.00 0.00 0.00 -1.52 -2.54 103.07 101.59 3m1c h GLY 420 Ca 0.21 -0.80 -0.07 0.00 0.00 0.00 0.00 47.33 46.68 3m1c h GLY 420 CO -0.04 0.70 -0.31 1.41 0.00 0.00 0.00 176.54 178.30 3m1c h LEU 421 N -0.36 0.00 -0.05 3.11 3.38 -0.68 0.30 115.31 121.01 3m1c h LEU 421 Ca -0.12 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.75 3m1c h LEU 421 Cb 1.53 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.29 3m1c h LEU 421 CO 0.14 0.31 -0.37 0.00 0.09 0.00 0.00 178.44 178.61 3m1c h ALA 422 N 1.69 0.11 -0.22 1.53 0.00 -0.82 -1.50 119.26 120.05 3m1c h ALA 422 Ca -0.00 -0.47 -0.14 0.00 0.00 0.00 0.00 54.91 54.30 3m1c h ALA 422 Cb 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3m1c h ALA 422 CO 0.04 0.22 -0.44 0.00 0.00 0.00 0.00 179.25 179.07 3m1c h ALA 423 N 0.39 0.83 0.11 0.00 0.00 -1.21 0.45 119.26 119.83 3m1c h ALA 423 Ca -0.03 -0.45 -0.19 0.00 0.00 0.00 0.00 54.91 54.24 3m1c h ALA 423 Cb 1.05 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.74 3m1c h ALA 423 CO 0.08 0.65 -0.89 0.00 0.00 0.00 0.00 179.25 179.09 3m1c h ARG 424 N 0.45 0.23 0.00 0.00 3.08 -1.01 -1.85 114.38 115.27 3m1c h ARG 424 Ca 0.03 -0.39 -0.03 0.00 0.07 0.00 0.00 59.98 59.67 3m1c h ARG 424 Cb 0.94 0.14 -0.00 0.00 0.08 0.00 0.00 29.97 31.13 3m1c h ARG 424 CO 0.08 1.19 -0.80 0.78 -1.07 0.00 0.00 179.97 180.15 3m1c h GLY 425 N -0.37 0.00 0.00 0.04 0.00 -1.35 -3.33 103.07 98.06 3m1c h GLY 425 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.15 3m1c h GLY 425 CO 0.09 0.00 -0.89 0.00 0.00 0.00 0.00 176.54 175.74 3m1c n ALA 426 N -2.19 1.83 1.00 3.60 0.00 0.08 -4.67 120.51 120.16 3m1c n ALA 426 Ca -0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 3m1c n ALA 426 Cb 0.59 0.11 0.02 0.00 0.00 0.00 0.00 19.45 20.17 3m1c n ALA 426 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m1c n ALA 427 N -1.58 3.38 -0.89 0.00 0.00 -0.76 -1.29 120.51 119.37 3m1c n ALA 427 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 53.44 52.79 3m1c n ALA 427 Cb 0.23 -0.80 0.00 0.00 0.00 0.00 0.00 19.45 18.88 3m1c n ALA 427 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1c n GLY 428 N 1.41 0.63 3.93 0.00 0.00 -1.14 -4.53 105.19 105.50 3m1c n GLY 428 Ca 0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.83 3m1c n GLY 428 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1c s ALA 430 N -3.75 2.79 0.47 0.00 0.00 -1.26 -4.51 121.76 115.49 3m1c s ALA 430 Ca 0.71 -0.86 0.28 0.00 0.00 0.00 0.00 51.96 52.09 3m1c s ALA 430 Cb -0.05 -1.37 1.33 0.00 0.00 0.00 0.00 23.12 23.03 3m1c s ALA 430 CO 0.51 0.23 1.78 0.00 0.00 0.00 0.00 175.76 178.29 3m1c h ALA 431 N 6.70 2.67 0.00 0.00 0.00 -1.94 0.20 119.26 126.88 3m1c h ALA 431 Ca -0.28 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.64 3m1c h ALA 431 Cb 1.20 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3m1c h ALA 431 CO 0.59 -1.05 0.00 -0.40 0.00 0.00 0.00 179.25 178.38 3m1c n ASP 432 N -4.42 0.00 -0.11 0.00 5.68 -1.26 -1.92 116.55 114.51 3m1c n ASP 432 Ca 0.26 0.06 0.02 0.00 -0.50 0.00 0.00 54.79 54.63 3m1c n ASP 432 Cb 1.07 -0.24 0.00 0.00 -1.14 0.00 0.00 41.12 40.82 3m1c n ASP 432 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3m1c n SER 433 N -1.24 0.89 -4.77 -1.12 3.41 0.06 -4.89 113.62 105.96 3m1c n SER 433 Ca 0.05 -0.95 -0.40 0.00 -0.26 0.00 0.00 58.87 57.32 3m1c n SER 433 Cb 0.07 0.43 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 3m1c n SER 433 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3m1c s VAL 434 N -0.83 2.95 0.07 -3.33 1.01 -0.81 -4.31 120.40 115.15 3m1c s VAL 434 Ca 0.04 0.93 0.00 0.00 0.00 0.00 0.00 61.98 62.95 3m1c s VAL 434 Cb 0.04 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 32.79 3m1c s VAL 434 CO 0.11 0.20 -0.04 0.72 0.00 0.00 0.00 175.10 176.09 3m1c s PHE 435 N -1.18 0.67 -0.23 5.22 -0.12 0.16 -4.99 117.98 117.50 3m1c s PHE 435 Ca 0.49 -1.01 -0.05 0.00 -0.05 0.00 0.00 56.93 56.31 3m1c s PHE 435 Cb -0.37 -0.44 0.12 0.00 -0.63 0.00 0.00 43.02 41.70 3m1c s PHE 435 CO 0.48 -0.29 0.45 -1.17 -0.05 0.00 0.00 175.22 174.64 3m1c s LEU 436 N -2.97 -0.76 -0.44 -1.99 2.96 -1.26 -2.21 118.68 112.00 3m1c s LEU 436 Ca 0.09 0.81 -0.03 0.00 -0.22 0.00 0.00 54.13 54.78 3m1c s LEU 436 Cb 0.07 1.45 0.12 0.00 0.50 0.00 0.00 46.19 48.33 3m1c s LEU 436 CO -0.08 -0.25 0.25 0.20 -1.32 0.00 0.00 176.35 175.15 3m1c s ASN 437 N 2.65 5.29 -0.00 3.68 0.01 0.11 -5.00 114.94 121.67 3m1c s ASN 437 Ca 0.04 -2.14 -0.21 0.00 -0.71 0.00 0.00 52.86 49.84 3m1c s ASN 437 Cb -0.13 -1.85 -0.05 0.00 0.41 0.00 0.00 41.25 39.63 3m1c s ASN 437 CO -0.15 -0.53 0.61 -0.69 -1.51 0.00 0.00 177.10 174.83 3m1c s VAL 438 N 0.98 4.90 -0.36 1.60 1.01 -1.26 -1.32 120.40 125.94 3m1c s VAL 438 Ca 0.09 1.28 0.14 0.00 0.00 0.00 0.00 61.98 63.49 3m1c s VAL 438 Cb -0.23 -3.95 0.40 0.00 0.00 0.00 0.00 36.38 32.61 3m1c s VAL 438 CO -0.04 0.41 0.98 -1.54 0.00 0.00 0.00 175.10 174.91 3m1c n SER 439 N 2.75 0.33 0.13 3.32 3.41 -0.07 -4.84 113.62 118.65 3m1c n SER 439 Ca -0.06 -2.85 0.03 0.00 -0.26 0.00 0.00 58.87 55.73 3m1c n SER 439 Cb 0.51 -0.05 0.02 0.00 -0.26 0.00 0.00 64.21 64.43 3m1c n SER 439 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 3m1c h VAL 440 N 2.28 0.66 -3.73 -3.33 -1.51 -1.82 -2.85 116.25 105.95 3m1c h VAL 440 Ca -0.08 -1.98 -0.49 0.00 -1.23 0.00 0.00 66.70 62.92 3m1c h VAL 440 Cb 1.13 2.25 0.01 0.00 -2.13 0.00 0.00 31.29 32.56 3m1c h VAL 440 CO 0.37 0.37 0.14 -0.76 -1.23 0.00 0.00 177.57 176.47 3m1c s LEU 441 N -6.24 3.76 0.28 4.19 1.43 -1.26 -1.15 118.68 119.69 3m1c s LEU 441 Ca 0.03 1.14 -0.29 0.00 -1.03 0.00 0.00 54.13 53.97 3m1c s LEU 441 Cb 0.08 -4.04 -0.10 0.00 0.03 0.00 0.00 46.19 42.15 3m1c s LEU 441 CO 0.75 -0.46 1.39 -0.62 0.23 0.00 0.00 176.35 177.64 3m1c s ASP 442 N -3.34 6.70 0.25 2.29 2.15 0.32 -4.21 116.67 120.83 3m1c s ASP 442 Ca 0.51 2.67 -0.05 0.00 0.43 0.00 0.00 52.55 56.11 3m1c s ASP 442 Cb -0.10 -2.63 0.27 0.00 -0.30 0.00 0.00 42.92 40.16 3m1c s ASP 442 CO 0.34 -0.64 1.85 -0.65 -0.17 0.00 0.00 175.17 175.90 3m1c h PRO 443 N 4.43 1.15 -0.18 4.34 0.11 -1.94 -0.98 132.00 138.93 3m1c h PRO 443 Ca -0.47 -0.15 -0.16 0.00 0.11 0.00 0.00 66.00 65.32 3m1c h PRO 443 Cb 1.22 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 32.12 3m1c h PRO 443 CO 0.73 0.87 -0.52 0.00 -0.21 0.00 0.00 178.00 178.87 3m1c h ALA 444 N 1.30 0.30 -0.18 -0.75 0.00 -1.96 -2.56 119.26 115.41 3m1c h ALA 444 Ca 0.28 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 3m1c h ALA 444 Cb 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3m1c h ALA 444 CO -0.04 0.50 -0.08 0.00 0.00 0.00 0.00 179.25 179.63 3m1c h ALA 445 N 0.57 1.54 -0.05 0.00 0.00 -1.77 -2.63 119.26 116.92 3m1c h ALA 445 Ca -0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 3m1c h ALA 445 Cb 1.14 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 3m1c h ALA 445 CO 0.11 0.33 0.01 -0.09 0.00 0.00 0.00 179.25 179.61 3m1c h ARG 446 N 0.26 0.08 -0.94 0.00 2.43 -1.01 0.85 114.38 116.04 3m1c h ARG 446 Ca 0.06 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.26 3m1c h ARG 446 Cb 0.32 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.80 3m1c h ARG 446 CO 0.02 0.32 0.60 -0.07 -1.51 0.00 0.00 179.97 179.33 3m1c h LEU 447 N -0.17 0.97 0.24 3.80 3.38 -1.28 0.34 115.31 122.59 3m1c h LEU 447 Ca 0.01 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 3m1c h LEU 447 Cb 0.28 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.83 3m1c h LEU 447 CO 0.00 0.64 -0.11 0.03 0.09 0.00 0.00 178.44 179.08 3m1c h ARG 448 N 1.12 -0.30 -0.43 1.13 3.08 -1.30 -1.82 114.38 115.86 3m1c h ARG 448 Ca 0.40 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.55 3m1c h ARG 448 Cb 0.12 0.07 -0.07 0.00 0.08 0.00 0.00 29.97 30.17 3m1c h ARG 448 CO -0.16 -0.09 0.02 1.25 -1.07 0.00 0.00 179.97 179.92 3m1c h LEU 449 N -0.47 -0.14 -1.70 3.04 5.85 -0.06 -0.93 115.31 120.89 3m1c h LEU 449 Ca -0.03 0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 3m1c h LEU 449 Cb 0.36 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.54 3m1c h LEU 449 CO 0.05 -0.04 -0.10 -0.33 -0.34 0.00 0.00 178.44 177.68 3m1c h GLU 450 N 0.13 0.06 -0.08 1.25 5.08 -0.29 0.51 114.58 121.24 3m1c h GLU 450 Ca 0.21 -0.01 -0.12 0.00 -1.00 0.00 0.00 59.36 58.44 3m1c h GLU 450 Cb 0.30 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.54 3m1c h GLU 450 CO -0.34 0.17 -0.40 0.00 -1.00 0.00 0.00 179.01 177.44 3m1c h ALA 451 N 1.84 0.16 -0.15 3.43 0.00 -0.35 -1.98 119.26 122.21 3m1c h ALA 451 Ca 0.01 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 3m1c h ALA 451 Cb 0.23 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 3m1c h ALA 451 CO 0.01 0.28 0.04 -0.09 0.00 0.00 0.00 179.25 179.49 3m1c h ARG 452 N -0.03 0.23 -0.95 0.00 9.65 -0.99 -2.40 114.38 119.88 3m1c h ARG 452 Ca -0.03 -0.05 0.07 0.00 -1.10 0.00 0.00 59.98 58.87 3m1c h ARG 452 Cb 1.05 -0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 29.53 3m1c h ARG 452 CO 0.08 0.38 0.61 -0.07 2.80 0.00 0.00 179.97 183.77 3m1c h LEU 453 N 0.05 0.95 -0.48 3.80 3.38 -0.96 0.46 115.31 122.51 3m1c h LEU 453 Ca 0.05 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.12 3m1c h LEU 453 Cb 0.24 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.75 3m1c h LEU 453 CO -0.00 0.59 0.10 1.23 0.09 0.00 0.00 178.44 180.45 3m1c h GLY 454 N 1.08 0.58 1.09 0.83 0.00 -1.13 -0.44 103.07 105.08 3m1c h GLY 454 Ca 0.42 -0.02 -0.10 0.00 0.00 0.00 0.00 47.33 47.63 3m1c h GLY 454 CO -0.19 -0.06 -0.03 0.84 0.00 0.00 0.00 176.54 177.10 3m1c h HIS 455 N 0.23 1.17 -0.15 5.60 -0.00 -0.59 -2.45 115.15 118.95 3m1c h HIS 455 Ca 0.24 -0.21 -0.07 0.00 -0.00 0.00 0.00 60.37 60.32 3m1c h HIS 455 Cb 0.32 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.41 3m1c h HIS 455 CO -0.22 1.04 -0.23 -0.07 -0.00 0.00 0.00 177.93 178.44 3m1c h LEU 456 N 0.96 0.26 -1.24 0.26 3.38 -0.66 0.35 115.31 118.63 3m1c h LEU 456 Ca 0.16 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3m1c h LEU 456 Cb 0.59 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.24 3m1c h LEU 456 CO 0.04 0.51 0.49 0.58 0.09 0.00 0.00 178.44 180.14 3m1c h VAL 457 N 0.24 1.20 0.28 1.22 2.07 -0.74 0.15 116.25 120.67 3m1c h VAL 457 Ca 0.04 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 3m1c h VAL 457 Cb 0.55 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.42 3m1c h VAL 457 CO 0.04 0.19 -0.13 0.00 0.02 0.00 0.00 177.57 177.69 3m1c h ALA 458 N 1.52 -0.38 0.10 1.67 0.00 -0.88 -3.12 119.26 118.17 3m1c h ALA 458 Ca 0.27 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.00 3m1c h ALA 458 Cb -0.10 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.79 3m1c h ALA 458 CO -0.06 -0.49 -0.48 0.00 0.00 0.00 0.00 179.25 178.22 3m1c h ALA 459 N -0.31 -0.96 -0.94 0.00 0.00 -0.70 -2.37 119.26 113.97 3m1c h ALA 459 Ca -0.04 -0.10 0.20 0.00 0.00 0.00 0.00 54.91 54.97 3m1c h ALA 459 Cb 0.51 0.87 -0.18 0.00 0.00 0.00 0.00 17.79 18.99 3m1c h ALA 459 CO 0.06 -1.08 -0.18 0.82 0.00 0.00 0.00 179.25 178.88 3m1c h ILE 460 N -0.68 0.06 0.00 0.00 2.04 -0.82 0.58 117.51 118.69 3m1c h ILE 460 Ca -0.00 -0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 3m1c h ILE 460 Cb 0.69 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 3m1c h ILE 460 CO -0.27 0.00 0.00 -0.07 0.00 0.00 0.00 178.15 177.81 3m1c h LEU 461 N 0.01 0.00 0.00 1.44 3.38 -1.36 -2.44 115.31 116.34 3m1c h LEU 461 Ca 0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.45 3m1c h LEU 461 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 3m1c h LEU 461 CO -0.95 0.00 -0.76 1.21 0.09 0.00 0.00 178.44 178.03 3m1c n GLU 462 N -2.72 0.41 0.26 1.13 2.13 0.17 -4.80 120.64 117.22 3m1c n GLU 462 Ca -0.00 0.18 -0.15 0.00 0.66 0.00 0.00 57.16 57.84 3m1c n GLU 462 Cb 0.17 -1.23 -0.08 0.00 0.27 0.00 0.00 31.44 30.57 3m1c n GLU 462 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3m1c h ARG 463 N -0.78 -0.62 -6.93 5.31 3.08 -0.67 -3.45 114.38 110.31 3m1c h ARG 463 Ca 0.00 0.04 -0.48 0.00 0.07 0.00 0.00 59.98 59.61 3m1c h ARG 463 Cb 0.76 0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.95 3m1c h ARG 463 CO 0.00 -0.34 0.21 -1.21 -1.07 0.00 0.00 179.97 177.55 3m1c s GLU 464 N -5.40 3.94 -0.01 0.04 0.41 -0.92 -4.99 118.70 111.77 3m1c s GLU 464 Ca -0.16 0.73 0.06 0.00 -0.41 0.00 0.00 54.97 55.20 3m1c s GLU 464 Cb 0.03 -2.31 -0.10 0.00 -1.78 0.00 0.00 34.13 29.97 3m1c s GLU 464 CO 0.58 -0.04 0.14 1.04 -0.49 0.00 0.00 175.26 176.49 3m1c n GLN 465 N -1.03 0.29 -1.72 1.61 1.13 -1.26 -4.78 117.38 111.62 3m1c n GLN 465 Ca 0.04 -0.06 -0.37 0.00 -1.94 0.00 0.00 57.00 54.68 3m1c n GLN 465 Cb 0.54 -1.14 0.07 0.00 0.11 0.00 0.00 30.24 29.81 3m1c n GLN 465 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 3m1c n SER 466 N -1.71 2.05 0.05 1.08 2.88 -1.26 -4.91 113.62 111.81 3m1c n SER 466 Ca -0.01 0.84 -0.06 0.00 -1.33 0.00 0.00 58.87 58.31 3m1c n SER 466 Cb 0.16 -1.55 0.13 0.00 -0.75 0.00 0.00 64.21 62.20 3m1c n SER 466 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 3m1c h LEU 467 N 0.57 0.39 -1.34 2.46 5.85 -1.99 -2.54 115.31 118.71 3m1c h LEU 467 Ca -0.51 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.01 3m1c h LEU 467 Cb 1.34 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 42.23 3m1c h LEU 467 CO 0.53 0.83 0.34 0.58 -0.34 0.00 0.00 178.44 180.38 3m1c h VAL 468 N 0.28 1.17 0.00 1.05 2.07 -1.95 -2.17 116.25 116.71 3m1c h VAL 468 Ca 0.01 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.10 3m1c h VAL 468 Cb 0.99 0.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 3m1c h VAL 468 CO 0.09 0.18 -0.16 0.00 0.02 0.00 0.00 177.57 177.69 3m1c h ALA 469 N 1.57 0.01 -0.02 1.67 0.00 -1.89 -2.67 119.26 117.94 3m1c h ALA 469 Ca 0.21 -0.45 0.01 0.00 0.00 0.00 0.00 54.91 54.67 3m1c h ALA 469 Cb -0.01 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3m1c h ALA 469 CO -0.04 0.02 0.01 0.45 0.00 0.00 0.00 179.25 179.70 3m1c h HIS 470 N -0.64 0.00 0.00 0.00 -0.00 -1.47 -0.70 115.15 112.34 3m1c h HIS 470 Ca -0.02 0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.30 3m1c h HIS 470 Cb 0.96 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.36 3m1c h HIS 470 CO 0.20 0.00 -0.28 0.00 -0.00 0.00 0.00 177.93 177.84 3m1c h ALA 471 N 1.99 0.83 -0.00 2.45 0.00 -1.40 -1.97 119.26 121.17 3m1c h ALA 471 Ca 0.01 -0.21 -0.20 0.00 0.00 0.00 0.00 54.91 54.50 3m1c h ALA 471 Cb 0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3m1c h ALA 471 CO -0.00 0.29 -0.88 1.25 0.00 0.00 0.00 179.25 179.91 3m1c h LEU 472 N 0.00 0.33 -0.84 0.00 5.85 -0.98 -2.14 115.31 117.52 3m1c h LEU 472 Ca -0.01 -0.26 -0.10 0.00 0.84 0.00 0.00 57.88 58.35 3m1c h LEU 472 Cb 1.18 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 42.09 3m1c h LEU 472 CO 0.03 1.06 -0.19 1.23 -0.34 0.00 0.00 178.44 180.23 3m1c h GLY 473 N 1.68 0.71 0.60 3.75 0.00 -0.99 -0.39 103.07 108.43 3m1c h GLY 473 Ca -0.05 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 3m1c h GLY 473 CO 0.14 0.52 -0.01 -0.97 0.00 0.00 0.00 176.54 176.21 3m1c h TYR 474 N 0.58 0.06 0.00 5.60 0.05 -1.33 -2.52 116.97 119.42 3m1c h TYR 474 Ca 0.09 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.84 3m1c h TYR 474 Cb 0.65 -0.01 -0.00 0.00 1.01 0.00 0.00 36.73 38.37 3m1c h TYR 474 CO 0.03 0.47 -0.06 0.37 -1.05 0.00 0.00 178.16 177.92 3m1c h GLN 475 N -0.36 0.00 0.07 4.88 4.15 -1.24 -0.24 115.11 122.35 3m1c h GLN 475 Ca 0.01 0.00 -0.27 0.00 0.77 0.00 0.00 58.65 59.16 3m1c h GLN 475 Cb 0.46 0.00 0.02 0.00 0.21 0.00 0.00 27.48 28.16 3m1c h GLN 475 CO 0.00 0.06 -1.12 -0.07 -1.93 0.00 0.00 178.83 175.77 3m1c h LEU 476 N 0.00 0.73 -0.65 -2.39 3.38 -0.99 -2.15 115.31 113.24 3m1c h LEU 476 Ca -0.00 -0.64 -0.06 0.00 0.09 0.00 0.00 57.88 57.27 3m1c h LEU 476 Cb 0.20 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 3m1c h LEU 476 CO 0.01 1.45 0.17 0.00 0.09 0.00 0.00 178.44 180.16 3m1c h ALA 477 N 0.48 0.85 -0.58 1.53 0.00 -0.75 -1.59 119.26 119.20 3m1c h ALA 477 Ca -0.14 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.58 3m1c h ALA 477 Cb 1.79 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 19.29 3m1c h ALA 477 CO 0.21 0.55 0.33 0.35 0.00 0.00 0.00 179.25 180.69 3m1c h PHE 478 N 0.95 0.62 -0.47 0.00 3.57 -1.04 0.31 116.94 120.89 3m1c h PHE 478 Ca 0.20 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.64 3m1c h PHE 478 Cb 0.34 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 3m1c h PHE 478 CO 0.03 0.33 -0.07 0.28 -2.23 0.00 0.00 178.31 176.65 3m1c h VAL 479 N 0.65 1.25 -0.05 1.41 2.07 -1.23 -2.99 116.25 117.36 3m1c h VAL 479 Ca 0.24 -1.12 -0.17 0.00 0.82 0.00 0.00 66.70 66.47 3m1c h VAL 479 Cb 0.08 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.81 3m1c h VAL 479 CO -0.13 0.39 -0.71 -0.07 0.02 0.00 0.00 177.57 177.07 3m1c h LEU 480 N 0.75 0.32 -0.11 2.57 3.38 -0.74 -3.47 115.31 118.01 3m1c h LEU 480 Ca 0.13 -0.21 -0.43 0.00 0.09 0.00 0.00 57.88 57.46 3m1c h LEU 480 Cb 0.55 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.18 3m1c h LEU 480 CO 0.03 0.92 -0.66 -0.67 0.09 0.00 0.00 178.44 178.15 3m1c n ASP 481 N -3.81 -4.80 -4.40 -0.43 2.03 0.11 -4.96 116.55 100.29 3m1c n ASP 481 Ca -0.03 -0.55 -0.30 0.00 0.52 0.00 0.00 54.79 54.43 3m1c n ASP 481 Cb 0.69 -3.87 -0.13 0.00 -0.72 0.00 0.00 41.12 37.08 3m1c n ASP 481 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 3m1c s SER 482 N -3.00 3.42 0.22 1.67 1.04 -1.26 -5.04 113.70 110.75 3m1c s SER 482 Ca 0.51 -0.60 -0.09 0.00 0.48 0.00 0.00 55.95 56.25 3m1c s SER 482 Cb -0.26 -0.36 0.22 0.00 0.10 0.00 0.00 66.02 65.72 3m1c s SER 482 CO 0.63 0.23 1.85 -0.65 0.98 0.00 0.00 173.24 176.28 3m1c h PRO 483 N 4.35 0.88 0.02 4.02 0.11 -1.96 -0.76 132.00 138.66 3m1c h PRO 483 Ca -0.48 -0.05 0.03 0.00 0.11 0.00 0.00 66.00 65.60 3m1c h PRO 483 Cb 1.16 -0.20 -0.05 0.00 0.11 0.00 0.00 31.00 32.02 3m1c h PRO 483 CO 0.43 0.58 -0.34 0.00 -0.21 0.00 0.00 178.00 178.46 3m1c h ALA 484 N 1.32 -0.52 0.14 -0.75 0.00 -1.99 0.48 119.26 117.94 3m1c h ALA 484 Ca 0.30 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.20 3m1c h ALA 484 Cb 0.03 0.60 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 3m1c h ALA 484 CO -0.12 -0.86 -0.36 0.00 0.00 0.00 0.00 179.25 177.90 3m1c h ALA 485 N 0.17 -0.65 0.00 0.00 0.00 -1.82 0.12 119.26 117.08 3m1c h ALA 485 Ca 0.05 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3m1c h ALA 485 Cb 0.58 0.60 0.00 0.00 0.00 0.00 0.00 17.79 18.97 3m1c h ALA 485 CO -0.26 -0.92 0.00 1.88 0.00 0.00 0.00 179.25 179.94 3m1c h TYR 486 N -0.61 0.00 0.13 0.00 0.05 -1.00 -2.60 116.97 112.94 3m1c h TYR 486 Ca 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 3m1c h TYR 486 Cb 0.63 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.37 3m1c h TYR 486 CO -0.31 0.00 -0.06 0.78 -1.05 0.00 0.00 178.16 177.51 3m1c h GLY 487 N 0.06 -0.19 0.38 3.88 0.00 0.15 -2.61 103.07 104.75 3m1c h GLY 487 Ca 0.00 0.07 0.09 0.00 0.00 0.00 0.00 47.33 47.49 3m1c h GLY 487 CO 0.00 -0.07 0.21 0.00 0.00 0.00 0.00 176.54 176.68 3m1c h ALA 488 N -0.21 0.76 -0.00 3.60 0.00 -1.02 -3.06 119.26 119.32 3m1c h ALA 488 Ca -0.02 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3m1c h ALA 488 Cb 0.54 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3m1c h ALA 488 CO 0.03 -0.21 -0.38 1.33 0.00 0.00 0.00 179.25 180.03 3m1c n VAL 489 N -5.01 0.00 -0.02 0.00 0.24 -1.16 -4.34 118.33 108.05 3m1c n VAL 489 Ca 0.08 -0.04 -0.12 0.00 -2.04 0.00 0.00 64.34 62.22 3m1c n VAL 489 Cb 0.27 0.24 -0.07 0.00 -1.47 0.00 0.00 33.84 32.80 3m1c n VAL 489 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3m1c h ALA 490 N 3.24 0.10 -0.54 2.33 0.00 -1.35 -0.11 119.26 122.92 3m1c h ALA 490 Ca 0.00 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.81 3m1c h ALA 490 Cb 0.49 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 3m1c h ALA 490 CO 0.00 -0.23 0.21 -1.35 0.00 0.00 0.00 179.25 177.88 3m1c h PRO 491 N -0.15 0.39 -0.55 0.00 0.11 -1.77 -1.70 132.00 128.33 3m1c h PRO 491 Ca 0.02 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 66.17 3m1c h PRO 491 Cb 0.33 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 31.30 3m1c h PRO 491 CO 0.00 0.26 0.25 1.03 -0.21 0.00 0.00 178.00 179.33 3m1c h SER 492 N 0.40 0.33 -0.59 -2.05 0.87 -1.65 -2.03 113.55 108.83 3m1c h SER 492 Ca 0.26 0.05 -0.06 0.00 -1.23 0.00 0.00 61.79 60.80 3m1c h SER 492 Cb 0.27 -0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.20 3m1c h SER 492 CO -0.25 0.22 0.12 0.00 -0.53 0.00 0.00 176.83 176.38 3m1c h ALA 493 N 1.33 0.78 -0.49 6.23 0.00 -0.75 -1.87 119.26 124.49 3m1c h ALA 493 Ca 0.26 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.93 3m1c h ALA 493 Cb 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3m1c h ALA 493 CO -0.21 0.52 0.32 0.00 0.00 0.00 0.00 179.25 179.87 3m1c h ALA 494 N 1.02 0.63 -0.46 0.00 0.00 -1.05 -1.85 119.26 117.54 3m1c h ALA 494 Ca 0.18 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 3m1c h ALA 494 Cb 0.39 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3m1c h ALA 494 CO 0.01 0.09 0.04 -0.09 0.00 0.00 0.00 179.25 179.29 3m1c h ARG 495 N 0.67 0.73 -0.00 0.00 2.43 -1.10 -1.99 114.38 115.11 3m1c h ARG 495 Ca 0.18 -0.17 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 3m1c h ARG 495 Cb -0.06 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.40 3m1c h ARG 495 CO -0.04 0.72 0.00 1.25 -1.51 0.00 0.00 179.97 180.39 3m1c h LEU 496 N 0.70 0.01 -0.70 3.80 5.85 -1.13 -1.95 115.31 121.89 3m1c h LEU 496 Ca 0.15 -0.25 0.14 0.00 0.84 0.00 0.00 57.88 58.75 3m1c h LEU 496 Cb 0.37 -0.00 -0.10 0.00 0.37 0.00 0.00 40.66 41.30 3m1c h LEU 496 CO 0.01 0.26 0.19 0.40 -0.34 0.00 0.00 178.44 178.96 3m1c h ILE 497 N -0.24 0.58 -0.95 4.05 2.04 -1.12 0.35 117.51 122.22 3m1c h ILE 497 Ca 0.00 -0.10 0.05 0.00 1.00 0.00 0.00 64.86 65.81 3m1c h ILE 497 Cb 0.26 0.25 -0.06 0.00 -0.74 0.00 0.00 36.82 36.53 3m1c h ILE 497 CO 0.00 0.05 0.61 0.44 0.00 0.00 0.00 178.15 179.25 3m1c h ASP 498 N 0.30 0.99 0.04 1.72 3.32 -1.31 -2.26 116.42 119.23 3m1c h ASP 498 Ca 0.38 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.32 3m1c h ASP 498 Cb 0.61 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 3m1c h ASP 498 CO -0.46 0.65 -0.38 0.00 -1.72 0.00 0.00 179.24 177.33 3m1c h ALA 499 N 1.42 0.96 -0.08 3.45 0.00 -0.18 -2.97 119.26 121.87 3m1c h ALA 499 Ca 0.40 -0.42 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 3m1c h ALA 499 Cb 0.11 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3m1c h ALA 499 CO -0.16 0.62 -0.65 -0.07 0.00 0.00 0.00 179.25 178.99 3m1c h LEU 500 N 0.38 0.35 -1.44 0.00 3.38 -0.66 -2.34 115.31 114.98 3m1c h LEU 500 Ca 0.04 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 3m1c h LEU 500 Cb 0.84 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.48 3m1c h LEU 500 CO 0.07 0.90 -0.15 0.22 0.09 0.00 0.00 178.44 179.57 3m1c h TYR 501 N 0.22 0.18 0.00 1.13 3.20 -1.32 -0.99 116.97 119.39 3m1c h TYR 501 Ca -0.01 -0.02 -0.15 0.00 3.14 0.00 0.00 58.73 61.69 3m1c h TYR 501 Cb 1.19 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 39.38 3m1c h TYR 501 CO 0.03 0.33 -0.69 0.00 -1.64 0.00 0.00 178.16 176.19 3m1c h ALA 502 N 1.68 0.73 -0.07 1.82 0.00 -1.34 -0.10 119.26 121.99 3m1c h ALA 502 Ca 0.03 -0.63 -0.15 0.00 0.00 0.00 0.00 54.91 54.17 3m1c h ALA 502 Cb 0.38 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3m1c h ALA 502 CO 0.02 0.86 -0.61 0.93 0.00 0.00 0.00 179.25 180.46 3m1c h GLU 503 N 0.00 0.24 0.24 0.00 4.39 -0.81 -0.79 114.58 117.84 3m1c h GLU 503 Ca -0.01 -0.17 -0.34 0.00 0.34 0.00 0.00 59.36 59.19 3m1c h GLU 503 Cb 1.33 0.03 0.03 0.00 -0.10 0.00 0.00 28.75 30.03 3m1c h GLU 503 CO 0.09 0.78 -1.53 0.35 -1.16 0.00 0.00 179.01 177.53 3m1c h PHE 504 N 0.18 0.92 0.00 4.33 3.57 -0.99 -0.09 116.94 124.86 3m1c h PHE 504 Ca -0.01 -0.67 -0.05 0.00 3.53 0.00 0.00 57.97 60.77 3m1c h PHE 504 Cb 1.12 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 39.82 3m1c h PHE 504 CO 0.02 1.58 -0.24 -0.07 -2.23 0.00 0.00 178.31 177.38 3m1c h LEU 505 N 0.14 0.00 -0.91 0.59 4.07 -1.06 -2.16 115.31 115.98 3m1c h LEU 505 Ca -0.27 0.00 -0.07 0.00 0.08 0.00 0.00 57.88 57.62 3m1c h LEU 505 Cb 2.16 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.89 3m1c h LEU 505 CO 0.26 0.24 -0.33 1.23 -1.08 0.00 0.00 178.44 178.75 3m1c h GLY 506 N 1.18 0.00 0.00 0.83 0.00 -0.96 -3.44 103.07 100.69 3m1c h GLY 506 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3m1c h GLY 506 CO 0.03 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.18 3m1c n GLY 507 N 0.29 1.44 3.85 4.60 0.00 -0.81 -5.06 105.19 109.50 3m1c n GLY 507 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 3m1c n GLY 507 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3m1c s ARG 508 N 0.00 1.28 0.01 1.61 0.52 -0.09 -4.97 118.95 117.31 3m1c s ARG 508 Ca 0.00 0.09 0.06 0.00 -0.52 0.00 0.00 55.73 55.36 3m1c s ARG 508 Cb 0.00 -1.87 -0.03 0.00 0.52 0.00 0.00 34.95 33.57 3m1c s ARG 508 CO 0.00 -2.06 -0.18 0.00 0.02 0.00 0.00 175.30 173.08 3m1c s ALA 509 N -3.48 2.58 -1.14 2.13 0.00 -1.26 -4.32 121.76 116.26 3m1c s ALA 509 Ca 0.65 -1.12 -0.03 0.00 0.00 0.00 0.00 51.96 51.46 3m1c s ALA 509 Cb -0.11 -0.79 0.25 0.00 0.00 0.00 0.00 23.12 22.46 3m1c s ALA 509 CO 0.52 0.56 2.02 1.28 0.00 0.00 0.00 175.76 180.14 3m1c n LEU 510 N 1.86 7.59 -0.01 0.00 4.32 -1.26 -4.64 117.00 124.86 3m1c n LEU 510 Ca -0.16 -5.21 0.06 0.00 -0.02 0.00 0.00 56.01 50.68 3m1c n LEU 510 Cb 0.52 -1.24 -0.10 0.00 -1.62 0.00 0.00 43.42 40.98 3m1c n LEU 510 CO 0.26 2.04 -0.66 0.35 -1.22 0.00 0.00 177.39 178.16 3m1c n THR 511 N 0.62 0.03 -1.69 -5.08 -2.24 -1.26 -4.58 114.28 100.08 3m1c n THR 511 Ca 0.52 -0.29 -0.44 0.00 -2.27 0.00 0.00 64.05 61.56 3m1c n THR 511 Cb 0.26 0.18 -0.04 0.00 -2.10 0.00 0.00 70.33 68.63 3m1c n THR 511 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3m1c n ALA 512 N -1.95 1.99 -0.35 6.98 0.00 -1.26 -4.79 120.51 121.13 3m1c n ALA 512 Ca -0.03 0.42 0.12 0.00 0.00 0.00 0.00 53.44 53.96 3m1c n ALA 512 Cb 0.34 -2.42 0.31 0.00 0.00 0.00 0.00 19.45 17.68 3m1c n ALA 512 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3m1c h PRO 513 N 6.15 0.76 -0.62 0.00 0.11 -1.94 0.21 132.00 136.67 3m1c h PRO 513 Ca -0.44 -0.05 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 3m1c h PRO 513 Cb 1.23 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 32.14 3m1c h PRO 513 CO 0.91 0.50 0.30 1.98 -0.21 0.00 0.00 178.00 181.48 3m1c h MET 514 N 0.78 0.87 -0.15 1.05 4.05 -1.89 -0.62 114.93 119.03 3m1c h MET 514 Ca 0.57 -0.11 -0.04 0.00 -0.28 0.00 0.00 59.70 59.84 3m1c h MET 514 Cb 0.86 -0.17 -0.00 0.00 -0.80 0.00 0.00 31.60 31.49 3m1c h MET 514 CO -0.37 0.67 -0.08 0.28 0.23 0.00 0.00 176.91 177.64 3m1c h VAL 515 N 0.87 1.32 -0.42 -5.77 2.07 -0.99 -2.45 116.25 110.87 3m1c h VAL 515 Ca 0.22 -1.12 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 3m1c h VAL 515 Cb 0.08 1.75 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 3m1c h VAL 515 CO -0.03 0.33 0.19 0.03 0.02 0.00 0.00 177.57 178.11 3m1c h ARG 516 N -0.03 0.62 -0.93 1.57 3.08 -0.82 0.20 114.38 118.09 3m1c h ARG 516 Ca 0.03 -0.10 0.05 0.00 0.07 0.00 0.00 59.98 60.03 3m1c h ARG 516 Cb 0.55 -0.11 -0.06 0.00 0.08 0.00 0.00 29.97 30.44 3m1c h ARG 516 CO 0.02 0.56 0.60 -0.09 -1.07 0.00 0.00 179.97 180.00 3m1c h ARG 517 N 0.54 1.08 -0.51 0.04 2.43 -1.17 0.46 114.38 117.27 3m1c h ARG 517 Ca 0.14 -0.07 -0.12 0.00 -0.81 0.00 0.00 59.98 59.13 3m1c h ARG 517 Cb 0.16 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 3m1c h ARG 517 CO -0.01 0.72 -0.13 0.00 -1.51 0.00 0.00 179.97 179.03 3m1c h ALA 518 N 1.48 0.70 -0.32 2.80 0.00 -0.89 -2.78 119.26 120.25 3m1c h ALA 518 Ca 0.38 -0.36 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3m1c h ALA 518 Cb 0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 3m1c h ALA 518 CO -0.13 0.63 -0.16 1.25 0.00 0.00 0.00 179.25 180.84 3m1c h LEU 519 N 0.85 0.57 0.45 0.00 5.85 0.12 -1.70 115.31 121.45 3m1c h LEU 519 Ca 0.13 -0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 3m1c h LEU 519 Cb 0.70 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.57 3m1c h LEU 519 CO 0.05 0.75 -0.37 0.15 -0.34 0.00 0.00 178.44 178.68 3m1c h PHE 520 N 0.52 -1.00 0.00 1.25 3.57 0.14 -2.08 116.94 119.34 3m1c h PHE 520 Ca 0.09 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.52 3m1c h PHE 520 Cb 0.58 0.38 -0.01 0.00 2.79 0.00 0.00 35.95 39.69 3m1c h PHE 520 CO 0.02 -0.51 -0.31 1.88 -2.23 0.00 0.00 178.31 177.16 3m1c h TYR 521 N -0.79 0.00 -0.24 0.41 0.05 -1.45 -1.96 116.97 112.99 3m1c h TYR 521 Ca -0.06 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.53 3m1c h TYR 521 Cb 0.67 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.41 3m1c h TYR 521 CO -0.15 0.31 -0.59 0.00 -1.05 0.00 0.00 178.16 176.68 3m1c h ALA 522 N 1.69 0.50 -0.00 3.88 0.00 -1.24 -0.31 119.26 123.77 3m1c h ALA 522 Ca -0.00 -0.53 -0.11 0.00 0.00 0.00 0.00 54.91 54.27 3m1c h ALA 522 Cb 0.67 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3m1c h ALA 522 CO 0.04 0.69 -0.51 1.79 0.00 0.00 0.00 179.25 181.26 3m1c h THR 523 N 0.59 1.37 -0.51 0.00 1.35 -1.23 -2.12 112.91 112.35 3m1c h THR 523 Ca 0.00 -1.75 -0.05 0.00 -0.55 0.00 0.00 66.41 64.07 3m1c h THR 523 Cb 1.19 1.94 -0.02 0.00 -1.73 0.00 0.00 68.15 69.52 3m1c h THR 523 CO 0.12 0.50 0.13 0.00 -0.25 0.00 0.00 175.52 176.02 3m1c h ALA 524 N 1.49 1.27 -0.07 6.62 0.00 -0.77 -2.22 119.26 125.57 3m1c h ALA 524 Ca -0.00 -0.19 -0.21 0.00 0.00 0.00 0.00 54.91 54.50 3m1c h ALA 524 Cb 0.90 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.50 3m1c h ALA 524 CO 0.07 0.51 -0.79 0.28 0.00 0.00 0.00 179.25 179.32 3m1c h VAL 525 N 0.75 1.32 0.00 0.00 2.07 -0.75 -2.21 116.25 117.43 3m1c h VAL 525 Ca 0.17 -2.05 0.00 0.00 0.82 0.00 0.00 66.70 65.64 3m1c h VAL 525 Cb 0.27 2.25 0.00 0.00 -1.52 0.00 0.00 31.29 32.29 3m1c h VAL 525 CO -0.00 0.63 0.00 0.18 0.02 0.00 0.00 177.57 178.40 3m1c n LEU 526 N -4.01 0.35 -0.05 2.57 4.77 -0.83 -3.00 117.00 116.81 3m1c n LEU 526 Ca -0.09 0.56 -0.06 0.00 -0.03 0.00 0.00 56.01 56.38 3m1c n LEU 526 Cb 0.75 -0.47 -0.14 0.00 -2.33 0.00 0.00 43.42 41.23 3m1c n LEU 526 CO 0.52 -0.23 -0.78 -1.14 -1.33 0.00 0.00 177.39 174.43 3m1c n ARG 527 N -1.85 0.66 -0.33 3.23 0.63 -0.85 -4.60 116.66 113.53 3m1c n ARG 527 Ca 0.05 0.11 0.11 0.00 -0.92 0.00 0.00 57.85 57.20 3m1c n ARG 527 Cb 0.30 -1.66 0.28 0.00 0.45 0.00 0.00 32.46 31.83 3m1c n ARG 527 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3m1c h ALA 528 N 1.15 1.51 0.00 5.13 0.00 -1.30 -0.78 119.26 124.98 3m1c h ALA 528 Ca -0.36 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.62 3m1c h ALA 528 Cb 1.97 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.70 3m1c h ALA 528 CO 0.05 -0.07 -0.07 -1.35 0.00 0.00 0.00 179.25 177.80 3m1c h PRO 529 N 0.70 0.00 -0.30 0.00 0.11 -1.81 -2.43 132.00 128.27 3m1c h PRO 529 Ca 0.54 0.00 -0.17 0.00 0.11 0.00 0.00 66.00 66.47 3m1c h PRO 529 Cb 0.81 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.91 3m1c h PRO 529 CO -0.38 0.07 -0.49 0.74 -0.21 0.00 0.00 178.00 177.73 3m1c h PHE 530 N 0.00 1.01 0.00 0.65 0.04 -1.45 -2.51 116.94 114.68 3m1c h PHE 530 Ca -0.00 -0.34 -0.04 0.00 2.80 0.00 0.00 57.97 60.39 3m1c h PHE 530 Cb 0.13 -0.20 -0.01 0.00 2.20 0.00 0.00 35.95 38.08 3m1c h PHE 530 CO 0.00 1.14 -0.19 -0.07 -0.60 0.00 0.00 178.31 178.60 3m1c h LEU 531 N 0.65 0.00 -0.80 1.54 4.07 -1.46 -2.62 115.31 116.69 3m1c h LEU 531 Ca 0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.99 3m1c h LEU 531 Cb 1.08 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.82 3m1c h LEU 531 CO 0.11 0.19 -0.24 0.00 -1.08 0.00 0.00 178.44 177.41 3m1c n ALA 532 N -2.27 3.05 0.00 1.53 0.00 -0.95 -4.65 120.51 117.23 3m1c n ALA 532 Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.94 3m1c n ALA 532 Cb 0.33 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.74 3m1c n ALA 532 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1c n GLY 533 N 1.33 -1.83 2.66 0.00 0.00 -0.96 -5.03 105.19 101.37 3m1c n GLY 533 Ca 0.13 -1.28 -0.00 0.00 0.00 0.00 0.00 46.02 44.86 3m1c n GLY 533 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1c n ALA 534 N -0.41 -2.24 -1.96 4.61 0.00 -1.26 -4.84 120.51 114.41 3m1c n ALA 534 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.13 3m1c n ALA 534 Cb 0.00 -1.19 -0.02 0.00 0.00 0.00 0.00 19.45 18.24 3m1c n ALA 534 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3m1c s PRO 535 N -3.02 3.79 0.70 0.00 0.02 -1.26 -5.03 135.00 130.20 3m1c s PRO 535 Ca 0.01 0.73 -0.11 0.00 0.02 0.00 0.00 61.00 61.65 3m1c s PRO 535 Cb -0.00 -2.20 0.01 0.00 0.02 0.00 0.00 34.50 32.33 3m1c s PRO 535 CO 0.56 -0.29 1.06 -1.54 -0.33 0.00 0.00 177.00 176.47 3m1c s SER 536 N -3.45 5.36 0.44 2.53 1.04 -1.26 -4.79 113.70 113.57 3m1c s SER 536 Ca 0.55 1.48 0.18 0.00 0.48 0.00 0.00 55.95 58.64 3m1c s SER 536 Cb -0.10 -2.35 1.11 0.00 0.10 0.00 0.00 66.02 64.77 3m1c s SER 536 CO 0.38 -1.44 1.91 0.00 0.98 0.00 0.00 173.24 175.07 3m1c h ALA 537 N -0.72 2.21 0.05 5.32 0.00 -1.99 0.14 119.26 124.27 3m1c h ALA 537 Ca -0.45 0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.22 3m1c h ALA 537 Cb 1.22 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.98 3m1c h ALA 537 CO 0.59 -0.44 -1.06 1.49 0.00 0.00 0.00 179.25 179.84 3m1c h GLU 538 N 0.36 0.40 -0.26 0.00 4.81 -1.99 -2.62 114.58 115.28 3m1c h GLU 538 Ca 0.39 -0.50 -0.14 0.00 -0.13 0.00 0.00 59.36 58.98 3m1c h GLU 538 Cb 1.00 0.16 -0.01 0.00 0.63 0.00 0.00 28.75 30.53 3m1c h GLU 538 CO -0.12 1.17 -0.42 1.96 -0.73 0.00 0.00 179.01 180.87 3m1c h GLN 539 N 0.20 0.64 -0.01 1.92 4.20 -1.46 -1.84 115.11 118.76 3m1c h GLN 539 Ca -0.11 -0.34 -0.00 0.00 0.06 0.00 0.00 58.65 58.26 3m1c h GLN 539 Cb 1.72 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 29.51 3m1c h GLN 539 CO 0.18 0.94 -0.01 0.00 -0.67 0.00 0.00 178.83 179.28 3m1c h ARG 540 N 0.52 0.02 -0.76 1.46 3.08 -0.85 -2.88 114.38 114.98 3m1c h ARG 540 Ca 0.04 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.15 3m1c h ARG 540 Cb 0.94 -0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.93 3m1c h ARG 540 CO 0.08 0.43 0.43 1.49 -1.07 0.00 0.00 179.97 181.34 3m1c h GLU 541 N -0.38 0.74 -0.25 0.04 4.57 -1.43 0.99 114.58 118.87 3m1c h GLU 541 Ca 0.00 -0.04 -0.05 0.00 -1.18 0.00 0.00 59.36 58.09 3m1c h GLU 541 Cb 0.42 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 28.83 3m1c h GLU 541 CO 0.00 0.49 -0.07 -0.09 -1.18 0.00 0.00 179.01 178.16 3m1c h ARG 542 N 0.76 0.39 0.04 1.92 2.43 -1.33 -2.66 114.38 115.93 3m1c h ARG 542 Ca 0.35 -0.09 -0.28 0.00 -0.81 0.00 0.00 59.98 59.15 3m1c h ARG 542 Cb 0.26 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.72 3m1c h ARG 542 CO -0.21 0.48 -1.56 0.00 -1.51 0.00 0.00 179.97 177.17 3m1c h ALA 543 N 1.56 0.56 -0.98 2.80 0.00 -1.11 -3.05 119.26 119.04 3m1c h ALA 543 Ca 0.08 -1.28 0.01 0.00 0.00 0.00 0.00 54.91 53.72 3m1c h ALA 543 Cb 0.36 0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 3m1c h ALA 543 CO 0.02 1.41 0.65 -0.09 0.00 0.00 0.00 179.25 181.24 3m1c h ARG 544 N 0.02 1.29 -0.10 0.00 2.43 -0.69 0.74 114.38 118.07 3m1c h ARG 544 Ca -0.23 -0.08 -0.18 0.00 -0.81 0.00 0.00 59.98 58.68 3m1c h ARG 544 Cb 1.97 -0.29 -0.00 0.00 -0.42 0.00 0.00 29.97 31.22 3m1c h ARG 544 CO 0.11 0.85 -0.69 -0.09 -1.51 0.00 0.00 179.97 178.64 3m1c h ARG 545 N 1.33 0.43 0.00 0.20 2.43 -1.55 -0.54 114.38 116.68 3m1c h ARG 545 Ca 0.36 -0.33 -0.08 0.00 -0.81 0.00 0.00 59.98 59.12 3m1c h ARG 545 Cb -0.15 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 3m1c h ARG 545 CO -0.08 0.96 -0.37 0.78 -1.51 0.00 0.00 179.97 179.76 3m1c h GLY 546 N 1.23 0.00 1.32 2.80 0.00 -1.29 -1.54 103.07 105.60 3m1c h GLY 546 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.01 3m1c h GLY 546 CO 0.12 0.00 -1.27 1.41 0.00 0.00 0.00 176.54 176.80 3m1c h LEU 547 N 0.00 0.79 -1.23 3.11 3.38 -0.58 -1.04 115.31 119.73 3m1c h LEU 547 Ca -0.00 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.21 3m1c h LEU 547 Cb 0.66 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 3m1c h LEU 547 CO 0.05 1.57 0.48 -0.07 0.09 0.00 0.00 178.44 180.55 3m1c h LEU 548 N 0.22 0.87 0.23 1.67 3.38 -0.96 -1.45 115.31 119.28 3m1c h LEU 548 Ca -0.19 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 3m1c h LEU 548 Cb 1.95 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 42.49 3m1c h LEU 548 CO 0.24 0.65 -0.11 0.40 0.09 0.00 0.00 178.44 179.70 3m1c h ILE 549 N 1.02 0.72 -0.44 1.22 2.04 -1.29 -2.13 117.51 118.64 3m1c h ILE 549 Ca 0.27 -0.91 -0.02 0.00 1.00 0.00 0.00 64.86 65.19 3m1c h ILE 549 Cb -0.09 1.15 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 3m1c h ILE 549 CO -0.06 0.17 0.17 0.71 0.00 0.00 0.00 178.15 179.14 3m1c h THR 550 N -0.86 1.17 -0.83 -0.27 1.35 -1.14 0.19 112.91 112.53 3m1c h THR 550 Ca -0.03 -0.53 -0.01 0.00 -0.55 0.00 0.00 66.41 65.29 3m1c h THR 550 Cb 0.51 0.65 -0.04 0.00 -1.73 0.00 0.00 68.15 67.54 3m1c h THR 550 CO 0.05 0.21 0.49 0.74 -0.25 0.00 0.00 175.52 176.75 3m1c h THR 551 N 0.62 1.23 -0.64 6.82 2.02 -1.32 -1.97 112.91 119.68 3m1c h THR 551 Ca 0.15 -0.53 -0.07 0.00 0.77 0.00 0.00 66.41 66.73 3m1c h THR 551 Cb 0.13 0.09 -0.03 0.00 -1.74 0.00 0.00 68.15 66.61 3m1c h THR 551 CO -0.01 0.25 0.14 0.00 0.37 0.00 0.00 175.52 176.26 3m1c h ALA 552 N 1.26 1.03 0.00 6.16 0.00 -0.40 -2.84 119.26 124.46 3m1c h ALA 552 Ca 0.30 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 3m1c h ALA 552 Cb -0.02 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 3m1c h ALA 552 CO -0.05 0.63 -0.15 -0.07 0.00 0.00 0.00 179.25 179.60 3m1c h LEU 553 N 0.97 0.00 -6.69 0.00 3.38 -0.29 -3.34 115.31 109.35 3m1c h LEU 553 Ca 0.20 0.00 -0.77 0.00 0.09 0.00 0.00 57.88 57.40 3m1c h LEU 553 Cb 0.37 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 40.92 3m1c h LEU 553 CO 0.00 0.15 1.54 0.00 0.09 0.00 0.00 178.44 180.23 3m1c s THR 555 N -0.68 2.00 0.28 0.00 -4.23 -1.25 -4.84 115.64 106.92 3m1c s THR 555 Ca 0.37 0.00 0.01 0.00 -1.18 0.00 0.00 61.69 60.88 3m1c s THR 555 Cb 0.07 -2.97 0.28 0.00 1.34 0.00 0.00 72.50 71.22 3m1c s THR 555 CO 0.04 -0.00 1.84 0.77 -0.54 0.00 0.00 174.62 176.73 3m1c h SER 556 N -1.11 0.95 -0.27 3.99 4.64 -0.94 -0.36 113.55 120.44 3m1c h SER 556 Ca -0.47 0.04 -0.05 0.00 -0.47 0.00 0.00 61.79 60.85 3m1c h SER 556 Cb 1.33 -0.15 -0.01 0.00 -0.31 0.00 0.00 62.40 63.26 3m1c h SER 556 CO 0.65 0.52 -0.02 0.44 -0.87 0.00 0.00 176.83 177.56 3m1c h ASP 557 N 1.03 0.49 -0.84 4.97 3.45 -1.92 -1.37 116.42 122.22 3m1c h ASP 557 Ca 0.49 -0.33 -0.02 0.00 0.43 0.00 0.00 57.03 57.60 3m1c h ASP 557 Cb 0.44 -0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 39.04 3m1c h ASP 557 CO -0.25 0.70 0.46 0.58 -1.57 0.00 0.00 179.24 179.16 3m1c h VAL 558 N 0.27 1.25 0.37 -1.35 2.07 -1.72 -1.88 116.25 115.25 3m1c h VAL 558 Ca 0.07 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 66.97 3m1c h VAL 558 Cb 0.46 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 3m1c h VAL 558 CO 0.02 0.28 -0.34 0.00 0.02 0.00 0.00 177.57 177.55 3m1c h ALA 559 N 1.25 -0.74 -0.76 1.67 0.00 -0.76 0.16 119.26 120.07 3m1c h ALA 559 Ca 0.30 -0.12 0.14 0.00 0.00 0.00 0.00 54.91 55.23 3m1c h ALA 559 Cb 0.04 0.47 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 3m1c h ALA 559 CO -0.05 -0.95 0.51 0.00 0.00 0.00 0.00 179.25 178.76 3m1c h ALA 560 N -0.24 2.06 -0.19 0.00 0.00 -1.12 -0.67 119.26 119.11 3m1c h ALA 560 Ca -0.03 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.71 3m1c h ALA 560 Cb 0.64 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3m1c h ALA 560 CO -0.04 -0.26 -0.54 0.00 0.00 0.00 0.00 179.25 178.40 3m1c h ALA 561 N 1.64 0.32 0.00 0.00 0.00 -0.80 -2.81 119.26 117.61 3m1c h ALA 561 Ca 0.37 -0.51 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 3m1c h ALA 561 Cb 0.80 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3m1c h ALA 561 CO -0.13 0.53 -0.16 0.00 0.00 0.00 0.00 179.25 179.50 3m1c h THR 562 N 0.41 0.58 -0.29 0.00 1.03 0.82 0.08 112.91 115.54 3m1c h THR 562 Ca -0.01 -0.72 -0.15 0.00 -0.01 0.00 0.00 66.41 65.52 3m1c h THR 562 Cb 1.16 1.47 -0.00 0.00 -1.07 0.00 0.00 68.15 69.71 3m1c h THR 562 CO 0.12 0.15 -0.40 0.45 -0.01 0.00 0.00 175.52 175.83 3m1c h HIS 563 N 0.00 0.95 -0.43 0.00 3.86 -1.24 -2.61 115.15 115.69 3m1c h HIS 563 Ca -0.00 -0.31 -0.13 0.00 -1.16 0.00 0.00 60.37 58.77 3m1c h HIS 563 Cb 0.46 -0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 3m1c h HIS 563 CO 0.00 1.10 -0.23 0.00 0.86 0.00 0.00 177.93 179.66 3m1c h ALA 564 N 0.69 0.60 -0.05 2.45 0.00 -0.95 -1.93 119.26 120.07 3m1c h ALA 564 Ca 0.03 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.55 3m1c h ALA 564 Cb 0.99 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 3m1c h ALA 564 CO 0.09 0.60 0.02 0.22 0.00 0.00 0.00 179.25 180.18 3m1c h ASP 565 N 0.74 0.07 -0.65 0.00 3.58 -1.09 -1.01 116.42 118.06 3m1c h ASP 565 Ca 0.09 -0.17 -0.03 0.00 0.42 0.00 0.00 57.03 57.34 3m1c h ASP 565 Cb 0.80 -0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.81 3m1c h ASP 565 CO 0.07 0.22 0.28 -0.07 -2.88 0.00 0.00 179.24 176.86 3m1c h LEU 566 N -0.09 0.87 -1.15 2.28 3.38 -1.50 0.16 115.31 119.26 3m1c h LEU 566 Ca 0.02 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 3m1c h LEU 566 Cb 0.17 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 3m1c h LEU 566 CO -0.00 0.78 0.41 0.03 0.09 0.00 0.00 178.44 179.75 3m1c h ARG 567 N 0.90 1.00 0.00 1.13 3.08 -1.27 -1.07 114.38 118.15 3m1c h ARG 567 Ca 0.22 -0.10 -0.14 0.00 0.07 0.00 0.00 59.98 60.03 3m1c h ARG 567 Cb 0.16 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 3m1c h ARG 567 CO -0.02 0.72 -0.66 0.00 -1.07 0.00 0.00 179.97 178.94 3m1c h ALA 568 N 1.44 0.72 -0.03 0.04 0.00 -0.58 -2.84 119.26 118.01 3m1c h ALA 568 Ca 0.26 -0.60 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 3m1c h ALA 568 Cb 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.69 3m1c h ALA 568 CO -0.04 0.83 -0.13 0.00 0.00 0.00 0.00 179.25 179.90 3m1c h ALA 569 N 1.34 0.05 -0.91 0.00 0.00 0.20 -2.91 119.26 117.04 3m1c h ALA 569 Ca -0.01 -0.38 0.03 0.00 0.00 0.00 0.00 54.91 54.55 3m1c h ALA 569 Cb 1.33 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 19.06 3m1c h ALA 569 CO 0.09 -0.02 0.59 -0.07 0.00 0.00 0.00 179.25 179.84 3m1c h LEU 570 N -0.46 1.00 -1.00 0.00 3.38 -1.31 -2.25 115.31 114.67 3m1c h LEU 570 Ca -0.01 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.05 3m1c h LEU 570 Cb 0.80 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 41.24 3m1c h LEU 570 CO 0.03 0.69 0.63 0.00 0.09 0.00 0.00 178.44 179.88 3m1c h ALA 571 N 1.36 1.46 0.00 1.53 0.00 -1.49 -2.63 119.26 119.49 3m1c h ALA 571 Ca 0.35 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.19 3m1c h ALA 571 Cb -0.03 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 3m1c h ALA 571 CO -0.11 0.31 -0.38 -0.09 0.00 0.00 0.00 179.25 178.98 3m1c h ARG 572 N 1.06 0.00 -6.41 0.00 2.43 -1.20 -3.46 114.38 106.80 3m1c h ARG 572 Ca 0.47 0.00 -0.53 0.00 -0.81 0.00 0.00 59.98 59.11 3m1c h ARG 572 Cb 0.36 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 3m1c h ARG 572 CO -0.23 0.38 0.22 0.95 -1.51 0.00 0.00 179.97 179.78 3m1c s THR 573 N -3.68 4.59 -0.62 0.20 -4.23 -0.99 -4.86 115.64 106.05 3m1c s THR 573 Ca -0.00 1.76 0.07 0.00 -1.18 0.00 0.00 61.69 62.34 3m1c s THR 573 Cb 0.11 -4.18 0.18 0.00 1.34 0.00 0.00 72.50 69.96 3m1c s THR 573 CO 0.69 0.38 1.13 -0.90 -0.54 0.00 0.00 174.62 175.38 3m1c n ASP 574 N 2.55 2.51 -1.55 3.99 5.68 -1.09 -4.99 116.55 123.66 3m1c n ASP 574 Ca -0.02 -1.94 -0.18 0.00 -0.50 0.00 0.00 54.79 52.15 3m1c n ASP 574 Cb 0.50 -0.14 -0.08 0.00 -1.14 0.00 0.00 41.12 40.26 3m1c n ASP 574 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3m1c n HIS 575 N 0.17 -0.15 0.00 2.11 8.25 -1.21 -4.79 115.22 119.60 3m1c n HIS 575 Ca 0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.53 3m1c n HIS 575 Cb 0.35 -3.20 0.00 0.00 1.12 0.00 0.00 29.99 28.26 3m1c n HIS 575 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3m1c n GLN 576 N -2.23 0.00 -0.20 -0.41 10.64 -1.26 -4.73 117.38 119.19 3m1c n GLN 576 Ca -0.18 0.00 -0.09 0.00 -1.83 0.00 0.00 57.00 54.89 3m1c n GLN 576 Cb 0.61 0.00 0.02 0.00 -0.86 0.00 0.00 30.24 30.00 3m1c n GLN 576 CO 0.00 0.00 0.00 1.57 -1.83 0.00 0.00 177.06 176.80 3m1c h LYS 577 N 0.00 0.99 -3.86 2.61 -0.00 -1.93 -3.39 116.57 111.00 3m1c h LYS 577 Ca 0.00 -0.31 -0.71 0.00 -0.00 0.00 0.00 60.65 59.63 3m1c h LYS 577 Cb 0.00 -0.09 -0.34 0.00 -0.00 0.00 0.00 32.23 31.80 3m1c h LYS 577 CO 0.00 0.99 -0.37 -0.80 -0.00 0.00 0.00 179.45 179.26 3m1c s ASN 578 N -6.48 5.39 0.77 7.07 0.01 -1.26 -5.05 114.94 115.39 3m1c s ASN 578 Ca -0.12 -2.59 -0.10 0.00 -0.71 0.00 0.00 52.86 49.34 3m1c s ASN 578 Cb 0.13 -1.89 0.08 0.00 0.41 0.00 0.00 41.25 39.98 3m1c s ASN 578 CO 0.84 -0.45 1.12 -0.76 -1.51 0.00 0.00 177.10 176.34 3m1c s LEU 579 N 0.33 2.65 -0.32 0.60 1.43 -1.26 -2.67 118.68 119.43 3m1c s LEU 579 Ca 0.14 0.60 0.01 0.00 -1.03 0.00 0.00 54.13 53.85 3m1c s LEU 579 Cb -0.21 -3.13 0.10 0.00 0.03 0.00 0.00 46.19 42.98 3m1c s LEU 579 CO -0.04 -1.83 0.08 0.12 0.23 0.00 0.00 176.35 174.92 3m1c s PHE 580 N -3.46 2.40 -0.38 0.29 5.36 -1.26 -4.87 117.98 116.06 3m1c s PHE 580 Ca 0.62 -2.17 -0.13 0.00 -0.96 0.00 0.00 56.93 54.29 3m1c s PHE 580 Cb -0.10 -2.12 0.01 0.00 -0.34 0.00 0.00 43.02 40.46 3m1c s PHE 580 CO 0.47 -0.90 0.26 -1.58 -1.46 0.00 0.00 175.22 172.01 3m1c s TRP 581 N 1.37 3.23 0.15 10.12 0.52 -1.26 -4.54 118.94 128.53 3m1c s TRP 581 Ca 0.10 -0.53 -0.21 0.00 0.02 0.00 0.00 56.10 55.48 3m1c s TRP 581 Cb -0.18 -2.51 0.04 0.00 -1.15 0.00 0.00 33.47 29.67 3m1c s TRP 581 CO -0.19 -0.52 1.65 1.25 0.02 0.00 0.00 176.95 179.16 3m1c h LEU 582 N 8.54 -0.59 -1.11 2.99 5.85 -1.95 -2.03 115.31 127.01 3m1c h LEU 582 Ca -0.28 0.12 0.28 0.00 0.84 0.00 0.00 57.88 58.84 3m1c h LEU 582 Cb 1.13 0.30 -0.12 0.00 0.37 0.00 0.00 40.66 42.34 3m1c h LEU 582 CO 0.68 -0.22 0.62 -0.65 -0.34 0.00 0.00 178.44 178.54 3m1c h PRO 583 N -0.16 0.43 0.00 5.25 0.11 -1.97 0.46 132.00 136.12 3m1c h PRO 583 Ca 0.15 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.23 3m1c h PRO 583 Cb 0.38 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.39 3m1c h PRO 583 CO -0.36 0.28 0.00 -0.25 -0.21 0.00 0.00 178.00 177.46 3m1c n ASP 584 N -4.86 0.31 -0.57 -2.05 9.92 -0.76 -2.25 116.55 116.29 3m1c n ASP 584 Ca 0.29 0.58 0.07 0.00 -0.53 0.00 0.00 54.79 55.20 3m1c n ASP 584 Cb 0.89 -0.64 0.20 0.00 -0.64 0.00 0.00 41.12 40.92 3m1c n ASP 584 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 3m1c n HIS 585 N -1.85 0.48 -1.64 1.24 8.25 0.16 -4.62 115.22 117.24 3m1c n HIS 585 Ca 0.02 -1.11 -0.38 0.00 -0.26 0.00 0.00 57.72 56.00 3m1c n HIS 585 Cb 0.18 -0.27 0.05 0.00 1.12 0.00 0.00 29.99 31.07 3m1c n HIS 585 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3m1c n PHE 586 N -1.05 1.08 -4.15 4.41 7.35 -0.95 -4.97 117.46 119.19 3m1c n PHE 586 Ca 0.21 0.44 -0.16 0.00 -0.76 0.00 0.00 57.45 57.18 3m1c n PHE 586 Cb 0.79 -2.17 -0.11 0.00 0.35 0.00 0.00 39.48 38.33 3m1c n PHE 586 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 3m1c s SER 587 N -1.23 1.40 0.45 -2.13 1.04 -1.26 -4.86 113.70 107.11 3m1c s SER 587 Ca 0.76 -0.66 0.21 0.00 0.48 0.00 0.00 55.95 56.73 3m1c s SER 587 Cb -0.42 -0.01 1.18 0.00 0.10 0.00 0.00 66.02 66.88 3m1c s SER 587 CO 0.47 -0.17 1.88 -0.65 0.98 0.00 0.00 173.24 175.75 3m1c h PRO 588 N 4.11 0.29 -0.85 4.02 0.11 -1.91 -2.47 132.00 135.29 3m1c h PRO 588 Ca -0.38 -0.02 0.20 0.00 0.11 0.00 0.00 66.00 65.91 3m1c h PRO 588 Cb 1.19 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.18 3m1c h PRO 588 CO 0.44 0.19 0.58 0.00 -0.21 0.00 0.00 178.00 179.00 3m1c n ALA 590 N -2.56 2.88 -1.54 0.00 0.00 -0.93 -3.31 120.51 115.06 3m1c n ALA 590 Ca 0.18 -0.22 0.07 0.00 0.00 0.00 0.00 53.44 53.46 3m1c n ALA 590 Cb 0.71 -1.31 0.13 0.00 0.00 0.00 0.00 19.45 18.99 3m1c n ALA 590 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3m1c n ALA 591 N -1.46 2.75 -2.60 0.00 0.00 0.43 -3.17 120.51 116.45 3m1c n ALA 591 Ca 0.07 -2.64 -0.18 0.00 0.00 0.00 0.00 53.44 50.69 3m1c n ALA 591 Cb 0.33 -0.42 0.09 0.00 0.00 0.00 0.00 19.45 19.44 3m1c n ALA 591 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 3m1c n SER 592 N -0.93 1.13 -1.82 0.00 3.41 0.10 -4.69 113.62 110.83 3m1c n SER 592 Ca 0.14 -1.92 -0.20 0.00 -0.26 0.00 0.00 58.87 56.62 3m1c n SER 592 Cb 0.72 -0.47 0.10 0.00 -0.26 0.00 0.00 64.21 64.30 3m1c n SER 592 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3m1c n LEU 593 N 0.00 5.44 -4.35 1.04 4.77 -1.26 -4.77 117.00 117.87 3m1c n LEU 593 Ca 0.13 -4.28 -0.37 0.00 -0.03 0.00 0.00 56.01 51.46 3m1c n LEU 593 Cb 0.46 -0.62 -0.13 0.00 -2.33 0.00 0.00 43.42 40.80 3m1c n LEU 593 CO 0.31 1.63 -0.28 -0.13 -1.33 0.00 0.00 177.39 177.59 3m1c s ARG 594 N -3.54 3.13 -0.14 3.23 0.52 -1.26 -1.80 118.95 119.10 3m1c s ARG 594 Ca 0.53 -0.82 0.15 0.00 -0.52 0.00 0.00 55.73 55.06 3m1c s ARG 594 Cb 0.44 -3.34 0.32 0.00 0.52 0.00 0.00 34.95 32.89 3m1c s ARG 594 CO 0.01 -0.41 1.16 1.19 0.02 0.00 0.00 175.30 177.27 3m1c n PHE 595 N 4.86 0.00 0.13 -0.53 3.72 0.44 -4.56 117.46 121.52 3m1c n PHE 595 Ca -0.15 -1.06 0.08 0.00 -0.05 0.00 0.00 57.45 56.27 3m1c n PHE 595 Cb 0.48 -0.18 0.15 0.00 -0.94 0.00 0.00 39.48 38.99 3m1c n PHE 595 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3m1c n ASP 596 N -1.03 2.86 0.17 4.37 5.75 -1.18 -4.70 116.55 122.79 3m1c n ASP 596 Ca 0.15 -1.85 0.12 0.00 -0.01 0.00 0.00 54.79 53.20 3m1c n ASP 596 Cb 0.70 -0.19 0.59 0.00 -1.03 0.00 0.00 41.12 41.20 3m1c n ASP 596 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 3m1c h LEU 597 N 2.89 0.00 -2.71 -2.12 3.38 -1.89 -2.45 115.31 112.41 3m1c h LEU 597 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3m1c h LEU 597 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 3m1c h LEU 597 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.53 3m1c n ALA 598 N -1.81 2.27 -1.43 1.53 0.00 -1.26 -4.65 120.51 115.17 3m1c n ALA 598 Ca -0.00 -1.15 -0.30 0.00 0.00 0.00 0.00 53.44 51.99 3m1c n ALA 598 Cb 0.12 -0.61 0.09 0.00 0.00 0.00 0.00 19.45 19.05 3m1c n ALA 598 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3m1c s GLU 599 N -1.03 2.17 0.14 0.00 2.02 -0.92 -4.85 118.70 116.23 3m1c s GLU 599 Ca 0.32 0.87 -0.31 0.00 0.02 0.00 0.00 54.97 55.86 3m1c s GLU 599 Cb 0.17 -1.91 -0.08 0.00 0.10 0.00 0.00 34.13 32.41 3m1c s GLU 599 CO 0.22 -1.62 1.55 0.78 0.02 0.00 0.00 175.26 176.21 3m1c h GLY 600 N -1.09 -0.89 0.69 -1.39 0.00 -1.94 -2.06 103.07 96.38 3m1c h GLY 600 Ca -0.46 0.73 0.17 0.00 0.00 0.00 0.00 47.33 47.77 3m1c h GLY 600 CO 0.56 -0.07 0.49 -1.33 0.00 0.00 0.00 176.54 176.19 3m1c h GLY 601 N -0.26 0.00 1.81 4.60 0.00 -1.93 -1.85 103.07 105.45 3m1c h GLY 601 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.25 3m1c h GLY 601 CO -0.72 0.00 -0.99 0.74 0.00 0.00 0.00 176.54 175.57 3m1c h PHE 602 N 0.00 0.00 -0.23 5.60 0.04 -1.67 -2.97 116.94 117.72 3m1c h PHE 602 Ca 0.28 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.85 3m1c h PHE 602 Cb 1.26 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.41 3m1c h PHE 602 CO 0.00 0.85 -0.64 0.82 -0.60 0.00 0.00 178.31 178.75 3m1c h ILE 603 N 0.00 1.28 -0.49 -0.55 1.08 -1.27 -1.92 117.51 115.64 3m1c h ILE 603 Ca -0.05 -1.83 -0.01 0.00 -0.39 0.00 0.00 64.86 62.58 3m1c h ILE 603 Cb 1.69 1.77 -0.02 0.00 -3.07 0.00 0.00 36.82 37.20 3m1c h ILE 603 CO 0.10 0.59 0.27 -0.07 -0.69 0.00 0.00 178.15 178.36 3m1c h LEU 604 N 0.60 0.61 -0.40 1.44 3.38 -1.56 -1.92 115.31 117.45 3m1c h LEU 604 Ca -0.01 -0.08 0.07 0.00 0.09 0.00 0.00 57.88 57.94 3m1c h LEU 604 Cb 1.25 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.78 3m1c h LEU 604 CO 0.13 0.51 0.06 0.44 0.09 0.00 0.00 178.44 179.68 3m1c h ASP 605 N 0.65 -0.04 0.45 -0.43 3.32 -1.41 -1.35 116.42 117.61 3m1c h ASP 605 Ca 0.17 0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.26 3m1c h ASP 605 Cb 0.04 0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 3m1c h ASP 605 CO -0.03 0.01 -0.17 0.00 -1.72 0.00 0.00 179.24 177.33 3m1c h ALA 606 N 1.32 1.27 0.06 3.45 0.00 -0.98 -2.76 119.26 121.61 3m1c h ALA 606 Ca 0.19 -0.16 -0.31 0.00 0.00 0.00 0.00 54.91 54.64 3m1c h ALA 606 Cb 0.25 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 3m1c h ALA 606 CO -0.27 0.21 -1.73 -0.07 0.00 0.00 0.00 179.25 177.39 3m1c h LEU 607 N 0.00 0.19 -0.19 0.00 3.38 -0.86 -3.07 115.31 114.76 3m1c h LEU 607 Ca -0.00 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.60 3m1c h LEU 607 Cb 0.44 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3m1c h LEU 607 CO 0.02 1.32 0.00 0.00 0.09 0.00 0.00 178.44 179.88 3m1c h ALA 608 N 0.65 1.00 -0.62 1.53 0.00 -1.08 -2.62 119.26 118.13 3m1c h ALA 608 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3m1c h ALA 608 Cb 2.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.80 3m1c h ALA 608 CO 0.10 0.00 0.00 -0.12 0.00 0.00 0.00 179.25 179.23 3m1c n MET 609 N -2.79 2.80 -2.82 0.00 0.00 -1.06 -4.97 117.12 108.29 3m1c n MET 609 Ca 0.04 -2.49 -0.30 0.00 -0.00 0.00 0.00 57.70 54.95 3m1c n MET 609 Cb 0.46 -1.49 -0.03 0.00 0.00 0.00 0.00 33.22 32.16 3m1c n MET 609 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3m1c s ALA 610 N -1.03 3.36 0.16 -5.12 0.00 -0.99 -4.85 121.76 113.29 3m1c s ALA 610 Ca 0.41 -0.25 -0.27 0.00 0.00 0.00 0.00 51.96 51.85 3m1c s ALA 610 Cb 0.22 -2.68 -0.08 0.00 0.00 0.00 0.00 23.12 20.58 3m1c s ALA 610 CO 0.28 -0.06 0.83 0.95 0.00 0.00 0.00 175.76 177.76 3m1c s THR 611 N -2.43 4.35 0.33 0.00 -4.23 -1.26 -5.02 115.64 107.38 3m1c s THR 611 Ca 0.51 1.82 -0.29 0.00 -1.18 0.00 0.00 61.69 62.55 3m1c s THR 611 Cb -0.10 -4.20 -0.12 0.00 1.34 0.00 0.00 72.50 69.42 3m1c s THR 611 CO 0.33 0.48 1.41 0.54 -0.54 0.00 0.00 174.62 176.84 3m1c n ARG 612 N 1.83 2.35 -1.24 3.99 1.74 -1.26 -5.01 116.66 119.06 3m1c n ARG 612 Ca -0.04 0.83 0.00 0.00 -0.77 0.00 0.00 57.85 57.87 3m1c n ARG 612 Cb 0.48 -2.49 0.00 0.00 -1.02 0.00 0.00 32.46 29.43 3m1c n ARG 612 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3m1c n SER 613 N 1.13 0.95 -1.63 0.55 3.41 -1.26 -5.05 113.62 111.72 3m1c n SER 613 Ca 0.05 -0.62 -0.09 0.00 -0.26 0.00 0.00 58.87 57.95 3m1c n SER 613 Cb 0.36 0.00 0.22 0.00 -0.26 0.00 0.00 64.21 64.54 3m1c n SER 613 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3m1c n ASP 614 N -1.27 3.52 -4.62 4.04 8.00 -1.26 -4.94 116.55 120.02 3m1c n ASP 614 Ca 0.00 -3.52 -0.34 0.00 0.71 0.00 0.00 54.79 51.63 3m1c n ASP 614 Cb 0.00 -0.71 -0.10 0.00 -0.02 0.00 0.00 41.12 40.29 3m1c n ASP 614 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3m1c s ILE 615 N -3.16 4.52 0.28 0.53 -1.09 -1.26 -5.08 121.20 115.94 3m1c s ILE 615 Ca 0.50 -0.14 -0.27 0.00 -2.23 0.00 0.00 60.65 58.51 3m1c s ILE 615 Cb 0.43 -2.99 -0.15 0.00 -1.58 0.00 0.00 42.46 38.17 3m1c s ILE 615 CO 0.07 0.51 0.79 -2.65 -1.23 0.00 0.00 174.94 172.42 3m1c n PRO 616 N 3.18 0.81 -0.30 2.79 -0.02 -1.26 -4.67 135.00 135.53 3m1c n PRO 616 Ca -0.17 0.29 0.11 0.00 -2.02 0.00 0.00 63.50 61.70 3m1c n PRO 616 Cb 0.53 -1.53 0.28 0.00 -0.02 0.00 0.00 33.50 32.76 3m1c n PRO 616 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3m1c h ALA 617 N 1.50 1.38 0.00 3.55 0.00 -1.98 -1.00 119.26 122.71 3m1c h ALA 617 Ca -0.36 0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.63 3m1c h ALA 617 Cb 1.38 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.26 3m1c h ALA 617 CO 0.58 -0.26 -0.28 0.38 0.00 0.00 0.00 179.25 179.66 3m1c h ASP 618 N 0.47 0.00 0.00 0.00 -0.00 -2.00 -2.09 116.42 112.80 3m1c h ASP 618 Ca 0.53 0.00 -0.06 0.00 -0.00 0.00 0.00 57.03 57.50 3m1c h ASP 618 Cb 0.93 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.25 3m1c h ASP 618 CO -0.48 0.28 -0.35 0.58 -0.00 0.00 0.00 179.24 179.28 3m1c h VAL 619 N 0.00 1.45 -0.66 4.15 2.07 -1.62 -2.92 116.25 118.72 3m1c h VAL 619 Ca -0.00 -2.22 0.11 0.00 0.82 0.00 0.00 66.70 65.41 3m1c h VAL 619 Cb 0.70 2.87 -0.04 0.00 -1.52 0.00 0.00 31.29 33.30 3m1c h VAL 619 CO 0.04 0.49 0.44 -0.03 0.02 0.00 0.00 177.57 178.53 3m1c h MET 620 N -1.00 0.44 -0.69 1.57 4.05 -1.16 0.69 114.93 118.83 3m1c h MET 620 Ca -0.09 -0.03 -0.06 0.00 -0.28 0.00 0.00 59.70 59.24 3m1c h MET 620 Cb 1.03 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 31.70 3m1c h MET 620 CO -0.06 0.29 0.21 0.00 0.23 0.00 0.00 176.91 177.59 3m1c h ALA 621 N 1.67 0.91 -0.35 0.39 0.00 -1.49 -1.35 119.26 119.04 3m1c h ALA 621 Ca 0.31 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 3m1c h ALA 621 Cb 0.60 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 3m1c h ALA 621 CO -0.09 0.59 -0.43 0.37 0.00 0.00 0.00 179.25 179.69 3m1c h GLN 622 N 1.02 0.90 -0.60 0.00 4.15 0.35 -1.97 115.11 118.96 3m1c h GLN 622 Ca 0.22 -0.49 0.03 0.00 0.77 0.00 0.00 58.65 59.17 3m1c h GLN 622 Cb 0.31 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.99 3m1c h GLN 622 CO -0.01 1.14 0.37 1.96 -1.93 0.00 0.00 178.83 180.36 3m1c h GLN 623 N 0.72 0.71 0.19 1.69 4.20 -0.24 -2.36 115.11 120.02 3m1c h GLN 623 Ca 0.05 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3m1c h GLN 623 Cb 1.02 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 28.62 3m1c h GLN 623 CO 0.10 0.47 -0.19 1.15 -0.67 0.00 0.00 178.83 179.69 3m1c h THR 624 N 0.73 0.58 -0.87 -0.54 2.02 -1.05 -2.57 112.91 111.22 3m1c h THR 624 Ca 0.24 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.60 3m1c h THR 624 Cb 0.01 0.58 -0.06 0.00 -1.74 0.00 0.00 68.15 66.94 3m1c h THR 624 CO -0.10 0.00 0.57 0.03 0.37 0.00 0.00 175.52 176.40 3m1c h ARG 625 N -0.41 0.45 -0.28 6.66 3.08 -1.20 0.25 114.38 122.92 3m1c h ARG 625 Ca 0.00 -0.03 -0.13 0.00 0.07 0.00 0.00 59.98 59.90 3m1c h ARG 625 Cb 0.39 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 3m1c h ARG 625 CO -0.05 0.30 -0.35 0.78 -1.07 0.00 0.00 179.97 179.57 3m1c h GLY 626 N 0.46 0.69 1.38 0.04 0.00 -1.05 -0.91 103.07 103.67 3m1c h GLY 626 Ca 0.45 -0.65 -0.30 0.00 0.00 0.00 0.00 47.33 46.82 3m1c h GLY 626 CO -0.17 0.59 -1.30 -2.08 0.00 0.00 0.00 176.54 173.58 3m1c h VAL 627 N 0.53 1.35 -0.69 4.60 2.07 -0.77 -1.98 116.25 121.35 3m1c h VAL 627 Ca 0.05 -2.69 0.14 0.00 0.82 0.00 0.00 66.70 65.02 3m1c h VAL 627 Cb 0.86 2.84 -0.10 0.00 -1.52 0.00 0.00 31.29 33.37 3m1c h VAL 627 CO 0.07 0.80 0.20 0.00 0.02 0.00 0.00 177.57 178.67 3m1c h ALA 628 N 0.36 0.90 -0.13 1.67 0.00 -0.50 -2.03 119.26 119.53 3m1c h ALA 628 Ca -0.19 0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 3m1c h ALA 628 Cb 1.98 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.93 3m1c h ALA 628 CO 0.24 -0.29 -0.42 0.77 0.00 0.00 0.00 179.25 179.56 3m1c h SER 629 N 0.32 0.30 -0.41 0.00 0.02 -1.05 -2.59 113.55 110.15 3m1c h SER 629 Ca 0.38 -0.13 -0.02 0.00 -0.84 0.00 0.00 61.79 61.18 3m1c h SER 629 Cb 0.60 -0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.03 3m1c h SER 629 CO -0.44 0.69 0.16 0.58 -1.14 0.00 0.00 176.83 176.68 3m1c h VAL 630 N 0.24 1.20 -0.01 2.27 2.07 -0.80 -1.73 116.25 119.49 3m1c h VAL 630 Ca 0.02 -0.62 -0.09 0.00 0.82 0.00 0.00 66.70 66.83 3m1c h VAL 630 Cb 0.84 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 3m1c h VAL 630 CO 0.07 0.22 -0.44 -0.07 0.02 0.00 0.00 177.57 177.37 3m1c h LEU 631 N 0.51 0.02 0.15 2.57 3.38 -1.19 0.19 115.31 120.94 3m1c h LEU 631 Ca 0.13 -0.01 -0.29 0.00 0.09 0.00 0.00 57.88 57.81 3m1c h LEU 631 Cb 0.20 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 40.96 3m1c h LEU 631 CO -0.01 0.46 -1.30 0.71 0.09 0.00 0.00 178.44 178.39 3m1c h THR 632 N 0.02 1.45 -0.39 0.22 1.35 -1.37 -2.58 112.91 111.60 3m1c h THR 632 Ca -0.00 -2.96 -0.16 0.00 -0.55 0.00 0.00 66.41 62.74 3m1c h THR 632 Cb 0.78 2.96 -0.01 0.00 -1.73 0.00 0.00 68.15 70.16 3m1c h THR 632 CO 0.06 0.87 -0.37 0.03 -0.25 0.00 0.00 175.52 175.85 3m1c h ARG 633 N 0.10 0.95 -0.25 4.72 3.08 -1.17 -2.31 114.38 119.50 3m1c h ARG 633 Ca -0.16 -0.49 0.05 0.00 0.07 0.00 0.00 59.98 59.44 3m1c h ARG 633 Cb 2.01 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 32.03 3m1c h ARG 633 CO 0.22 1.15 -0.06 2.35 -1.07 0.00 0.00 179.97 182.57 3m1c h TRP 634 N 0.78 -0.13 0.00 3.04 2.91 -1.02 -2.74 115.95 118.79 3m1c h TRP 634 Ca 0.06 0.02 0.00 0.00 1.13 0.00 0.00 58.89 60.11 3m1c h TRP 634 Cb 0.97 0.09 0.00 0.00 -0.51 0.00 0.00 29.16 29.72 3m1c h TRP 634 CO 0.06 -0.10 0.00 0.00 -1.03 0.00 0.00 178.44 177.37 3m1c h ALA 635 N 1.25 1.00 -1.83 2.65 0.00 -1.30 -3.42 119.26 117.61 3m1c h ALA 635 Ca 0.12 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.38 3m1c h ALA 635 Cb 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 17.79 17.81 3m1c h ALA 635 CO -0.26 0.00 0.34 -1.58 0.00 0.00 0.00 179.25 177.75 3m1c s HIS 636 N -3.36 2.85 -0.23 0.00 5.65 -0.88 -4.74 115.29 114.58 3m1c s HIS 636 Ca 0.05 -0.56 -0.07 0.00 0.25 0.00 0.00 55.06 54.72 3m1c s HIS 636 Cb 0.09 -4.03 -0.03 0.00 -1.18 0.00 0.00 32.58 27.43 3m1c s HIS 636 CO 0.47 -1.39 0.06 0.71 -0.65 0.00 0.00 174.74 173.95 3m1c s TYR 637 N 3.41 3.11 0.17 3.88 2.02 -1.26 -4.96 117.35 123.72 3m1c s TYR 637 Ca 0.19 -0.30 -0.15 0.00 -0.37 0.00 0.00 57.07 56.45 3m1c s TYR 637 Cb -0.18 -2.18 0.13 0.00 -0.40 0.00 0.00 41.96 39.32 3m1c s TYR 637 CO 0.11 -0.22 1.72 -0.91 -1.57 0.00 0.00 175.55 174.68 3m1c h ASN 638 N 7.78 0.01 -0.72 2.29 2.35 -1.98 -2.41 115.58 122.90 3m1c h ASN 638 Ca -0.37 0.07 0.16 0.00 -0.55 0.00 0.00 56.30 55.61 3m1c h ASN 638 Cb 1.18 0.10 -0.04 0.00 0.05 0.00 0.00 38.32 39.60 3m1c h ASN 638 CO 0.61 0.04 0.49 0.00 -1.65 0.00 0.00 177.43 176.92 3m1c h ALA 639 N 1.32 2.28 0.02 -0.83 0.00 -1.94 0.12 119.26 120.23 3m1c h ALA 639 Ca 0.21 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 3m1c h ALA 639 Cb 0.25 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3m1c h ALA 639 CO -0.27 -0.49 -0.01 -0.07 0.00 0.00 0.00 179.25 178.42 3m1c h LEU 640 N 0.27 -0.02 -0.51 0.00 3.38 -1.82 -2.88 115.31 113.73 3m1c h LEU 640 Ca 0.35 -0.64 0.10 0.00 0.09 0.00 0.00 57.88 57.79 3m1c h LEU 640 Cb 0.99 0.01 -0.09 0.00 0.09 0.00 0.00 40.66 41.66 3m1c h LEU 640 CO -0.09 0.77 -0.09 0.40 0.09 0.00 0.00 178.44 179.53 3m1c h ILE 641 N -0.96 0.52 -1.03 1.22 2.04 -1.29 0.13 117.51 118.14 3m1c h ILE 641 Ca -0.00 -0.01 0.27 0.00 1.00 0.00 0.00 64.86 66.11 3m1c h ILE 641 Cb 0.66 0.48 -0.08 0.00 -0.74 0.00 0.00 36.82 37.14 3m1c h ILE 641 CO 0.00 0.01 0.68 -0.09 0.00 0.00 0.00 178.15 178.75 3m1c h ARG 642 N 0.03 0.30 0.00 2.37 2.43 -0.84 -2.33 114.38 116.34 3m1c h ARG 642 Ca 0.25 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 3m1c h ARG 642 Cb 0.39 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 3m1c h ARG 642 CO -0.50 0.20 -1.31 0.00 -1.51 0.00 0.00 179.97 176.85 3m1c n ALA 643 N -2.54 2.71 -0.18 2.80 0.00 0.28 -4.32 120.51 119.27 3m1c n ALA 643 Ca 0.24 -0.34 0.01 0.00 0.00 0.00 0.00 53.44 53.35 3m1c n ALA 643 Cb 0.91 -0.98 0.01 0.00 0.00 0.00 0.00 19.45 19.39 3m1c n ALA 643 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3m1c n PHE 644 N -2.46 0.00 -3.73 0.00 3.72 -0.29 -4.85 117.46 109.85 3m1c n PHE 644 Ca -0.01 -0.51 -0.38 0.00 -0.05 0.00 0.00 57.45 56.50 3m1c n PHE 644 Cb 0.54 -0.06 -0.12 0.00 -0.94 0.00 0.00 39.48 38.90 3m1c n PHE 644 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 3m1c s VAL 645 N -1.10 3.91 0.05 -4.37 1.01 -0.91 -4.67 120.40 114.33 3m1c s VAL 645 Ca 0.03 -1.07 -0.30 0.00 0.00 0.00 0.00 61.98 60.63 3m1c s VAL 645 Cb 0.03 -3.20 -0.08 0.00 0.00 0.00 0.00 36.38 33.12 3m1c s VAL 645 CO 0.00 -0.18 1.80 -2.84 0.00 0.00 0.00 175.10 173.88 3m1c s PRO 646 N 1.43 4.16 0.20 2.72 0.02 -1.26 -4.93 135.00 137.34 3m1c s PRO 646 Ca -0.01 2.46 0.06 0.00 0.02 0.00 0.00 61.00 63.52 3m1c s PRO 646 Cb -0.19 -3.86 -0.04 0.00 0.02 0.00 0.00 34.50 30.43 3m1c s PRO 646 CO 0.03 -0.85 0.18 -1.21 -0.33 0.00 0.00 177.00 174.82 3m1c s GLU 647 N 3.53 2.97 0.73 5.54 8.01 -1.26 -4.55 118.70 133.67 3m1c s GLU 647 Ca 0.80 -0.91 -0.12 0.00 0.01 0.00 0.00 54.97 54.75 3m1c s GLU 647 Cb -0.41 -2.65 0.03 0.00 -4.31 0.00 0.00 34.13 26.79 3m1c s GLU 647 CO 0.36 0.46 1.11 0.00 0.01 0.00 0.00 175.26 177.19 3m1c s ALA 648 N -1.89 2.81 -0.16 5.21 0.00 -1.26 -4.39 121.76 122.08 3m1c s ALA 648 Ca 0.32 -0.38 0.17 0.00 0.00 0.00 0.00 51.96 52.07 3m1c s ALA 648 Cb -0.09 -3.02 -0.02 0.00 0.00 0.00 0.00 23.12 19.99 3m1c s ALA 648 CO 0.24 -1.26 1.14 1.15 0.00 0.00 0.00 175.76 177.04 3m1c h THR 649 N -0.75 0.60 -2.39 0.00 2.02 -1.96 -3.46 112.91 106.98 3m1c h THR 649 Ca -0.45 -1.97 -0.54 0.00 0.77 0.00 0.00 66.41 64.21 3m1c h THR 649 Cb 1.27 2.16 -0.14 0.00 -1.74 0.00 0.00 68.15 69.70 3m1c h THR 649 CO 0.64 0.34 -0.69 -1.38 0.37 0.00 0.00 175.52 174.80 3m1c s HIS 650 N -2.99 2.11 0.27 3.16 -3.43 -1.26 -5.12 115.29 108.03 3m1c s HIS 650 Ca 0.01 -0.57 -0.30 0.00 -0.80 0.00 0.00 55.06 53.40 3m1c s HIS 650 Cb 0.08 -1.15 -0.10 0.00 -1.43 0.00 0.00 32.58 29.98 3m1c s HIS 650 CO 0.78 0.44 1.35 -1.14 -2.00 0.00 0.00 174.74 174.17 3m1c s GLN 651 N -3.65 4.34 -0.15 -0.38 0.74 -1.26 -4.99 119.66 114.30 3m1c s GLN 651 Ca 0.30 2.20 -0.18 0.00 0.05 0.00 0.00 55.36 57.72 3m1c s GLN 651 Cb 0.02 -3.12 -0.04 0.00 1.10 0.00 0.00 33.01 30.97 3m1c s GLN 651 CO 0.13 -0.28 0.49 0.00 -0.55 0.00 0.00 175.29 175.08 3m1c n SER 653 N 4.14 0.98 0.00 0.00 3.41 -1.26 -4.82 113.62 116.06 3m1c n SER 653 Ca -0.06 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 3m1c n SER 653 Cb 0.51 -1.49 0.00 0.00 -0.26 0.00 0.00 64.21 62.97 3m1c n SER 653 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3m1c n GLY 654 N 0.69 -0.88 3.68 5.00 0.00 -1.26 -4.88 105.19 107.54 3m1c n GLY 654 Ca 0.14 -1.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.07 3m1c n GLY 654 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3m1c s PRO 655 N -1.92 4.37 0.14 1.61 0.02 -1.26 -4.96 135.00 133.00 3m1c s PRO 655 Ca 0.00 1.25 -0.31 0.00 0.02 0.00 0.00 61.00 61.96 3m1c s PRO 655 Cb 0.00 -3.55 -0.10 0.00 0.02 0.00 0.00 34.50 30.87 3m1c s PRO 655 CO 0.00 -0.32 1.65 -1.54 -0.33 0.00 0.00 177.00 176.46 3m1c s SER 656 N 1.11 6.53 -0.91 2.53 1.04 -1.26 -4.87 113.70 117.87 3m1c s SER 656 Ca 0.44 2.65 -0.16 0.00 0.48 0.00 0.00 55.95 59.36 3m1c s SER 656 Cb -0.17 -2.58 0.17 0.00 0.10 0.00 0.00 66.02 63.54 3m1c s SER 656 CO 0.15 -0.89 1.00 -1.00 0.98 0.00 0.00 173.24 173.48 3m1c s HIS 657 N 1.74 3.44 -0.43 5.02 3.76 -1.26 -4.97 115.29 122.59 3m1c s HIS 657 Ca 0.73 -1.72 -0.22 0.00 -0.15 0.00 0.00 55.06 53.70 3m1c s HIS 657 Cb -0.44 -4.08 0.02 0.00 1.11 0.00 0.00 32.58 29.19 3m1c s HIS 657 CO 0.32 -1.26 0.70 1.21 -0.85 0.00 0.00 174.74 174.86 3m1c s ASN 658 N 2.91 6.37 -0.17 1.40 3.84 -1.26 -4.51 114.94 123.52 3m1c s ASN 658 Ca 0.27 -0.21 -0.06 0.00 0.21 0.00 0.00 52.86 53.08 3m1c s ASN 658 Cb -0.07 -2.34 -0.04 0.00 -0.55 0.00 0.00 41.25 38.25 3m1c s ASN 658 CO -0.09 -0.81 0.03 0.00 -2.79 0.00 0.00 177.10 173.44 3m1c s ALA 659 N 2.98 3.29 -0.06 1.71 0.00 -1.26 -5.07 121.76 123.36 3m1c s ALA 659 Ca 0.25 -0.76 -0.30 0.00 0.00 0.00 0.00 51.96 51.15 3m1c s ALA 659 Cb -0.13 -1.79 -0.03 0.00 0.00 0.00 0.00 23.12 21.16 3m1c s ALA 659 CO 0.20 0.22 1.23 -1.21 0.00 0.00 0.00 175.76 176.20 3m1c s GLU 660 N 0.27 4.33 0.13 0.00 2.02 -1.26 -4.93 118.70 119.26 3m1c s GLU 660 Ca 0.02 1.70 -0.33 0.00 0.02 0.00 0.00 54.97 56.37 3m1c s GLU 660 Cb -0.13 -3.58 -0.13 0.00 0.10 0.00 0.00 34.13 30.39 3m1c s GLU 660 CO 0.01 -0.49 1.66 -0.35 0.02 0.00 0.00 175.26 176.12 3m1c n PRO 661 N 5.37 2.29 -0.02 0.39 -0.04 -1.26 -4.90 135.00 136.83 3m1c n PRO 661 Ca 0.11 0.83 -0.16 0.00 -0.04 0.00 0.00 63.50 64.24 3m1c n PRO 661 Cb 0.46 -2.63 -0.13 0.00 -0.04 0.00 0.00 33.50 31.16 3m1c n PRO 661 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3m1c h ARG 662 N 6.75 0.15 -5.20 0.54 2.47 -0.82 -3.45 114.38 114.82 3m1c h ARG 662 Ca -0.45 -0.22 -0.52 0.00 -1.26 0.00 0.00 59.98 57.53 3m1c h ARG 662 Cb 1.25 0.07 -0.31 0.00 -1.65 0.00 0.00 29.97 29.34 3m1c h ARG 662 CO 0.91 1.05 -0.82 0.42 0.56 0.00 0.00 179.97 182.08 3m1c s ILE 663 N -2.59 1.23 -0.19 2.04 1.01 -1.07 -0.42 121.20 121.21 3m1c s ILE 663 Ca -0.16 -0.62 0.01 0.00 0.00 0.00 0.00 60.65 59.87 3m1c s ILE 663 Cb -0.01 -1.05 0.02 0.00 0.01 0.00 0.00 42.46 41.43 3m1c s ILE 663 CO 0.75 0.36 -0.18 -0.22 0.00 0.00 0.00 174.94 175.65 3m1c s LEU 664 N -0.05 2.26 -0.42 2.97 2.96 -0.75 -0.49 118.68 125.15 3m1c s LEU 664 Ca -0.01 -0.64 0.01 0.00 -0.22 0.00 0.00 54.13 53.27 3m1c s LEU 664 Cb -0.09 -1.51 0.11 0.00 0.50 0.00 0.00 46.19 45.20 3m1c s LEU 664 CO 0.01 -0.01 0.18 -0.69 -1.32 0.00 0.00 176.35 174.52 3m1c s VAL 665 N 1.31 2.83 -1.30 1.68 1.01 -0.13 -4.71 120.40 121.08 3m1c s VAL 665 Ca 0.05 -2.46 -0.17 0.00 0.00 0.00 0.00 61.98 59.40 3m1c s VAL 665 Cb -0.13 -2.98 0.01 0.00 0.00 0.00 0.00 36.38 33.28 3m1c s VAL 665 CO -0.12 -0.69 2.03 -0.81 0.00 0.00 0.00 175.10 175.51 3m1c n PRO 666 N 4.12 2.67 0.22 2.72 -0.05 -1.26 -0.98 135.00 142.44 3m1c n PRO 666 Ca 0.02 -2.68 0.08 0.00 -0.05 0.00 0.00 63.50 60.88 3m1c n PRO 666 Cb 0.40 -3.33 0.49 0.00 -0.05 0.00 0.00 33.50 31.01 3m1c n PRO 666 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 175.50 176.42 3m1c h ILE 667 N 4.67 0.77 -4.24 0.52 2.10 -1.88 -3.43 117.51 116.03 3m1c h ILE 667 Ca 0.49 -1.07 -0.13 0.00 1.08 0.00 0.00 64.86 65.23 3m1c h ILE 667 Cb 0.73 1.66 -0.15 0.00 -1.09 0.00 0.00 36.82 37.97 3m1c h ILE 667 CO 1.73 0.25 -0.66 0.42 -1.08 0.00 0.00 178.15 178.82 3m1c s THR 668 N -3.91 0.20 0.31 2.19 -4.23 -1.01 -4.89 115.64 104.29 3m1c s THR 668 Ca -0.01 -1.78 -0.01 0.00 -1.18 0.00 0.00 61.69 58.71 3m1c s THR 668 Cb 0.12 -1.58 0.23 0.00 1.34 0.00 0.00 72.50 72.61 3m1c s THR 668 CO 0.65 -0.91 1.94 1.12 -0.54 0.00 0.00 174.62 176.88 3m1c h HIS 669 N 3.09 0.93 -0.50 3.99 2.07 -1.99 -2.82 115.15 119.92 3m1c h HIS 669 Ca -0.34 -0.01 -0.13 0.00 -2.85 0.00 0.00 60.37 57.04 3m1c h HIS 669 Cb 1.15 -0.30 -0.01 0.00 2.57 0.00 0.00 27.41 30.81 3m1c h HIS 669 CO 0.51 0.64 -0.18 -0.91 -3.07 0.00 0.00 177.93 174.92 3m1c h ASN 670 N 0.97 1.02 -3.98 3.10 2.35 -1.96 -3.48 115.58 113.59 3m1c h ASN 670 Ca 0.25 -0.37 -0.33 0.00 -0.55 0.00 0.00 56.30 55.30 3m1c h ASN 670 Cb 0.00 -0.28 -0.15 0.00 0.05 0.00 0.00 38.32 37.95 3m1c h ASN 670 CO -0.04 1.16 -0.71 0.00 -1.65 0.00 0.00 177.43 176.20 3m1c s ALA 671 N -4.73 1.48 0.01 -0.83 0.00 -1.06 -4.60 121.76 112.04 3m1c s ALA 671 Ca -0.11 -1.52 -0.02 0.00 0.00 0.00 0.00 51.96 50.31 3m1c s ALA 671 Cb 0.13 0.11 -0.01 0.00 0.00 0.00 0.00 23.12 23.34 3m1c s ALA 671 CO 0.87 -0.12 0.02 -1.12 0.00 0.00 0.00 175.76 175.40 3m1c s SER 672 N -3.18 0.15 0.07 0.00 0.01 -0.81 -2.41 113.70 107.53 3m1c s SER 672 Ca 0.18 -0.36 -0.09 0.00 1.31 0.00 0.00 55.95 56.99 3m1c s SER 672 Cb 0.03 0.12 -0.06 0.00 0.21 0.00 0.00 66.02 66.32 3m1c s SER 672 CO 0.01 -0.28 0.37 -0.31 0.41 0.00 0.00 173.24 173.45 3m1c s TYR 673 N -1.24 3.58 -0.02 2.43 2.02 -0.15 0.20 117.35 124.17 3m1c s TYR 673 Ca -0.14 0.74 0.03 0.00 -0.37 0.00 0.00 57.07 57.34 3m1c s TYR 673 Cb -0.08 -2.12 -0.00 0.00 -0.40 0.00 0.00 41.96 39.35 3m1c s TYR 673 CO -0.00 0.54 -0.10 0.08 -1.57 0.00 0.00 175.55 174.50 3m1c s VAL 674 N -1.38 0.80 -0.22 0.71 1.01 0.61 -0.95 120.40 120.98 3m1c s VAL 674 Ca 0.32 -0.41 -0.05 0.00 0.00 0.00 0.00 61.98 61.84 3m1c s VAL 674 Cb -0.14 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.53 3m1c s VAL 674 CO 0.18 0.24 0.00 -0.69 0.00 0.00 0.00 175.10 174.83 3m1c s VAL 675 N -0.06 3.84 0.30 2.92 1.01 0.36 -0.72 120.40 128.04 3m1c s VAL 675 Ca 0.01 -0.34 0.05 0.00 0.00 0.00 0.00 61.98 61.70 3m1c s VAL 675 Cb -0.06 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.53 3m1c s VAL 675 CO -0.00 0.40 0.22 0.42 0.00 0.00 0.00 175.10 176.14 3m1c s THR 676 N 1.33 0.05 -2.01 3.92 -4.23 -0.69 -0.07 115.64 113.95 3m1c s THR 676 Ca 0.04 -2.00 0.20 0.00 -1.18 0.00 0.00 61.69 58.76 3m1c s THR 676 Cb -0.15 -2.50 0.58 0.00 1.34 0.00 0.00 72.50 71.78 3m1c s THR 676 CO 0.01 0.00 1.48 1.41 -0.54 0.00 0.00 174.62 176.98 3m1c n HIS 677 N -0.53 0.87 -3.72 3.99 8.25 -1.26 -1.06 115.22 121.76 3m1c n HIS 677 Ca 0.05 -0.44 -0.14 0.00 -0.26 0.00 0.00 57.72 56.94 3m1c n HIS 677 Cb 0.64 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.65 3m1c n HIS 677 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3m1c s THR 678 N -1.13 0.01 0.46 1.59 2.01 -1.26 -4.77 115.64 112.56 3m1c s THR 678 Ca 0.44 -0.10 -0.23 0.00 0.31 0.00 0.00 61.69 62.12 3m1c s THR 678 Cb 0.23 -0.63 -0.09 0.00 0.01 0.00 0.00 72.50 72.01 3m1c s THR 678 CO 0.30 -0.05 0.98 -0.81 -0.69 0.00 0.00 174.62 174.35 3m1c n PRO 679 N 2.41 1.24 -2.94 4.92 -0.04 -1.26 -4.89 135.00 134.44 3m1c n PRO 679 Ca -0.15 0.45 -0.20 0.00 -0.04 0.00 0.00 63.50 63.55 3m1c n PRO 679 Cb 0.57 -2.05 0.02 0.00 -0.04 0.00 0.00 33.50 32.00 3m1c n PRO 679 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3m1c s LEU 680 N -0.71 3.57 0.16 1.53 1.43 -1.26 -4.95 118.68 118.45 3m1c s LEU 680 Ca 0.65 -0.04 0.24 0.00 -1.03 0.00 0.00 54.13 53.96 3m1c s LEU 680 Cb -0.53 -2.89 0.43 0.00 0.03 0.00 0.00 46.19 43.24 3m1c s LEU 680 CO 0.55 -0.83 1.43 1.55 0.23 0.00 0.00 176.35 179.28 3m1c h PRO 681 N 0.41 0.00 -5.20 1.29 0.14 -1.96 -3.46 132.00 123.21 3m1c h PRO 681 Ca -0.43 0.00 -0.41 0.00 0.14 0.00 0.00 66.00 65.30 3m1c h PRO 681 Cb 1.27 0.00 -0.14 0.00 0.14 0.00 0.00 31.00 32.27 3m1c h PRO 681 CO 0.52 0.00 -0.67 -0.98 0.14 0.00 0.00 178.00 177.02 3m1c s ARG 682 N -3.17 1.38 0.00 0.86 1.70 -1.26 -4.26 118.95 114.19 3m1c s ARG 682 Ca 0.07 -1.69 0.00 0.00 -0.47 0.00 0.00 55.73 53.64 3m1c s ARG 682 Cb 0.12 -0.77 0.00 0.00 -0.57 0.00 0.00 34.95 33.74 3m1c s ARG 682 CO 0.69 -0.05 0.00 0.41 -1.08 0.00 0.00 175.30 175.28 3m1c n GLY 683 N -0.45 -0.08 3.65 3.88 0.00 0.37 -4.81 105.19 107.74 3m1c n GLY 683 Ca -0.06 -1.62 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 3m1c n GLY 683 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3m1c s ILE 684 N -2.97 3.35 -0.13 -0.61 -1.09 -0.75 -2.80 121.20 116.20 3m1c s ILE 684 Ca 0.00 0.41 0.01 0.00 -2.23 0.00 0.00 60.65 58.84 3m1c s ILE 684 Cb 0.00 -3.31 -0.01 0.00 -1.58 0.00 0.00 42.46 37.56 3m1c s ILE 684 CO 0.00 -0.09 -0.17 -0.83 -1.23 0.00 0.00 174.94 172.63 3m1c s GLY 685 N 4.56 1.46 -0.04 6.18 0.00 0.12 0.99 107.32 120.60 3m1c s GLY 685 Ca 0.81 -0.98 0.04 0.00 0.00 0.00 0.00 44.72 44.60 3m1c s GLY 685 CO 0.34 -0.13 -0.14 -0.19 0.00 0.00 0.00 173.10 172.98 3m1c s TYR 686 N 0.55 2.70 -0.26 1.90 2.02 0.54 -1.71 117.35 123.10 3m1c s TYR 686 Ca -0.10 -0.16 -0.03 0.00 -0.37 0.00 0.00 57.07 56.41 3m1c s TYR 686 Cb -0.16 -1.61 0.02 0.00 -0.40 0.00 0.00 41.96 39.81 3m1c s TYR 686 CO 0.04 0.21 -0.03 0.21 -1.57 0.00 0.00 175.55 174.41 3m1c s LYS 687 N -0.85 2.92 0.32 -0.62 2.20 -1.26 -1.04 119.74 121.41 3m1c s LYS 687 Ca 0.12 -0.93 -0.29 0.00 -0.36 0.00 0.00 55.97 54.51 3m1c s LYS 687 Cb -0.11 -3.08 -0.11 0.00 -1.51 0.00 0.00 37.83 33.03 3m1c s LYS 687 CO 0.01 -0.40 1.45 -0.51 -0.36 0.00 0.00 175.35 175.54 3m1c s LEU 688 N 1.37 4.37 -0.02 5.43 1.43 -0.84 -4.88 118.68 125.54 3m1c s LEU 688 Ca 0.01 2.85 -0.01 0.00 -1.03 0.00 0.00 54.13 55.96 3m1c s LEU 688 Cb -0.17 -3.65 -0.04 0.00 0.03 0.00 0.00 46.19 42.37 3m1c s LEU 688 CO -0.03 -0.75 0.05 0.42 0.23 0.00 0.00 176.35 176.28 3m1c s THR 689 N -0.67 4.58 0.00 5.49 -4.23 -1.26 -4.41 115.64 115.13 3m1c s THR 689 Ca 0.55 -0.40 0.00 0.00 -1.18 0.00 0.00 61.69 60.66 3m1c s THR 689 Cb -0.44 -3.05 0.00 0.00 1.34 0.00 0.00 72.50 70.35 3m1c s THR 689 CO 0.53 0.40 0.00 0.61 -0.54 0.00 0.00 174.62 175.63 3m1c n GLY 690 N 1.40 0.79 3.15 3.99 0.00 -1.26 -5.02 105.19 108.24 3m1c n GLY 690 Ca -0.14 -0.66 -0.29 0.00 0.00 0.00 0.00 46.02 44.93 3m1c n GLY 690 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3m1c s VAL 691 N -2.42 1.67 -0.43 1.61 1.01 -1.26 -4.25 120.40 116.32 3m1c s VAL 691 Ca 0.00 -0.80 -0.40 0.00 0.00 0.00 0.00 61.98 60.78 3m1c s VAL 691 Cb 0.00 -1.46 -0.17 0.00 0.00 0.00 0.00 36.38 34.75 3m1c s VAL 691 CO 0.00 0.47 1.52 -0.67 0.00 0.00 0.00 175.10 176.42 3m1c n ASP 692 N 3.53 0.92 0.10 3.32 2.03 -0.22 -4.80 116.55 121.42 3m1c n ASP 692 Ca -0.20 0.89 0.20 0.00 0.52 0.00 0.00 54.79 56.20 3m1c n ASP 692 Cb 0.52 -0.76 0.75 0.00 -0.72 0.00 0.00 41.12 40.92 3m1c n ASP 692 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 3m1c h VAL 693 N 4.84 0.45 0.00 5.18 3.04 -1.97 -0.18 116.25 127.60 3m1c h VAL 693 Ca -0.29 0.00 -0.08 0.00 -1.01 0.00 0.00 66.70 65.32 3m1c h VAL 693 Cb 1.19 0.70 -0.01 0.00 -2.01 0.00 0.00 31.29 31.16 3m1c h VAL 693 CO 0.87 0.00 -0.40 0.03 -1.01 0.00 0.00 177.57 177.07 3m1c h ARG 694 N 0.00 0.00 -2.07 4.17 3.08 -2.00 -3.36 114.38 114.20 3m1c h ARG 694 Ca 0.19 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 59.69 3m1c h ARG 694 Cb 0.96 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.61 3m1c h ARG 694 CO -0.00 0.40 -1.00 0.54 -1.07 0.00 0.00 179.97 178.83 3m1c n ARG 695 N -3.37 1.40 -1.72 0.04 1.74 -0.08 -5.13 116.66 109.54 3m1c n ARG 695 Ca 0.01 -3.70 -0.32 0.00 -0.77 0.00 0.00 57.85 53.06 3m1c n ARG 695 Cb 0.59 -1.67 0.05 0.00 -1.02 0.00 0.00 32.46 30.41 3m1c n ARG 695 CO 0.00 0.00 0.00 -2.14 -1.52 0.00 0.00 177.63 173.97 3m1c s PRO 696 N -2.09 2.85 -0.07 5.56 0.02 -1.21 -4.65 135.00 135.40 3m1c s PRO 696 Ca 0.39 1.26 0.05 0.00 0.02 0.00 0.00 61.00 62.72 3m1c s PRO 696 Cb 0.24 -1.97 -0.01 0.00 0.02 0.00 0.00 34.50 32.78 3m1c s PRO 696 CO -0.09 -1.20 -0.22 -0.51 -0.33 0.00 0.00 177.00 174.66 3m1c s LEU 697 N -5.03 2.25 0.00 -5.54 1.43 -1.26 -4.45 118.68 106.08 3m1c s LEU 697 Ca 0.64 -0.44 0.05 0.00 -1.03 0.00 0.00 54.13 53.35 3m1c s LEU 697 Cb -0.18 -1.43 -0.02 0.00 0.03 0.00 0.00 46.19 44.59 3m1c s LEU 697 CO 0.44 0.25 -0.17 -0.36 0.23 0.00 0.00 176.35 176.74 3m1c s PHE 698 N -0.18 1.52 -0.17 0.29 0.08 -0.23 -1.99 117.98 117.31 3m1c s PHE 698 Ca -0.02 -0.31 0.01 0.00 0.12 0.00 0.00 56.93 56.73 3m1c s PHE 698 Cb -0.14 -0.96 0.02 0.00 -0.57 0.00 0.00 43.02 41.37 3m1c s PHE 698 CO 0.04 -0.00 -0.20 0.42 -0.10 0.00 0.00 175.22 175.37 3m1c s ILE 699 N -0.51 2.09 -0.03 0.64 1.01 -0.20 -1.70 121.20 122.50 3m1c s ILE 699 Ca 0.06 -0.94 0.07 0.00 0.00 0.00 0.00 60.65 59.84 3m1c s ILE 699 Cb -0.07 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.51 3m1c s ILE 699 CO -0.00 0.54 -0.24 -0.89 0.00 0.00 0.00 174.94 174.35 3m1c s THR 700 N 1.19 2.18 -0.44 2.92 2.01 0.10 -0.34 115.64 123.26 3m1c s THR 700 Ca 0.02 -1.05 -0.12 0.00 0.31 0.00 0.00 61.69 60.85 3m1c s THR 700 Cb -0.14 -1.77 0.08 0.00 0.01 0.00 0.00 72.50 70.68 3m1c s THR 700 CO -0.10 0.58 0.32 -0.47 -0.69 0.00 0.00 174.62 174.26 3m1c s TYR 701 N -0.57 3.30 -0.07 4.92 5.04 0.28 -0.28 117.35 129.97 3m1c s TYR 701 Ca 0.08 -1.28 -0.11 0.00 -2.44 0.00 0.00 57.07 53.33 3m1c s TYR 701 Cb -0.11 -3.07 -0.05 0.00 0.35 0.00 0.00 41.96 39.09 3m1c s TYR 701 CO -0.00 -0.83 0.26 -0.51 -1.34 0.00 0.00 175.55 173.13 3m1c s LEU 702 N 1.52 4.42 0.22 6.97 1.43 0.13 -1.81 118.68 131.56 3m1c s LEU 702 Ca 0.03 0.69 -0.08 0.00 -1.03 0.00 0.00 54.13 53.75 3m1c s LEU 702 Cb -0.24 -2.31 -0.02 0.00 0.03 0.00 0.00 46.19 43.65 3m1c s LEU 702 CO 0.04 0.36 0.32 0.42 0.23 0.00 0.00 176.35 177.72 3m1c s THR 703 N -1.00 0.00 -1.12 5.49 -4.23 -1.26 -1.93 115.64 111.60 3m1c s THR 703 Ca 0.19 -1.65 -0.23 0.00 -1.18 0.00 0.00 61.69 58.82 3m1c s THR 703 Cb -0.14 -2.31 -0.05 0.00 1.34 0.00 0.00 72.50 71.34 3m1c s THR 703 CO 0.08 -0.02 1.89 0.00 -0.54 0.00 0.00 174.62 176.04 3m1c s ALA 704 N -4.07 1.97 0.06 3.99 0.00 -1.26 -4.69 121.76 117.75 3m1c s ALA 704 Ca 0.29 -2.08 -0.26 0.00 0.00 0.00 0.00 51.96 49.91 3m1c s ALA 704 Cb 0.03 -4.64 0.08 0.00 0.00 0.00 0.00 23.12 18.59 3m1c s ALA 704 CO 0.10 -4.85 0.70 -0.08 0.00 0.00 0.00 175.76 171.63 3m1c s THR 705 N 9.78 0.00 -1.79 0.00 -1.32 -1.26 -4.74 115.64 116.30 3m1c s THR 705 Ca 0.66 0.00 0.23 0.00 -1.21 0.00 0.00 61.69 61.37 3m1c s THR 705 Cb -0.02 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.95 3m1c s THR 705 CO 0.08 0.00 1.11 0.00 -2.21 0.00 0.00 174.62 173.60 3m1c s GLU 707 N -2.59 4.07 0.03 0.00 2.02 -1.26 -4.58 118.70 116.39 3m1c s GLU 707 Ca 0.17 1.27 0.01 0.00 0.02 0.00 0.00 54.97 56.44 3m1c s GLU 707 Cb 0.18 -2.22 -0.02 0.00 0.10 0.00 0.00 34.13 32.17 3m1c s GLU 707 CO 0.62 -0.19 -0.05 0.20 0.02 0.00 0.00 175.26 175.87 3m1c s GLY 708 N -2.01 0.35 -0.03 -1.39 0.00 -1.26 0.14 107.32 103.12 3m1c s GLY 708 Ca 0.63 -0.57 -0.02 0.00 0.00 0.00 0.00 44.72 44.76 3m1c s GLY 708 CO 0.18 -0.61 0.08 0.30 0.00 0.00 0.00 173.10 173.05 3m1c s HIS 709 N -1.10 -0.08 0.40 1.90 3.76 -1.12 -4.89 115.29 114.16 3m1c s HIS 709 Ca -0.09 0.25 -0.21 0.00 -0.15 0.00 0.00 55.06 54.86 3m1c s HIS 709 Cb -0.08 -0.05 -0.11 0.00 1.11 0.00 0.00 32.58 33.45 3m1c s HIS 709 CO -0.00 -0.08 0.92 0.00 -0.85 0.00 0.00 174.74 174.73 3m1c s ALA 710 N 0.53 3.10 -0.02 -1.40 0.00 -1.26 0.12 121.76 122.83 3m1c s ALA 710 Ca -0.04 0.38 -0.09 0.00 0.00 0.00 0.00 51.96 52.20 3m1c s ALA 710 Cb -0.06 -3.11 0.01 0.00 0.00 0.00 0.00 23.12 19.96 3m1c s ALA 710 CO -0.02 0.16 0.20 1.03 0.00 0.00 0.00 175.76 177.13 3m1c s ARG 711 N -2.98 0.48 0.33 0.00 1.81 -0.69 -4.87 118.95 113.03 3m1c s ARG 711 Ca 0.59 -0.19 -0.17 0.00 -1.72 0.00 0.00 55.73 54.25 3m1c s ARG 711 Cb -0.11 0.21 -0.09 0.00 -0.45 0.00 0.00 34.95 34.51 3m1c s ARG 711 CO 0.15 -0.11 0.78 -1.21 -0.68 0.00 0.00 175.30 174.23 3m1c s GLU 712 N -1.03 4.07 -0.53 3.54 2.02 -1.26 -4.34 118.70 121.17 3m1c s GLU 712 Ca -0.11 0.78 -0.21 0.00 0.02 0.00 0.00 54.97 55.45 3m1c s GLU 712 Cb -0.06 -2.42 0.05 0.00 0.10 0.00 0.00 34.13 31.80 3m1c s GLU 712 CO 0.02 0.14 0.76 0.42 0.02 0.00 0.00 175.26 176.62 3m1c s ILE 713 N -1.98 4.67 0.29 -1.63 1.01 -1.26 -4.97 121.20 117.32 3m1c s ILE 713 Ca 0.55 -0.22 -0.28 0.00 0.00 0.00 0.00 60.65 60.70 3m1c s ILE 713 Cb -0.11 -4.41 -0.09 0.00 0.01 0.00 0.00 42.46 37.86 3m1c s ILE 713 CO 0.17 -0.96 1.00 -1.61 0.00 0.00 0.00 174.94 173.54 3m1c s GLU 714 N 3.18 4.66 0.35 2.79 8.01 -1.26 -4.71 118.70 131.72 3m1c s GLU 714 Ca 0.21 1.55 -0.24 0.00 0.01 0.00 0.00 54.97 56.50 3m1c s GLU 714 Cb -0.17 -3.07 -0.10 0.00 -4.31 0.00 0.00 34.13 26.48 3m1c s GLU 714 CO 0.14 0.31 0.93 -2.14 0.01 0.00 0.00 175.26 174.51 3m1c s PRO 715 N -1.59 4.45 0.02 0.39 0.02 -1.26 -1.37 135.00 135.66 3m1c s PRO 715 Ca 0.46 1.22 -0.13 0.00 0.02 0.00 0.00 61.00 62.57 3m1c s PRO 715 Cb -0.26 -2.62 0.02 0.00 0.02 0.00 0.00 34.50 31.66 3m1c s PRO 715 CO 0.32 0.20 0.28 0.15 -0.33 0.00 0.00 177.00 177.62 3m1c s LYS 716 N -2.39 0.73 0.22 5.54 -0.14 -0.51 -4.83 119.74 118.35 3m1c s LYS 716 Ca 0.53 -0.42 0.09 0.00 -1.36 0.00 0.00 55.97 54.82 3m1c s LYS 716 Cb -0.16 0.32 -0.05 0.00 -1.68 0.00 0.00 37.83 36.26 3m1c s LYS 716 CO 0.20 -0.22 -0.17 1.03 -0.76 0.00 0.00 175.35 175.44 3m1c s ARG 717 N -2.10 1.41 0.58 1.68 0.52 -1.26 -3.24 118.95 116.54 3m1c s ARG 717 Ca -0.08 -1.60 0.08 0.00 -0.52 0.00 0.00 55.73 53.61 3m1c s ARG 717 Cb -0.03 -1.36 0.08 0.00 0.52 0.00 0.00 34.95 34.17 3m1c s ARG 717 CO -0.01 0.25 0.65 -0.51 0.02 0.00 0.00 175.30 175.70 3m1c s LEU 718 N -3.21 2.85 0.31 2.53 2.01 -1.26 -5.14 118.68 116.77 3m1c s LEU 718 Ca 0.23 -1.08 0.00 0.00 0.01 0.00 0.00 54.13 53.29 3m1c s LEU 718 Cb -0.03 -1.32 0.00 0.00 0.01 0.00 0.00 46.19 44.85 3m1c s LEU 718 CO 0.09 -1.32 0.00 1.33 1.01 0.00 0.00 176.35 177.46 3m1c n VAL 719 N -2.09 -9.27 0.35 -1.59 0.24 -1.26 -5.07 118.33 99.63 3m1c n VAL 719 Ca 0.09 3.02 0.11 0.00 -2.04 0.00 0.00 64.34 65.52 3m1c n VAL 719 Cb 0.63 -4.36 -0.03 0.00 -1.47 0.00 0.00 33.84 28.61 3m1c n VAL 719 CO 0.00 0.00 0.00 -1.14 -2.14 0.00 0.00 176.83 173.55 3m1c n ARG 725 N 1.20 0.44 -3.08 7.34 0.63 -1.26 -5.20 116.66 116.72 3m1c n ARG 725 Ca 0.00 -0.02 -0.43 0.00 -0.92 0.00 0.00 57.85 56.48 3m1c n ARG 725 Cb 0.00 -1.63 -0.06 0.00 0.45 0.00 0.00 32.46 31.22 3m1c n ARG 725 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 3m1c s ASP 726 N -4.36 6.35 0.00 6.15 2.15 -1.26 -4.94 116.67 120.76 3m1c s ASP 726 Ca 0.00 -0.27 0.26 0.00 0.43 0.00 0.00 52.55 52.97 3m1c s ASP 726 Cb 0.13 -2.33 0.66 0.00 -0.30 0.00 0.00 42.92 41.07 3m1c s ASP 726 CO 0.83 -0.80 1.51 0.18 -0.17 0.00 0.00 175.17 176.71 3m1c n LEU 727 N 6.35 0.85 0.00 -1.34 4.32 -1.26 -4.95 117.00 120.97 3m1c n LEU 727 Ca -0.01 -0.18 0.00 0.00 -0.02 0.00 0.00 56.01 55.81 3m1c n LEU 727 Cb 0.48 -0.16 0.00 0.00 -1.62 0.00 0.00 43.42 42.11 3m1c n LEU 727 CO 0.55 0.17 0.00 0.61 -1.22 0.00 0.00 177.39 177.50 3m1c n GLY 728 N 1.40 0.49 0.07 -0.72 0.00 -1.26 -4.96 105.19 100.22 3m1c n GLY 728 Ca 0.10 -0.84 -0.07 0.00 0.00 0.00 0.00 46.02 45.20 3m1c n GLY 728 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3m1c h LEU 729 N 0.00 0.00 -9.41 0.99 3.38 -1.96 -3.46 115.31 104.85 3m1c h LEU 729 Ca 0.00 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.35 3m1c h LEU 729 Cb 0.78 0.00 0.10 0.00 0.09 0.00 0.00 40.66 41.63 3m1c h LEU 729 CO 0.00 0.97 0.16 0.52 0.09 0.00 0.00 178.44 180.18 3m1c n VAL 730 N -3.16 1.61 0.00 1.22 0.31 -1.26 -0.81 118.33 116.23 3m1c n VAL 730 Ca -0.09 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.83 3m1c n VAL 730 Cb 0.99 -0.92 0.00 0.00 -0.91 0.00 0.00 33.84 33.00 3m1c n VAL 730 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3m1c n GLY 731 N 1.55 2.90 3.86 2.92 0.00 -0.16 -4.95 105.19 111.31 3m1c n GLY 731 Ca 0.12 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 3m1c n GLY 731 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3m1c s ALA 732 N -1.97 2.34 -0.07 4.61 0.00 0.01 -4.49 121.76 122.19 3m1c s ALA 732 Ca 0.00 -0.61 0.01 0.00 0.00 0.00 0.00 51.96 51.36 3m1c s ALA 732 Cb 0.00 -2.98 0.02 0.00 0.00 0.00 0.00 23.12 20.16 3m1c s ALA 732 CO 0.00 -1.90 -0.06 0.08 0.00 0.00 0.00 175.76 173.88 3m1c s VAL 733 N -3.47 0.76 -0.21 0.00 1.01 -0.02 -0.35 120.40 118.12 3m1c s VAL 733 Ca 0.63 -0.21 -0.19 0.00 0.00 0.00 0.00 61.98 62.21 3m1c s VAL 733 Cb -0.12 -0.78 -0.03 0.00 0.00 0.00 0.00 36.38 35.45 3m1c s VAL 733 CO 0.51 0.29 0.55 0.12 0.00 0.00 0.00 175.10 176.57 3m1c s PHE 734 N 1.17 3.36 -0.15 5.22 5.36 0.13 0.66 117.98 133.73 3m1c s PHE 734 Ca -0.06 0.80 0.01 0.00 -0.96 0.00 0.00 56.93 56.72 3m1c s PHE 734 Cb -0.14 -2.72 0.02 0.00 -0.34 0.00 0.00 43.02 39.84 3m1c s PHE 734 CO -0.02 -0.15 -0.16 -1.17 -1.46 0.00 0.00 175.22 172.27 3m1c s LEU 735 N 1.81 1.82 -0.17 6.12 1.98 -0.70 0.15 118.68 129.69 3m1c s LEU 735 Ca 0.25 -0.53 -0.05 0.00 -2.89 0.00 0.00 54.13 50.91 3m1c s LEU 735 Cb -0.16 -1.27 -0.03 0.00 0.66 0.00 0.00 46.19 45.40 3m1c s LEU 735 CO 0.10 -0.03 -0.01 -0.60 -1.89 0.00 0.00 176.35 173.91 3m1c s ARG 736 N 1.39 3.70 0.05 1.98 3.52 -0.44 -0.32 118.95 128.82 3m1c s ARG 736 Ca 0.04 -0.50 0.01 0.00 -0.13 0.00 0.00 55.73 55.16 3m1c s ARG 736 Cb -0.13 -3.00 -0.03 0.00 -1.56 0.00 0.00 34.95 30.23 3m1c s ARG 736 CO -0.11 0.18 -0.06 1.52 -0.81 0.00 0.00 175.30 176.02 3m1c s TYR 737 N 0.55 0.59 0.35 5.12 -0.85 -0.51 0.54 117.35 123.14 3m1c s TYR 737 Ca -0.02 -0.64 0.04 0.00 -0.52 0.00 0.00 57.07 55.93 3m1c s TYR 737 Cb -0.14 -0.37 -0.02 0.00 0.38 0.00 0.00 41.96 41.82 3m1c s TYR 737 CO 0.02 -0.15 0.51 0.95 -1.52 0.00 0.00 175.55 175.36 3m1c s THR 738 N -2.07 4.46 0.40 -3.49 -4.23 0.39 0.44 115.64 111.54 3m1c s THR 738 Ca -0.06 -0.78 0.09 0.00 -1.18 0.00 0.00 61.69 59.76 3m1c s THR 738 Cb -0.05 -3.59 0.21 0.00 1.34 0.00 0.00 72.50 70.40 3m1c s THR 738 CO -0.02 -0.30 1.98 -0.65 -0.54 0.00 0.00 174.62 175.09 3m1c h PRO 739 N 0.79 0.36 0.00 3.99 0.11 -1.78 -2.30 132.00 133.17 3m1c h PRO 739 Ca -0.48 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3m1c h PRO 739 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3m1c h PRO 739 CO 0.57 0.36 0.13 0.00 -0.21 0.00 0.00 178.00 178.85 3m1c n ALA 740 N -2.49 0.83 -0.33 -0.75 0.00 -1.26 -1.06 120.51 115.45 3m1c n ALA 740 Ca 0.01 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.58 3m1c n ALA 740 Cb 0.17 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.61 3m1c n ALA 740 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3m1c n GLY 741 N -1.31 0.81 3.85 0.00 0.00 -0.87 -4.78 105.19 102.89 3m1c n GLY 741 Ca -0.01 -0.19 -0.37 0.00 0.00 0.00 0.00 46.02 45.45 3m1c n GLY 741 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3m1c s GLU 742 N -0.67 3.85 -0.31 1.61 2.12 -1.25 -4.89 118.70 119.16 3m1c s GLU 742 Ca 0.00 0.32 -0.11 0.00 0.36 0.00 0.00 54.97 55.54 3m1c s GLU 742 Cb 0.00 -3.15 -0.03 0.00 0.26 0.00 0.00 34.13 31.21 3m1c s GLU 742 CO 0.00 0.66 0.19 0.08 -0.54 0.00 0.00 175.26 175.65 3m1c s VAL 743 N -1.17 5.07 -0.10 3.70 1.01 -1.26 -0.46 120.40 127.20 3m1c s VAL 743 Ca 0.26 -0.12 -0.12 0.00 0.00 0.00 0.00 61.98 62.00 3m1c s VAL 743 Cb -0.16 -3.52 -0.28 0.00 0.00 0.00 0.00 36.38 32.43 3m1c s VAL 743 CO 0.14 0.12 0.52 0.24 0.00 0.00 0.00 175.10 176.12 3m1c h MET 744 N 8.40 0.29 -2.90 2.72 0.00 -0.28 -3.42 114.93 119.74 3m1c h MET 744 Ca -0.33 -0.50 -0.13 0.00 0.00 0.00 0.00 59.70 58.74 3m1c h MET 744 Cb 1.17 0.18 -0.24 0.00 0.00 0.00 0.00 31.60 32.72 3m1c h MET 744 CO 0.60 1.24 -0.29 -1.54 0.00 0.00 0.00 176.91 176.91 3m1c s SER 745 N -7.12 -0.34 -0.61 1.22 1.04 -1.20 -0.34 113.70 106.35 3m1c s SER 745 Ca -0.20 0.60 0.06 0.00 0.48 0.00 0.00 55.95 56.89 3m1c s SER 745 Cb 0.05 0.65 0.24 0.00 0.10 0.00 0.00 66.02 67.06 3m1c s SER 745 CO 0.79 -0.19 0.69 0.52 0.98 0.00 0.00 173.24 176.03 3m1c n VAL 746 N 2.56 1.83 -3.03 5.02 0.31 -1.25 -1.33 118.33 122.44 3m1c n VAL 746 Ca -0.15 -5.00 -0.40 0.00 -0.01 0.00 0.00 64.34 58.79 3m1c n VAL 746 Cb 0.57 -2.08 -0.05 0.00 -0.91 0.00 0.00 33.84 31.37 3m1c n VAL 746 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3m1c s LEU 747 N -2.18 4.40 -0.18 7.52 1.43 0.12 -3.71 118.68 126.08 3m1c s LEU 747 Ca 0.38 1.32 -0.26 0.00 -1.03 0.00 0.00 54.13 54.54 3m1c s LEU 747 Cb 0.14 -3.14 -0.01 0.00 0.03 0.00 0.00 46.19 43.21 3m1c s LEU 747 CO -0.04 -0.02 0.86 -0.22 0.23 0.00 0.00 176.35 177.16 3m1c s LEU 748 N 0.23 4.16 -1.06 1.79 2.96 -1.26 0.21 118.68 125.72 3m1c s LEU 748 Ca 0.37 1.20 -0.23 0.00 -0.22 0.00 0.00 54.13 55.25 3m1c s LEU 748 Cb -0.19 -3.28 -0.03 0.00 0.50 0.00 0.00 46.19 43.19 3m1c s LEU 748 CO 0.20 -0.44 1.84 -0.69 -1.32 0.00 0.00 176.35 175.95 3m1c s VAL 749 N 2.31 3.64 -0.06 1.68 1.01 0.53 -4.83 120.40 124.67 3m1c s VAL 749 Ca 0.39 -0.80 -0.11 0.00 0.00 0.00 0.00 61.98 61.46 3m1c s VAL 749 Cb -0.16 -4.50 -0.07 0.00 0.00 0.00 0.00 36.38 31.65 3m1c s VAL 749 CO 0.12 -1.25 0.46 -0.78 0.00 0.00 0.00 175.10 173.65 3m1c h ASP 750 N 10.10 -0.30 -4.78 3.32 3.58 -1.92 -0.40 116.42 126.02 3m1c h ASP 750 Ca 0.19 -0.03 -0.58 0.00 0.42 0.00 0.00 57.03 57.04 3m1c h ASP 750 Cb 0.97 0.08 -0.11 0.00 1.72 0.00 0.00 39.33 41.98 3m1c h ASP 750 CO 1.28 0.17 -0.42 0.35 -2.88 0.00 0.00 179.24 177.73 3m1c n THR 751 N -5.01 0.00 -0.01 2.25 -2.24 -1.26 -4.61 114.28 103.39 3m1c n THR 751 Ca -0.05 -2.13 -0.12 0.00 -2.27 0.00 0.00 64.05 59.48 3m1c n THR 751 Cb 0.16 0.47 0.02 0.00 -2.10 0.00 0.00 70.33 68.88 3m1c n THR 751 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 3m1c h ASP 752 N 1.13 0.73 -0.90 3.42 1.82 -1.99 -2.71 116.42 117.92 3m1c h ASP 752 Ca -0.36 -0.41 0.14 0.00 -0.39 0.00 0.00 57.03 56.01 3m1c h ASP 752 Cb 1.13 -0.21 -0.09 0.00 0.68 0.00 0.00 39.33 40.84 3m1c h ASP 752 CO 0.60 1.15 0.51 0.00 -1.61 0.00 0.00 179.24 179.89 3m1c h ALA 753 N 0.86 1.36 0.00 -0.78 0.00 -2.00 0.31 119.26 119.02 3m1c h ALA 753 Ca -0.00 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 3m1c h ALA 753 Cb 1.16 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 3m1c h ALA 753 CO 0.12 0.02 -0.32 1.15 0.00 0.00 0.00 179.25 180.21 3m1c h THR 754 N 0.75 0.91 -0.04 0.00 2.02 -1.95 -1.00 112.91 113.60 3m1c h THR 754 Ca 0.47 -1.26 -0.16 0.00 0.77 0.00 0.00 66.41 66.24 3m1c h THR 754 Cb 0.60 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 3m1c h THR 754 CO -0.32 0.32 -0.69 -0.61 0.37 0.00 0.00 175.52 174.58 3m1c h GLN 755 N 0.00 0.20 0.11 6.66 4.15 -0.12 -3.14 115.11 122.97 3m1c h GLN 755 Ca -0.00 -0.16 -0.18 0.00 0.77 0.00 0.00 58.65 59.07 3m1c h GLN 755 Cb 0.72 0.03 0.02 0.00 0.21 0.00 0.00 27.48 28.46 3m1c h GLN 755 CO 0.04 0.82 -0.77 1.96 -1.93 0.00 0.00 178.83 178.95 3m1c h GLN 756 N 0.14 0.33 0.00 1.69 1.08 -0.81 -1.98 115.11 115.56 3m1c h GLN 756 Ca -0.02 -0.50 0.00 0.00 -1.45 0.00 0.00 58.65 56.68 3m1c h GLN 756 Cb 1.23 0.18 0.00 0.00 -0.05 0.00 0.00 27.48 28.84 3m1c h GLN 756 CO 0.11 1.21 0.54 0.37 -0.95 0.00 0.00 178.83 180.11 3m1c h GLN 757 N -0.29 0.00 0.00 1.46 4.15 -1.26 0.75 115.11 119.91 3m1c h GLN 757 Ca -0.13 0.00 -0.29 0.00 0.77 0.00 0.00 58.65 59.00 3m1c h GLN 757 Cb 1.57 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 29.20 3m1c h GLN 757 CO 0.15 0.00 -2.10 1.28 -1.93 0.00 0.00 178.83 176.23 3m1c n LEU 758 N -2.35 0.03 0.22 -2.39 4.77 -1.12 -4.44 117.00 111.72 3m1c n LEU 758 Ca -0.01 -0.00 0.11 0.00 -0.03 0.00 0.00 56.01 56.08 3m1c n LEU 758 Cb 0.56 0.38 0.34 0.00 -2.33 0.00 0.00 43.42 42.38 3m1c n LEU 758 CO 0.06 0.40 0.79 0.00 -1.33 0.00 0.00 177.39 177.31 3m1c h ALA 759 N 0.78 0.95 -0.14 -1.18 0.00 -0.08 -3.13 119.26 116.46 3m1c h ALA 759 Ca -0.44 -0.14 -0.23 0.00 0.00 0.00 0.00 54.91 54.11 3m1c h ALA 759 Cb 1.99 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 19.76 3m1c h ALA 759 CO 0.02 0.19 -0.80 1.96 0.00 0.00 0.00 179.25 180.62 3m1c h GLN 760 N 0.00 0.78 0.00 0.00 4.20 -1.68 -3.41 115.11 115.00 3m1c h GLN 760 Ca -0.00 -0.65 0.00 0.00 0.06 0.00 0.00 58.65 58.06 3m1c h GLN 760 Cb 0.89 0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.81 3m1c h GLN 760 CO 0.02 1.25 0.00 0.41 -0.67 0.00 0.00 178.83 179.84 3m1c n GLY 761 N 0.73 -0.55 3.40 3.46 0.00 -1.18 -4.86 105.19 106.19 3m1c n GLY 761 Ca -0.08 -2.22 -0.45 0.00 0.00 0.00 0.00 46.02 43.28 3m1c n GLY 761 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3m1c s PRO 762 N -0.06 4.05 0.25 1.61 0.05 -1.26 -4.81 135.00 134.82 3m1c s PRO 762 Ca 0.00 -2.74 -0.30 0.00 0.05 0.00 0.00 61.00 58.01 3m1c s PRO 762 Cb 0.00 -4.80 -0.14 0.00 0.05 0.00 0.00 34.50 29.61 3m1c s PRO 762 CO 0.00 -1.53 1.19 0.28 0.05 0.00 0.00 177.00 176.99 3m1c n VAL 763 N 3.91 1.39 -2.48 -0.36 0.31 -1.26 -4.89 118.33 114.95 3m1c n VAL 763 Ca 0.29 -0.35 -0.42 0.00 -0.01 0.00 0.00 64.34 63.85 3m1c n VAL 763 Cb 0.42 -1.13 -0.03 0.00 -0.91 0.00 0.00 33.84 32.19 3m1c n VAL 763 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3m1c s ALA 764 N -0.54 3.37 0.00 3.52 0.00 -1.26 -2.68 121.76 124.17 3m1c s ALA 764 Ca 0.65 0.75 0.00 0.00 0.00 0.00 0.00 51.96 53.36 3m1c s ALA 764 Cb -0.72 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 18.96 3m1c s ALA 764 CO 0.55 -0.46 0.00 0.41 0.00 0.00 0.00 175.76 176.26 3m1c n GLY 765 N 3.19 0.48 2.74 0.00 0.00 -1.26 -4.98 105.19 105.35 3m1c n GLY 765 Ca 0.09 -0.40 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 3m1c n GLY 765 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3m1c n THR 766 N -2.95 1.10 -1.81 2.61 -1.04 -1.09 -5.06 114.28 106.04 3m1c n THR 766 Ca 0.00 -4.61 -0.21 0.00 -2.04 0.00 0.00 64.05 57.20 3m1c n THR 766 Cb 0.00 -2.07 -0.09 0.00 -1.82 0.00 0.00 70.33 66.35 3m1c n THR 766 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3m1c s PRO 767 N -1.27 1.78 1.20 -2.82 0.02 -1.26 -4.62 135.00 128.02 3m1c s PRO 767 Ca 0.28 -0.69 -0.17 0.00 0.02 0.00 0.00 61.00 60.44 3m1c s PRO 767 Cb -0.00 -5.08 0.28 0.00 0.02 0.00 0.00 34.50 29.72 3m1c s PRO 767 CO -0.16 -4.77 1.05 -0.80 -0.33 0.00 0.00 177.00 171.99 3m1c s ASN 768 N 7.77 0.83 0.00 2.53 0.01 -1.26 -4.89 114.94 119.94 3m1c s ASN 768 Ca 0.76 0.99 0.31 0.00 -0.71 0.00 0.00 52.86 54.21 3m1c s ASN 768 Cb -0.04 -1.49 1.70 0.00 0.41 0.00 0.00 41.25 41.84 3m1c s ASN 768 CO 0.15 -4.22 2.13 0.52 -1.51 0.00 0.00 177.10 174.17 3m1c n VAL 769 N -4.87 0.00 1.09 1.60 0.31 -1.26 -3.52 118.33 111.67 3m1c n VAL 769 Ca 0.09 -0.01 0.12 0.00 -0.01 0.00 0.00 64.34 64.53 3m1c n VAL 769 Cb 0.58 -0.46 0.14 0.00 -0.91 0.00 0.00 33.84 33.19 3m1c n VAL 769 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 3m1c n PHE 770 N -1.10 0.00 -4.40 3.52 3.72 -1.26 -4.89 117.46 113.05 3m1c n PHE 770 Ca 0.19 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.30 3m1c n PHE 770 Cb 0.18 -0.07 -0.12 0.00 -0.94 0.00 0.00 39.48 38.53 3m1c n PHE 770 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 3m1c s SER 771 N -2.62 3.86 0.13 4.37 1.04 -1.23 -5.01 113.70 114.25 3m1c s SER 771 Ca 0.18 -0.52 0.04 0.00 0.48 0.00 0.00 55.95 56.12 3m1c s SER 771 Cb 0.18 -0.56 -0.04 0.00 0.10 0.00 0.00 66.02 65.70 3m1c s SER 771 CO 0.61 0.20 -0.09 -0.55 0.98 0.00 0.00 173.24 174.39 3m1c s SER 772 N -1.95 1.58 0.00 7.02 0.15 -1.26 -4.82 113.70 114.42 3m1c s SER 772 Ca 0.17 -1.00 0.26 0.00 0.70 0.00 0.00 55.95 56.08 3m1c s SER 772 Cb -0.11 0.02 0.64 0.00 -1.71 0.00 0.00 66.02 64.87 3m1c s SER 772 CO 0.09 -0.37 1.51 0.47 1.20 0.00 0.00 173.24 176.14 3m1c n ASP 773 N -0.12 1.94 -4.66 5.45 9.92 -1.26 -4.86 116.55 122.96 3m1c n ASP 773 Ca -0.11 -1.57 -0.37 0.00 -0.53 0.00 0.00 54.79 52.22 3m1c n ASP 773 Cb 0.61 0.07 -0.09 0.00 -0.64 0.00 0.00 41.12 41.06 3m1c n ASP 773 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3m1c s VAL 774 N -2.12 5.34 -0.38 2.53 1.01 -1.26 -5.03 120.40 120.49 3m1c s VAL 774 Ca 0.31 0.25 -0.42 0.00 0.00 0.00 0.00 61.98 62.12 3m1c s VAL 774 Cb 0.20 -3.53 -0.17 0.00 0.00 0.00 0.00 36.38 32.88 3m1c s VAL 774 CO 0.37 0.34 1.78 -2.65 0.00 0.00 0.00 175.10 174.94 3m1c n PRO 775 N 4.28 0.64 -3.63 2.72 -0.02 -1.25 -4.74 135.00 133.01 3m1c n PRO 775 Ca -0.14 0.23 -0.06 0.00 -2.02 0.00 0.00 63.50 61.50 3m1c n PRO 775 Cb 0.52 -1.87 -0.02 0.00 -0.02 0.00 0.00 33.50 32.11 3m1c n PRO 775 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3m1c s SER 776 N 3.95 -0.29 0.07 2.55 1.04 -0.95 -4.46 113.70 115.61 3m1c s SER 776 Ca 1.04 -0.21 0.07 0.00 0.48 0.00 0.00 55.95 57.32 3m1c s SER 776 Cb -1.24 0.46 -0.04 0.00 0.10 0.00 0.00 66.02 65.30 3m1c s SER 776 CO 0.70 -0.81 -0.14 -0.69 0.98 0.00 0.00 173.24 173.28 3m1c s VAL 777 N -3.27 3.08 -0.19 5.02 1.01 0.17 -2.46 120.40 123.76 3m1c s VAL 777 Ca 0.08 -1.21 -0.05 0.00 0.00 0.00 0.00 61.98 60.81 3m1c s VAL 777 Cb -0.01 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 3m1c s VAL 777 CO -0.03 0.24 -0.01 0.00 0.00 0.00 0.00 175.10 175.30 3m1c s ALA 778 N -1.05 3.03 0.20 5.51 0.00 -1.26 -1.43 121.76 126.75 3m1c s ALA 778 Ca 0.17 -0.94 0.08 0.00 0.00 0.00 0.00 51.96 51.27 3m1c s ALA 778 Cb -0.11 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.25 3m1c s ALA 778 CO 0.09 -0.05 -0.01 -0.51 0.00 0.00 0.00 175.76 175.28 3m1c s LEU 779 N 0.83 3.25 -0.15 0.00 1.43 0.57 -0.81 118.68 123.79 3m1c s LEU 779 Ca 0.00 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 52.63 3m1c s LEU 779 Cb -0.14 -1.87 0.03 0.00 0.03 0.00 0.00 46.19 44.23 3m1c s LEU 779 CO 0.02 0.07 -0.12 -0.22 0.23 0.00 0.00 176.35 176.32 3m1c s LEU 780 N -3.13 1.72 -0.35 1.79 2.96 -0.39 -1.72 118.68 119.56 3m1c s LEU 780 Ca 0.28 -0.54 -0.13 0.00 -0.22 0.00 0.00 54.13 53.53 3m1c s LEU 780 Cb -0.08 -1.14 -0.00 0.00 0.50 0.00 0.00 46.19 45.46 3m1c s LEU 780 CO 0.19 -0.08 0.23 -0.76 -1.32 0.00 0.00 176.35 174.61 3m1c s LEU 781 N 1.50 4.60 0.44 -0.68 1.43 0.21 -1.92 118.68 124.26 3m1c s LEU 781 Ca 0.04 -0.60 -0.16 0.00 -1.03 0.00 0.00 54.13 52.38 3m1c s LEU 781 Cb -0.13 -2.11 -0.09 0.00 0.03 0.00 0.00 46.19 43.89 3m1c s LEU 781 CO -0.10 -0.29 0.90 -0.36 0.23 0.00 0.00 176.35 176.73 3m1c s PHE 782 N 1.68 3.41 0.64 0.29 0.08 -0.27 -0.84 117.98 122.96 3m1c s PHE 782 Ca 0.05 1.39 0.37 0.00 0.12 0.00 0.00 56.93 58.86 3m1c s PHE 782 Cb -0.18 -2.70 2.05 0.00 -0.57 0.00 0.00 43.02 41.62 3m1c s PHE 782 CO 0.09 -0.18 2.23 -1.35 -0.10 0.00 0.00 175.22 175.91 3m1c h PRO 783 N 1.45 0.00 -0.59 0.24 0.11 -1.88 -2.72 132.00 128.61 3m1c h PRO 783 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3m1c h PRO 783 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3m1c h PRO 783 CO 0.62 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.68 3m1c n ASN 784 N -3.33 3.34 0.00 -2.05 6.94 -1.26 -4.75 115.26 114.15 3m1c n ASN 784 Ca -0.02 -2.15 0.00 0.00 -0.02 0.00 0.00 54.58 52.39 3m1c n ASN 784 Cb 0.17 -0.43 0.00 0.00 -2.36 0.00 0.00 39.78 37.16 3m1c n ASN 784 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3m1c n GLY 785 N 1.19 2.89 3.74 4.83 0.00 -1.02 -5.07 105.19 111.75 3m1c n GLY 785 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 3m1c n GLY 785 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3m1c s THR 786 N -2.79 4.49 -0.14 2.61 -4.23 -1.26 -4.90 115.64 109.41 3m1c s THR 786 Ca 0.00 1.88 0.02 0.00 -1.18 0.00 0.00 61.69 62.42 3m1c s THR 786 Cb 0.00 -4.23 0.01 0.00 1.34 0.00 0.00 72.50 69.62 3m1c s THR 786 CO 0.00 0.39 -0.22 -0.69 -0.54 0.00 0.00 174.62 173.56 3m1c s VAL 787 N -0.36 2.07 0.43 2.29 1.01 -1.26 -1.11 120.40 123.47 3m1c s VAL 787 Ca 0.42 -0.97 0.06 0.00 0.00 0.00 0.00 61.98 61.49 3m1c s VAL 787 Cb -0.23 -1.83 -0.06 0.00 0.00 0.00 0.00 36.38 34.26 3m1c s VAL 787 CO 0.27 0.55 0.03 0.27 0.00 0.00 0.00 175.10 176.23 3m1c s ILE 788 N 0.87 1.89 -0.36 2.22 -4.36 -0.81 -4.08 121.20 116.58 3m1c s ILE 788 Ca -0.06 -1.96 -0.00 0.00 -0.26 0.00 0.00 60.65 58.37 3m1c s ILE 788 Cb -0.15 -2.85 0.09 0.00 1.25 0.00 0.00 42.46 40.80 3m1c s ILE 788 CO -0.03 0.00 0.10 -2.28 0.24 0.00 0.00 174.94 172.97 3m1c s HIS 789 N -2.73 3.57 -1.00 1.37 5.65 -0.47 -1.26 115.29 120.42 3m1c s HIS 789 Ca 0.31 -2.50 -0.20 0.00 0.25 0.00 0.00 55.06 52.92 3m1c s HIS 789 Cb 0.08 -2.86 -0.09 0.00 -1.18 0.00 0.00 32.58 28.52 3m1c s HIS 789 CO 0.16 -0.93 1.99 1.28 -0.65 0.00 0.00 174.74 176.59 3m1c n LEU 790 N 4.48 4.71 -0.19 8.88 4.77 0.01 -1.43 117.00 138.23 3m1c n LEU 790 Ca -0.03 -3.27 0.06 0.00 -0.03 0.00 0.00 56.01 52.74 3m1c n LEU 790 Cb 0.42 -1.34 0.13 0.00 -2.33 0.00 0.00 43.42 40.30 3m1c n LEU 790 CO 0.28 -0.12 0.41 0.18 -1.33 0.00 0.00 177.39 176.81 3m1c n LEU 791 N 7.84 -0.12 0.27 2.23 4.77 -1.20 0.47 117.00 131.27 3m1c n LEU 791 Ca 0.50 0.94 0.14 0.00 -0.03 0.00 0.00 56.01 57.56 3m1c n LEU 791 Cb 0.41 -0.32 0.78 0.00 -2.33 0.00 0.00 43.42 41.97 3m1c n LEU 791 CO 0.96 -0.93 1.01 0.00 -1.33 0.00 0.00 177.39 177.10 3m1c h ALA 792 N 1.10 1.24 -0.02 -1.18 0.00 -1.87 -2.75 119.26 115.79 3m1c h ALA 792 Ca 0.31 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.13 3m1c h ALA 792 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3m1c h ALA 792 CO -0.54 0.11 -0.26 1.19 0.00 0.00 0.00 179.25 179.76 3m1c n PHE 793 N -3.55 0.00 -1.57 0.00 3.72 0.18 -4.57 117.46 111.66 3m1c n PHE 793 Ca -0.02 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.02 3m1c n PHE 793 Cb 0.22 -0.03 0.08 0.00 -0.94 0.00 0.00 39.48 38.80 3m1c n PHE 793 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 3m1c n ASP 794 N 0.09 1.37 -3.79 4.37 10.43 -1.04 -4.67 116.55 123.30 3m1c n ASP 794 Ca 0.12 0.77 -0.27 0.00 2.57 0.00 0.00 54.79 57.98 3m1c n ASP 794 Cb 0.44 -1.49 -0.17 0.00 1.84 0.00 0.00 41.12 41.75 3m1c n ASP 794 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 3m1c s THR 795 N -1.57 0.72 0.51 -3.53 -4.23 -1.03 -5.00 115.64 101.51 3m1c s THR 795 Ca 0.79 -0.53 -0.03 0.00 -1.18 0.00 0.00 61.69 60.74 3m1c s THR 795 Cb -0.37 -1.08 -0.00 0.00 1.34 0.00 0.00 72.50 72.38 3m1c s THR 795 CO 0.44 -0.05 0.78 -0.76 -0.54 0.00 0.00 174.62 174.49 3m1c s LEU 796 N 1.78 3.48 0.00 4.79 1.02 -1.26 -2.24 118.68 126.24 3m1c s LEU 796 Ca -0.00 0.54 0.31 0.00 0.02 0.00 0.00 54.13 55.00 3m1c s LEU 796 Cb -0.16 -3.40 1.78 0.00 0.02 0.00 0.00 46.19 44.43 3m1c s LEU 796 CO -0.07 -0.84 2.16 -2.65 0.02 0.00 0.00 176.35 174.97