#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b8m s TRP 65 N 0.00 1.09 -0.25 2.13 0.52 -0.03 -4.97 118.94 117.43 3b8m s TRP 65 Ca 0.00 -0.92 -0.14 0.00 0.02 0.00 0.00 56.10 55.06 3b8m s TRP 65 Cb 0.00 -1.07 -0.04 0.00 -1.15 0.00 0.00 33.47 31.21 3b8m s TRP 65 CO 0.00 -0.63 0.34 0.99 0.02 0.00 0.00 176.95 177.68 3b8m s THR 66 N 1.84 5.21 0.09 2.01 2.01 -1.26 -0.18 115.64 125.35 3b8m s THR 66 Ca -0.01 0.53 -0.14 0.00 0.31 0.00 0.00 61.69 62.38 3b8m s THR 66 Cb -0.17 -3.67 -0.06 0.00 0.01 0.00 0.00 72.50 68.60 3b8m s THR 66 CO -0.09 0.20 0.49 -0.55 -0.69 0.00 0.00 174.62 173.99 3b8m s SER 67 N 1.46 6.82 0.09 3.53 0.15 0.26 -4.58 113.70 121.42 3b8m s SER 67 Ca 0.14 1.02 0.06 0.00 0.70 0.00 0.00 55.95 57.87 3b8m s SER 67 Cb -0.15 -2.27 -0.03 0.00 -1.71 0.00 0.00 66.02 61.86 3b8m s SER 67 CO 0.09 0.19 -0.16 0.00 1.20 0.00 0.00 173.24 174.56 3b8m s ALA 68 N -1.32 1.42 0.01 5.45 0.00 -1.26 -1.36 121.76 124.70 3b8m s ALA 68 Ca 0.32 -1.14 -0.01 0.00 0.00 0.00 0.00 51.96 51.14 3b8m s ALA 68 Cb -0.16 -0.13 -0.01 0.00 0.00 0.00 0.00 23.12 22.82 3b8m s ALA 68 CO 0.18 0.20 0.00 0.00 0.00 0.00 0.00 175.76 176.14 3b8m s ALA 69 N -1.46 0.03 -0.13 0.00 0.00 0.91 0.10 121.76 121.22 3b8m s ALA 69 Ca 0.03 -0.45 0.01 0.00 0.00 0.00 0.00 51.96 51.55 3b8m s ALA 69 Cb -0.09 0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.17 3b8m s ALA 69 CO 0.03 -0.15 -0.16 0.08 0.00 0.00 0.00 175.76 175.56 3b8m s VAL 70 N -1.28 1.62 0.02 0.00 1.01 0.86 0.16 120.40 122.79 3b8m s VAL 70 Ca -0.14 -0.69 0.08 0.00 0.00 0.00 0.00 61.98 61.24 3b8m s VAL 70 Cb -0.08 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.78 3b8m s VAL 70 CO -0.01 0.47 -0.25 0.68 0.00 0.00 0.00 175.10 175.99 3b8m s VAL 71 N 1.22 2.02 0.18 2.92 -7.23 0.03 0.15 120.40 119.69 3b8m s VAL 71 Ca -0.01 -1.23 0.07 0.00 -1.81 0.00 0.00 61.98 59.01 3b8m s VAL 71 Cb -0.14 -1.70 -0.04 0.00 0.56 0.00 0.00 36.38 35.05 3b8m s VAL 71 CO -0.06 0.43 -0.15 0.42 -0.31 0.00 0.00 175.10 175.43 3b8m s THR 72 N -0.71 1.65 0.43 5.32 -4.23 0.17 -0.39 115.64 117.88 3b8m s THR 72 Ca 0.10 -2.09 -0.22 0.00 -1.18 0.00 0.00 61.69 58.31 3b8m s THR 72 Cb -0.10 -1.93 -0.13 0.00 1.34 0.00 0.00 72.50 71.69 3b8m s THR 72 CO 0.01 -0.54 0.46 -2.65 -0.54 0.00 0.00 174.62 171.35 3b8m n PRO 73 N -0.14 0.46 -1.14 3.99 -0.02 -1.26 0.18 135.00 137.07 3b8m n PRO 73 Ca -0.10 0.17 -0.31 0.00 -2.02 0.00 0.00 63.50 61.24 3b8m n PRO 73 Cb 0.59 -1.42 0.12 0.00 -0.02 0.00 0.00 33.50 32.77 3b8m n PRO 73 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 3b8m s PRO 74 N -1.50 1.74 0.21 0.52 0.04 -1.26 -4.00 135.00 130.75 3b8m s PRO 74 Ca 0.63 1.13 0.07 0.00 0.04 0.00 0.00 61.00 62.87 3b8m s PRO 74 Cb -0.60 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.06 3b8m s PRO 74 CO 0.59 -2.00 0.08 -1.21 0.04 0.00 0.00 177.00 174.50 3b8m s GLU 75 N -4.86 2.64 0.41 4.56 2.02 -1.26 -4.92 118.70 117.29 3b8m s GLU 75 Ca 0.63 -1.09 0.20 0.00 0.02 0.00 0.00 54.97 54.74 3b8m s GLU 75 Cb -0.18 -2.45 1.16 0.00 0.10 0.00 0.00 34.13 32.76 3b8m s GLU 75 CO 0.57 0.43 1.75 -1.35 0.02 0.00 0.00 175.26 176.68 3b8m h PRO 76 N 2.19 0.33 0.00 0.39 0.11 -1.99 0.25 132.00 133.28 3b8m h PRO 76 Ca -0.47 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.60 3b8m h PRO 76 Cb 1.22 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.25 3b8m h PRO 76 CO 0.60 0.22 -0.08 -0.39 -0.21 0.00 0.00 178.00 178.14 3b8m h VAL 77 N 0.34 0.30 -0.00 3.15 -1.51 -2.04 -1.85 116.25 114.63 3b8m h VAL 77 Ca 0.63 -0.57 0.00 0.00 -1.23 0.00 0.00 66.70 65.53 3b8m h VAL 77 Cb 1.67 1.43 0.00 0.00 -2.13 0.00 0.00 31.29 32.26 3b8m h VAL 77 CO -0.31 0.08 -0.00 0.00 -1.23 0.00 0.00 177.57 176.11 3b8m n GLN 78 N -3.33 1.16 -0.06 5.19 6.02 0.87 -4.02 117.38 123.21 3b8m n GLN 78 Ca -0.01 -0.25 0.04 0.00 -0.01 0.00 0.00 57.00 56.77 3b8m n GLN 78 Cb 0.27 -1.49 0.07 0.00 1.02 0.00 0.00 30.24 30.11 3b8m n GLN 78 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 177.06 177.92 3b8m n TRP 79 N -0.70 0.09 0.07 1.08 -0.00 -0.70 -4.72 117.44 112.57 3b8m n TRP 79 Ca 0.23 -0.67 -0.16 0.00 -0.00 0.00 0.00 57.50 56.89 3b8m n TRP 79 Cb 0.18 -0.09 -0.08 0.00 -0.00 0.00 0.00 31.31 31.31 3b8m n TRP 79 CO 0.00 0.00 0.00 0.37 -0.00 0.00 0.00 177.69 178.06 3b8m h GLN 80 N 0.28 0.46 -0.63 5.87 5.75 -1.70 0.30 115.11 125.44 3b8m h GLN 80 Ca 0.00 -0.55 -0.08 0.00 -0.15 0.00 0.00 58.65 57.87 3b8m h GLN 80 Cb 0.73 0.17 -0.02 0.00 1.07 0.00 0.00 27.48 29.42 3b8m h GLN 80 CO 0.01 1.19 0.09 0.93 -2.65 0.00 0.00 178.83 178.41 3b8m h GLU 81 N 0.24 1.06 -0.59 1.69 5.08 -1.91 -1.19 114.58 118.96 3b8m h GLU 81 Ca -0.11 -0.29 0.03 0.00 -1.00 0.00 0.00 59.36 57.99 3b8m h GLU 81 Cb 1.70 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.79 3b8m h GLU 81 CO 0.19 0.99 0.35 -0.07 -1.00 0.00 0.00 179.01 179.46 3b8m h LEU 82 N 0.97 0.55 -0.75 1.33 4.07 -1.85 -2.67 115.31 116.96 3b8m h LEU 82 Ca 0.19 0.01 -0.09 0.00 0.08 0.00 0.00 57.88 58.07 3b8m h LEU 82 Cb 0.45 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 42.06 3b8m h LEU 82 CO 0.01 0.38 0.01 -0.08 -1.08 0.00 0.00 178.44 177.68 3b8m h GLU 83 N 0.68 0.96 -0.35 1.13 4.57 -0.47 -1.37 114.58 119.74 3b8m h GLU 83 Ca 0.24 -0.28 0.04 0.00 -1.18 0.00 0.00 59.36 58.18 3b8m h GLU 83 Cb 0.06 -0.10 -0.04 0.00 -0.16 0.00 0.00 28.75 28.51 3b8m h GLU 83 CO -0.12 0.95 0.13 0.87 -1.18 0.00 0.00 179.01 179.66 3b8m h LYS 84 N 0.89 0.27 -0.30 1.92 1.57 -1.04 -2.06 116.57 117.82 3b8m h LYS 84 Ca 0.17 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3b8m h LYS 84 Cb 0.51 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 3b8m h LYS 84 CO 0.02 0.18 0.19 1.15 -0.57 0.00 0.00 179.45 180.42 3b8m h THR 85 N 0.28 1.09 -0.05 -0.16 2.02 -1.09 -1.11 112.91 113.90 3b8m h THR 85 Ca 0.16 -0.20 0.01 0.00 0.77 0.00 0.00 66.41 67.15 3b8m h THR 85 Cb 0.13 0.69 -0.00 0.00 -1.74 0.00 0.00 68.15 67.23 3b8m h THR 85 CO -0.16 0.09 0.09 -0.26 0.37 0.00 0.00 175.52 175.66 3b8m h PHE 86 N 0.39 0.00 -0.04 3.16 0.04 -1.02 -2.04 116.94 117.42 3b8m h PHE 86 Ca 0.11 0.00 -0.24 0.00 2.80 0.00 0.00 57.97 60.63 3b8m h PHE 86 Cb -0.01 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.15 3b8m h PHE 86 CO -0.05 0.00 -0.95 1.15 -0.60 0.00 0.00 178.31 177.87 3b8m h THR 87 N 0.00 1.31 -0.45 -1.55 2.02 -0.49 -0.71 112.91 113.03 3b8m h THR 87 Ca 0.02 -2.22 0.02 0.00 0.77 0.00 0.00 66.41 65.01 3b8m h THR 87 Cb 0.21 2.28 -0.03 0.00 -1.74 0.00 0.00 68.15 68.87 3b8m h THR 87 CO -0.00 0.68 0.26 0.11 0.37 0.00 0.00 175.52 176.94 3b8m h LYS 88 N 0.39 0.51 -0.18 6.66 1.57 -1.13 -2.35 116.57 122.04 3b8m h LYS 88 Ca -0.10 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.54 3b8m h LYS 88 Cb 1.58 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.77 3b8m h LYS 88 CO 0.18 0.33 -0.38 -0.07 -0.57 0.00 0.00 179.45 178.95 3b8m h LEU 89 N 0.52 0.41 -1.06 2.94 3.38 -1.45 -2.81 115.31 117.23 3b8m h LEU 89 Ca 0.18 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3b8m h LEU 89 Cb 0.03 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 3b8m h LEU 89 CO -0.09 0.76 0.23 -0.09 0.09 0.00 0.00 178.44 179.33 3b8m h ARG 90 N 0.33 0.90 -0.68 1.13 2.43 -0.66 -0.67 114.38 117.16 3b8m h ARG 90 Ca 0.03 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 3b8m h ARG 90 Cb 0.82 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 3b8m h ARG 90 CO 0.07 0.75 0.37 0.28 -1.51 0.00 0.00 179.97 179.92 3b8m h VAL 91 N 0.88 1.20 -0.23 0.20 2.07 -1.18 -2.04 116.25 117.15 3b8m h VAL 91 Ca 0.21 -0.51 -0.06 0.00 0.82 0.00 0.00 66.70 67.16 3b8m h VAL 91 Cb 0.19 0.29 -0.04 0.00 -1.52 0.00 0.00 31.29 30.21 3b8m h VAL 91 CO -0.02 0.23 0.08 0.18 0.02 0.00 0.00 177.57 178.06 3b8m n LEU 92 N -4.37 3.13 -0.79 2.57 4.77 -0.44 -4.85 117.00 117.02 3b8m n LEU 92 Ca 0.07 -1.60 -0.08 0.00 -0.03 0.00 0.00 56.01 54.36 3b8m n LEU 92 Cb 0.10 -0.58 -0.02 0.00 -2.33 0.00 0.00 43.42 40.59 3b8m n LEU 92 CO 0.38 0.48 -0.09 -0.67 -1.33 0.00 0.00 177.39 176.16 3b8m n ASP 93 N 0.12 -3.33 -3.98 -1.43 2.03 -0.77 -5.00 116.55 104.20 3b8m n ASP 93 Ca 0.13 0.08 -0.30 0.00 0.52 0.00 0.00 54.79 55.21 3b8m n ASP 93 Cb 0.67 -2.19 -0.16 0.00 -0.72 0.00 0.00 41.12 38.72 3b8m n ASP 93 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3b8m s LEU 94 N -2.11 2.35 -0.60 -2.67 2.96 -0.39 -5.01 118.68 113.20 3b8m s LEU 94 Ca 0.00 -0.97 -0.05 0.00 -0.22 0.00 0.00 54.13 52.90 3b8m s LEU 94 Cb 0.00 -1.21 0.16 0.00 0.50 0.00 0.00 46.19 45.64 3b8m s LEU 94 CO 0.00 -0.17 0.43 -0.62 -1.32 0.00 0.00 176.35 174.67 3b8m s ASP 95 N 1.40 5.44 0.02 3.68 2.15 -1.26 -2.59 116.67 125.51 3b8m s ASP 95 Ca -0.03 -2.65 0.01 0.00 0.43 0.00 0.00 52.55 50.32 3b8m s ASP 95 Cb -0.17 -1.90 -0.02 0.00 -0.30 0.00 0.00 42.92 40.53 3b8m s ASP 95 CO -0.07 -0.44 -0.05 0.27 -0.17 0.00 0.00 175.17 174.70 3b8m s ILE 96 N 0.24 0.33 0.31 4.11 -4.36 -1.26 -5.10 121.20 115.47 3b8m s ILE 96 Ca 0.15 -0.79 0.04 0.00 -0.26 0.00 0.00 60.65 59.79 3b8m s ILE 96 Cb -0.20 -0.40 -0.06 0.00 1.25 0.00 0.00 42.46 43.05 3b8m s ILE 96 CO -0.04 -0.31 0.05 -1.59 0.24 0.00 0.00 174.94 173.30 3b8m s LYS 97 N -1.17 1.60 -0.37 0.37 -2.85 -1.26 -4.80 119.74 111.27 3b8m s LYS 97 Ca -0.09 -1.88 -0.08 0.00 -1.00 0.00 0.00 55.97 52.92 3b8m s LYS 97 Cb -0.08 -0.80 0.05 0.00 -2.06 0.00 0.00 37.83 34.94 3b8m s LYS 97 CO -0.00 -0.19 0.16 0.42 0.10 0.00 0.00 175.35 175.85 3b8m s ILE 98 N -3.34 3.99 0.24 3.79 1.01 -1.26 -5.04 121.20 120.58 3b8m s ILE 98 Ca 0.36 -1.20 -0.31 0.00 0.00 0.00 0.00 60.65 59.49 3b8m s ILE 98 Cb 0.08 -3.32 -0.13 0.00 0.01 0.00 0.00 42.46 39.10 3b8m s ILE 98 CO 0.15 -0.29 1.50 -0.67 0.00 0.00 0.00 174.94 175.62 3b8m n ASP 99 N 4.86 3.14 0.16 3.58 2.03 -1.26 -4.90 116.55 124.15 3b8m n ASP 99 Ca -0.11 1.13 0.01 0.00 0.52 0.00 0.00 54.79 56.33 3b8m n ASP 99 Cb 0.44 -1.47 0.29 0.00 -0.72 0.00 0.00 41.12 39.66 3b8m n ASP 99 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 3b8m h ARG 100 N 4.76 0.05 0.00 -0.67 3.08 -1.98 -2.31 114.38 117.31 3b8m h ARG 100 Ca -0.45 -0.02 -0.11 0.00 0.07 0.00 0.00 59.98 59.47 3b8m h ARG 100 Cb 1.26 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.29 3b8m h ARG 100 CO 0.80 0.47 -0.69 1.15 -1.07 0.00 0.00 179.97 180.63 3b8m h THR 101 N 0.04 0.69 0.01 2.04 2.02 -1.91 -2.99 112.91 112.81 3b8m h THR 101 Ca 0.00 -2.03 -0.21 0.00 0.77 0.00 0.00 66.41 64.94 3b8m h THR 101 Cb 0.78 2.27 -0.02 0.00 -1.74 0.00 0.00 68.15 69.43 3b8m h THR 101 CO 0.06 0.39 -0.99 -0.33 0.37 0.00 0.00 175.52 175.02 3b8m h GLU 102 N 0.00 0.04 -0.07 6.66 5.08 -1.86 -1.32 114.58 123.11 3b8m h GLU 102 Ca -0.04 -0.07 -0.18 0.00 -1.00 0.00 0.00 59.36 58.08 3b8m h GLU 102 Cb 1.38 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 3b8m h GLU 102 CO 0.05 0.99 -0.71 0.00 -1.00 0.00 0.00 179.01 178.34 3b8m h ALA 103 N 0.98 0.63 0.04 3.43 0.00 -1.50 -1.74 119.26 121.11 3b8m h ALA 103 Ca -0.03 -0.60 -0.00 0.00 0.00 0.00 0.00 54.91 54.28 3b8m h ALA 103 Cb 1.72 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.44 3b8m h ALA 103 CO 0.13 0.76 -0.02 0.35 0.00 0.00 0.00 179.25 180.48 3b8m h PHE 104 N 0.25 -0.05 -0.48 0.00 3.57 -1.39 -2.06 116.94 116.79 3b8m h PHE 104 Ca -0.03 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.55 3b8m h PHE 104 Cb 1.28 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 40.01 3b8m h PHE 104 CO 0.04 0.29 0.33 -0.91 -2.23 0.00 0.00 178.31 175.82 3b8m h ASN 105 N -0.39 0.30 0.18 0.41 -0.26 -1.17 -1.06 115.58 113.59 3b8m h ASN 105 Ca -0.01 0.00 -0.16 0.00 -0.56 0.00 0.00 56.30 55.58 3b8m h ASN 105 Cb 0.36 -0.06 -0.01 0.00 -1.06 0.00 0.00 38.32 37.55 3b8m h ASN 105 CO 0.01 0.19 -0.60 0.25 -1.06 0.00 0.00 177.43 176.22 3b8m h LEU 106 N 0.34 0.48 -0.39 1.61 5.85 -1.16 0.21 115.31 122.24 3b8m h LEU 106 Ca 0.22 -0.27 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 3b8m h LEU 106 Cb 0.42 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.30 3b8m h LEU 106 CO -0.05 0.97 0.16 0.15 -0.34 0.00 0.00 178.44 179.32 3b8m h PHE 107 N 0.32 0.59 0.05 1.25 3.57 -0.51 -0.51 116.94 121.70 3b8m h PHE 107 Ca -0.00 -0.04 -0.00 0.00 3.53 0.00 0.00 57.97 61.45 3b8m h PHE 107 Cb 1.14 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.70 3b8m h PHE 107 CO 0.04 0.53 -0.03 0.82 -2.23 0.00 0.00 178.31 177.44 3b8m h ILE 108 N 0.48 1.10 -0.49 1.41 1.08 -0.91 0.07 117.51 120.26 3b8m h ILE 108 Ca 0.13 -0.49 0.08 0.00 -0.39 0.00 0.00 64.86 64.19 3b8m h ILE 108 Cb 0.19 1.42 -0.07 0.00 -3.07 0.00 0.00 36.82 35.29 3b8m h ILE 108 CO -0.01 0.12 0.09 0.50 -0.69 0.00 0.00 178.15 178.16 3b8m h LYS 109 N -0.29 0.22 -0.39 2.37 3.64 -0.90 -1.45 116.57 119.76 3b8m h LYS 109 Ca -0.01 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 3b8m h LYS 109 Cb 0.26 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 3b8m h LYS 109 CO 0.01 0.14 0.12 0.87 -2.27 0.00 0.00 179.45 178.32 3b8m h LYS 110 N 0.22 0.61 -0.89 1.90 1.57 -0.91 -2.23 116.57 116.84 3b8m h LYS 110 Ca 0.25 -0.13 0.14 0.00 -1.87 0.00 0.00 60.65 59.03 3b8m h LYS 110 Cb 0.33 -0.09 -0.09 0.00 0.08 0.00 0.00 32.23 32.46 3b8m h LYS 110 CO -0.33 0.62 0.50 0.35 -0.57 0.00 0.00 179.45 180.02 3b8m h PHE 111 N 0.49 0.89 0.00 -1.35 3.57 -0.27 0.54 116.94 120.80 3b8m h PHE 111 Ca 0.13 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.66 3b8m h PHE 111 Cb 0.27 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.75 3b8m h PHE 111 CO 0.01 0.26 0.00 1.04 -2.23 0.00 0.00 178.31 177.39 3b8m n GLN 112 N -4.79 0.99 -2.63 1.11 6.02 -0.61 -4.77 117.38 112.69 3b8m n GLN 112 Ca 0.18 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.74 3b8m n GLN 112 Cb 0.42 -1.36 -0.02 0.00 1.02 0.00 0.00 30.24 30.29 3b8m n GLN 112 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 3b8m s SER 113 N -1.73 6.95 0.19 1.08 0.15 0.18 -4.91 113.70 115.61 3b8m s SER 113 Ca 0.35 1.14 -0.07 0.00 0.70 0.00 0.00 55.95 58.07 3b8m s SER 113 Cb 0.16 -2.54 0.10 0.00 -1.71 0.00 0.00 66.02 62.03 3b8m s SER 113 CO 0.27 -0.84 1.60 0.58 1.20 0.00 0.00 173.24 176.04 3b8m h VAL 114 N 5.68 1.27 -0.49 4.45 2.07 -1.87 -1.92 116.25 125.44 3b8m h VAL 114 Ca -0.21 -1.35 0.00 0.00 0.82 0.00 0.00 66.70 65.97 3b8m h VAL 114 Cb 1.06 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 3b8m h VAL 114 CO 1.02 0.46 0.31 0.28 0.02 0.00 0.00 177.57 179.66 3b8m h SER 115 N 0.78 0.56 0.13 0.57 0.02 -1.96 -0.95 113.55 112.70 3b8m h SER 115 Ca 0.11 -0.02 -0.17 0.00 -0.84 0.00 0.00 61.79 60.87 3b8m h SER 115 Cb 0.75 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 3b8m h SER 115 CO 0.06 0.42 -0.62 -0.07 -1.14 0.00 0.00 176.83 175.47 3b8m h LEU 116 N 0.66 0.55 -0.25 5.07 3.38 -1.80 -2.32 115.31 120.60 3b8m h LEU 116 Ca 0.18 -0.32 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 3b8m h LEU 116 Cb -0.06 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3b8m h LEU 116 CO -0.04 1.04 0.00 0.25 0.09 0.00 0.00 178.44 179.78 3b8m h LEU 117 N 0.35 0.43 -0.62 1.67 5.85 -0.52 -0.87 115.31 121.61 3b8m h LEU 117 Ca -0.01 -0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.43 3b8m h LEU 117 Cb 1.18 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 42.05 3b8m h LEU 117 CO 0.11 0.63 0.38 -0.33 -0.34 0.00 0.00 178.44 178.89 3b8m h GLU 118 N 0.22 0.72 -0.64 1.25 5.08 -1.22 -1.09 114.58 118.89 3b8m h GLU 118 Ca 0.07 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 3b8m h GLU 118 Cb 0.41 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 3b8m h GLU 118 CO 0.01 0.48 0.37 1.49 -1.00 0.00 0.00 179.01 180.36 3b8m h GLU 119 N 0.74 0.89 -0.33 2.33 4.81 -1.26 -0.50 114.58 121.25 3b8m h GLU 119 Ca 0.25 -0.09 0.02 0.00 -0.13 0.00 0.00 59.36 59.40 3b8m h GLU 119 Cb 0.02 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.20 3b8m h GLU 119 CO -0.10 0.65 0.18 -0.92 -0.73 0.00 0.00 179.01 178.09 3b8m h TYR 120 N 0.88 0.34 0.70 0.92 3.20 -0.51 -2.15 116.97 120.34 3b8m h TYR 120 Ca 0.23 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.08 3b8m h TYR 120 Cb 0.01 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.17 3b8m h TYR 120 CO -0.01 0.20 -0.37 -0.07 -1.64 0.00 0.00 178.16 176.26 3b8m h LEU 121 N 0.38 -0.90 -1.61 2.82 3.38 -0.79 -2.29 115.31 116.29 3b8m h LEU 121 Ca 0.13 0.04 0.21 0.00 0.09 0.00 0.00 57.88 58.35 3b8m h LEU 121 Cb 0.02 0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.95 3b8m h LEU 121 CO -0.07 -0.60 0.60 0.03 0.09 0.00 0.00 178.44 178.48 3b8m h ARG 122 N -0.98 0.31 -0.01 1.13 3.08 -1.06 0.58 114.38 117.42 3b8m h ARG 122 Ca -0.09 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.94 3b8m h ARG 122 Cb 0.77 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.75 3b8m h ARG 122 CO 0.13 0.20 -0.08 -1.13 -1.07 0.00 0.00 179.97 178.03 3b8m n SER 123 N -4.47 1.46 -4.53 7.04 3.41 -0.82 -4.80 113.62 110.92 3b8m n SER 123 Ca 0.19 -1.36 -0.41 0.00 -0.26 0.00 0.00 58.87 57.02 3b8m n SER 123 Cb 0.75 0.04 -0.09 0.00 -0.26 0.00 0.00 64.21 64.65 3b8m n SER 123 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3b8m s SER 124 N -2.14 6.19 0.26 4.04 0.15 0.19 -4.94 113.70 117.45 3b8m s SER 124 Ca 0.33 -0.35 -0.03 0.00 0.70 0.00 0.00 55.95 56.61 3b8m s SER 124 Cb 0.20 -2.21 0.41 0.00 -1.71 0.00 0.00 66.02 62.72 3b8m s SER 124 CO 0.39 -0.41 1.85 1.55 1.20 0.00 0.00 173.24 177.81 3b8m h PRO 125 N 8.53 0.98 -0.50 5.44 0.13 -1.87 -1.73 132.00 142.98 3b8m h PRO 125 Ca -0.29 -0.06 0.09 0.00 -0.87 0.00 0.00 66.00 64.87 3b8m h PRO 125 Cb 1.13 -0.22 -0.07 0.00 0.13 0.00 0.00 31.00 31.97 3b8m h PRO 125 CO 0.73 0.65 0.10 -0.92 -0.23 0.00 0.00 178.00 178.32 3b8m h TYR 126 N 1.01 0.16 -0.30 1.56 3.20 -1.94 -2.30 116.97 118.36 3b8m h TYR 126 Ca 0.42 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 62.19 3b8m h TYR 126 Cb 0.27 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.54 3b8m h TYR 126 CO -0.02 -0.01 -0.37 0.28 -1.64 0.00 0.00 178.16 176.41 3b8m h VAL 127 N 0.24 1.29 0.00 1.81 2.07 -1.67 -3.10 116.25 116.88 3b8m h VAL 127 Ca 0.25 -1.52 0.00 0.00 0.82 0.00 0.00 66.70 66.25 3b8m h VAL 127 Cb 0.34 1.45 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 3b8m h VAL 127 CO -0.33 0.49 0.00 0.23 0.02 0.00 0.00 177.57 177.98 3b8m n MET 128 N -4.05 0.08 -0.08 1.57 2.81 -0.72 -1.81 117.12 114.91 3b8m n MET 128 Ca -0.01 0.33 -0.10 0.00 -1.81 0.00 0.00 57.70 56.11 3b8m n MET 128 Cb 0.51 -1.65 -0.03 0.00 -0.71 0.00 0.00 33.22 31.34 3b8m n MET 128 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 3b8m h ASP 129 N 0.00 0.38 -3.61 7.83 3.32 -1.43 -3.51 116.42 119.39 3b8m h ASP 129 Ca 0.00 -0.18 -0.56 0.00 0.02 0.00 0.00 57.03 56.31 3b8m h ASP 129 Cb 0.28 -0.10 -0.07 0.00 0.22 0.00 0.00 39.33 39.66 3b8m h ASP 129 CO 0.00 0.45 0.93 0.00 -1.72 0.00 0.00 179.24 178.91 3b8m s GLN 130 N -5.51 3.75 0.00 3.56 0.00 -0.75 -5.18 119.66 115.54 3b8m s GLN 130 Ca -0.13 0.68 0.00 0.00 -0.00 0.00 0.00 55.36 55.91 3b8m s GLN 130 Cb 0.08 -3.90 0.00 0.00 0.00 0.00 0.00 33.01 29.19 3b8m s GLN 130 CO 0.73 -1.34 0.55 -0.25 0.00 0.00 0.00 175.29 174.97 3b8m n ASP 137 N 7.82 0.00 0.00 12.60 8.00 -1.26 -5.13 116.55 138.58 3b8m n ASP 137 Ca 0.13 -1.30 0.00 0.00 0.71 0.00 0.00 54.79 54.33 3b8m n ASP 137 Cb 0.49 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.53 3b8m n ASP 137 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3b8m n GLU 138 N 0.00 0.00 0.00 -1.24 1.02 -1.26 -4.88 120.64 114.28 3b8m n GLU 138 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 3b8m n GLU 138 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.98 3b8m n GLU 138 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3b8m n LEU 139 N -0.89 1.84 0.07 -4.62 4.77 -1.26 -4.12 117.00 112.79 3b8m n LEU 139 Ca 0.00 -1.84 0.13 0.00 -0.03 0.00 0.00 56.01 54.27 3b8m n LEU 139 Cb 0.00 0.00 0.47 0.00 -2.33 0.00 0.00 43.42 41.56 3b8m n LEU 139 CO 0.00 0.46 0.90 0.47 -1.33 0.00 0.00 177.39 177.89 3b8m n ASP 140 N -0.42 0.51 0.19 -1.43 8.00 -1.26 -3.57 116.55 118.57 3b8m n ASP 140 Ca 0.00 0.56 -0.16 0.00 0.71 0.00 0.00 54.79 55.90 3b8m n ASP 140 Cb 0.21 -0.69 -0.09 0.00 -0.02 0.00 0.00 41.12 40.53 3b8m n ASP 140 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3b8m h LEU 141 N 0.00 -1.35 -0.53 0.64 6.46 -1.90 0.37 115.31 119.00 3b8m h LEU 141 Ca 0.00 0.13 0.11 0.00 -0.12 0.00 0.00 57.88 58.00 3b8m h LEU 141 Cb 0.59 0.48 -0.11 0.00 -0.73 0.00 0.00 40.66 40.90 3b8m h LEU 141 CO 0.00 -0.57 -0.20 -0.74 -0.62 0.00 0.00 178.44 176.31 3b8m h HIS 142 N -0.81 -0.50 -0.81 1.25 2.76 -1.85 -1.26 115.15 113.93 3b8m h HIS 142 Ca -0.02 0.05 0.03 0.00 -2.20 0.00 0.00 60.37 58.24 3b8m h HIS 142 Cb 0.77 0.30 -0.05 0.00 1.55 0.00 0.00 27.41 29.98 3b8m h HIS 142 CO -0.33 -0.29 0.52 0.00 -1.30 0.00 0.00 177.93 176.53 3b8m h ARG 143 N -0.08 1.00 -0.69 5.26 3.08 -1.50 0.98 114.38 122.42 3b8m h ARG 143 Ca 0.25 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.20 3b8m h ARG 143 Cb 0.46 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.26 3b8m h ARG 143 CO -0.59 0.66 0.29 0.00 -1.07 0.00 0.00 179.97 179.26 3b8m h ALA 144 N 1.33 1.22 0.24 0.04 0.00 0.45 -0.97 119.26 121.57 3b8m h ALA 144 Ca 0.32 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3b8m h ALA 144 Cb -0.01 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.51 3b8m h ALA 144 CO -0.11 0.58 -0.12 0.82 0.00 0.00 0.00 179.25 180.43 3b8m h ILE 145 N 0.99 0.82 -0.99 0.00 1.08 -0.11 0.15 117.51 119.45 3b8m h ILE 145 Ca 0.23 -0.52 0.21 0.00 -0.39 0.00 0.00 64.86 64.39 3b8m h ILE 145 Cb 0.16 1.11 -0.10 0.00 -3.07 0.00 0.00 36.82 34.93 3b8m h ILE 145 CO -0.02 0.11 0.62 0.58 -0.69 0.00 0.00 178.15 178.75 3b8m h VAL 146 N -0.60 0.67 -0.09 1.67 2.07 -0.74 0.32 116.25 119.55 3b8m h VAL 146 Ca -0.03 -0.21 -0.17 0.00 0.82 0.00 0.00 66.70 67.11 3b8m h VAL 146 Cb 0.43 -0.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.21 3b8m h VAL 146 CO 0.06 0.11 -0.60 0.00 0.02 0.00 0.00 177.57 177.16 3b8m h ALA 147 N 1.64 0.20 -0.74 1.67 0.00 -0.77 -2.93 119.26 118.33 3b8m h ALA 147 Ca 0.56 -0.54 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 3b8m h ALA 147 Cb 1.06 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 3b8m h ALA 147 CO -0.32 0.45 0.26 -0.07 0.00 0.00 0.00 179.25 179.56 3b8m h LEU 148 N 0.18 1.05 -1.30 0.00 3.38 0.04 -2.49 115.31 116.17 3b8m h LEU 148 Ca -0.05 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3b8m h LEU 148 Cb 1.25 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3b8m h LEU 148 CO 0.12 0.97 0.00 0.77 0.09 0.00 0.00 178.44 180.39 3b8m h SER 149 N 1.08 0.00 0.00 -0.43 4.64 -0.31 -1.19 113.55 117.34 3b8m h SER 149 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 3b8m h SER 149 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 3b8m h SER 149 CO -0.01 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.33 3b8m n GLU 150 N -2.50 0.91 -0.10 4.77 1.02 -0.94 -3.35 120.64 120.46 3b8m n GLU 150 Ca 0.00 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.18 3b8m n GLU 150 Cb 0.17 -1.49 0.09 0.00 -0.02 0.00 0.00 31.44 30.20 3b8m n GLU 150 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3b8m n LYS 151 N -0.99 2.22 -3.08 3.49 5.02 -0.45 -4.87 118.16 119.49 3b8m n LYS 151 Ca 0.21 -1.68 -0.40 0.00 -2.02 0.00 0.00 58.31 54.43 3b8m n LYS 151 Cb 0.10 -1.19 -0.06 0.00 -0.02 0.00 0.00 35.03 33.87 3b8m n LYS 151 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3b8m s MET 152 N -0.92 4.22 0.08 1.97 -1.94 -1.21 -2.90 119.30 118.60 3b8m s MET 152 Ca 0.15 0.68 0.06 0.00 -1.71 0.00 0.00 55.69 54.87 3b8m s MET 152 Cb 0.08 -3.58 -0.03 0.00 2.01 0.00 0.00 34.83 33.31 3b8m s MET 152 CO 0.11 -0.26 -0.17 0.15 -0.01 0.00 0.00 175.02 174.85 3b8m s LYS 153 N 1.95 0.93 -0.07 2.03 1.02 -0.67 -5.01 119.74 119.93 3b8m s LYS 153 Ca 0.30 -1.04 0.01 0.00 0.02 0.00 0.00 55.97 55.26 3b8m s LYS 153 Cb -0.16 -1.03 0.02 0.00 -0.52 0.00 0.00 37.83 36.14 3b8m s LYS 153 CO 0.11 0.23 -0.08 0.00 -0.92 0.00 0.00 175.35 174.69 3b8m s ALA 154 N -1.26 1.07 -0.04 5.17 0.00 -1.26 -1.23 121.76 124.21 3b8m s ALA 154 Ca 0.01 -0.32 0.03 0.00 0.00 0.00 0.00 51.96 51.68 3b8m s ALA 154 Cb -0.10 -0.62 0.00 0.00 0.00 0.00 0.00 23.12 22.40 3b8m s ALA 154 CO 0.03 -0.09 -0.13 0.14 0.00 0.00 0.00 175.76 175.71 3b8m s VAL 155 N 1.08 1.13 0.14 0.00 -7.23 -0.04 -4.98 120.40 110.49 3b8m s VAL 155 Ca -0.08 -0.53 -0.31 0.00 -1.81 0.00 0.00 61.98 59.26 3b8m s VAL 155 Cb -0.14 -1.00 -0.08 0.00 0.56 0.00 0.00 36.38 35.72 3b8m s VAL 155 CO -0.01 0.34 1.34 -0.62 -0.31 0.00 0.00 175.10 175.85 3b8m s ASP 156 N 0.28 6.88 0.18 4.85 -1.08 -1.26 -0.04 116.67 126.48 3b8m s ASP 156 Ca -0.07 2.32 0.24 0.00 -0.52 0.00 0.00 52.55 54.53 3b8m s ASP 156 Cb -0.12 -2.59 0.91 0.00 -1.46 0.00 0.00 42.92 39.66 3b8m s ASP 156 CO 0.02 -0.59 1.74 0.47 0.52 0.00 0.00 175.17 177.33 3b8m n ASP 157 N 3.49 0.57 -0.58 -0.34 8.00 -0.68 -3.10 116.55 123.91 3b8m n ASP 157 Ca 0.09 0.59 0.05 0.00 0.71 0.00 0.00 54.79 56.23 3b8m n ASP 157 Cb 0.43 -0.73 0.14 0.00 -0.02 0.00 0.00 41.12 40.94 3b8m n ASP 157 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3b8m n ASN 158 N -2.07 2.86 0.03 -2.24 3.02 -1.26 -4.33 115.26 111.27 3b8m n ASN 158 Ca 0.04 -2.02 -0.10 0.00 -0.03 0.00 0.00 54.58 52.47 3b8m n ASN 158 Cb 0.32 -0.22 -0.07 0.00 -0.61 0.00 0.00 39.78 39.20 3b8m n ASN 158 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3b8m h ALA 159 N 1.83 -0.18 -2.44 5.41 0.00 -1.91 -3.41 119.26 118.56 3b8m h ALA 159 Ca 0.00 -0.23 -0.54 0.00 0.00 0.00 0.00 54.91 54.15 3b8m h ALA 159 Cb 0.72 0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.59 3b8m h ALA 159 CO 0.00 -0.24 0.78 -1.54 0.00 0.00 0.00 179.25 178.26 3b8m s SER 160 N -5.54 6.86 -0.16 0.00 1.04 -1.26 -3.56 113.70 111.07 3b8m s SER 160 Ca -0.12 2.18 -0.04 0.00 0.48 0.00 0.00 55.95 58.45 3b8m s SER 160 Cb -0.00 -2.57 0.01 0.00 0.10 0.00 0.00 66.02 63.57 3b8m s SER 160 CO 0.43 -0.68 0.08 1.17 0.98 0.00 0.00 173.24 175.21 3b8m n LYS 161 N 4.84 -2.55 0.00 4.02 4.81 -1.26 -4.99 118.16 123.03 3b8m n LYS 161 Ca 0.12 2.16 0.00 0.00 -0.87 0.00 0.00 58.31 59.72 3b8m n LYS 161 Cb 0.43 -3.68 0.00 0.00 0.02 0.00 0.00 35.03 31.80 3b8m n LYS 161 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 3b8m n LYS 162 N 0.74 2.95 -0.55 1.64 5.02 -1.23 -4.82 118.16 121.90 3b8m n LYS 162 Ca -0.13 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.02 3b8m n LYS 162 Cb 0.20 0.00 0.12 0.00 -0.02 0.00 0.00 35.03 35.33 3b8m n LYS 162 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24 3b8m n LYS 163 N 0.00 -1.88 0.00 1.97 -0.00 -1.26 -4.16 118.16 112.83 3b8m n LYS 163 Ca 0.00 -0.86 0.00 0.00 -0.00 0.00 0.00 58.31 57.45 3b8m n LYS 163 Cb 0.00 -0.78 0.00 0.00 -0.00 0.00 0.00 35.03 34.25 3b8m n LYS 163 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 3b8m n ASP 164 N -3.85 0.00 -4.05 -5.58 2.03 -1.26 -4.86 116.55 98.99 3b8m n ASP 164 Ca 0.07 0.00 -0.34 0.00 0.52 0.00 0.00 54.79 55.05 3b8m n ASP 164 Cb 0.28 -0.11 -0.08 0.00 -0.72 0.00 0.00 41.12 40.49 3b8m n ASP 164 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3b8m s GLU 165 N 0.00 2.97 0.98 -0.67 2.02 -1.26 -5.09 118.70 117.66 3b8m s GLU 165 Ca 0.00 -3.23 -0.15 0.00 0.02 0.00 0.00 54.97 51.60 3b8m s GLU 165 Cb 0.00 -3.78 -0.04 0.00 0.10 0.00 0.00 34.13 30.41 3b8m s GLU 165 CO 0.00 -1.26 -0.16 -0.35 0.02 0.00 0.00 175.26 173.51 3b8m n PRO 166 N 2.33 -0.26 -3.69 0.39 -0.04 -1.26 -4.96 135.00 127.50 3b8m n PRO 166 Ca 0.20 -0.05 -0.39 0.00 -0.04 0.00 0.00 63.50 63.22 3b8m n PRO 166 Cb 0.36 -1.49 -0.12 0.00 -0.04 0.00 0.00 33.50 32.22 3b8m n PRO 166 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3b8m s SER 167 N -1.58 5.44 0.25 3.54 1.04 -1.26 -4.98 113.70 116.14 3b8m s SER 167 Ca 0.50 -0.97 -0.05 0.00 0.48 0.00 0.00 55.95 55.91 3b8m s SER 167 Cb -0.18 -1.93 0.47 0.00 0.10 0.00 0.00 66.02 64.48 3b8m s SER 167 CO 0.73 -0.31 1.68 0.25 0.98 0.00 0.00 173.24 176.56 3b8m h LEU 168 N 8.30 -0.03 -8.19 2.42 5.85 -2.07 -3.42 115.31 118.18 3b8m h LEU 168 Ca -0.26 0.15 -0.19 0.00 0.84 0.00 0.00 57.88 58.42 3b8m h LEU 168 Cb 1.10 0.22 -0.18 0.00 0.37 0.00 0.00 40.66 42.17 3b8m h LEU 168 CO 0.63 -0.06 -0.70 -0.72 -0.34 0.00 0.00 178.44 177.24 3b8m s TYR 169 N -6.05 0.55 1.17 1.25 -0.85 -1.26 -5.16 117.35 107.01 3b8m s TYR 169 Ca -0.13 -0.74 -0.19 0.00 -0.52 0.00 0.00 57.07 55.49 3b8m s TYR 169 Cb 0.22 -0.36 0.28 0.00 0.38 0.00 0.00 41.96 42.47 3b8m s TYR 169 CO 0.76 -0.21 1.14 0.99 -1.52 0.00 0.00 175.55 176.71 3b8m s THR 170 N -2.52 1.65 0.00 -3.49 2.01 -1.26 -5.06 115.64 106.97 3b8m s THR 170 Ca -0.03 0.00 0.00 0.00 0.31 0.00 0.00 61.69 61.97 3b8m s THR 170 Cb -0.02 -2.55 0.00 0.00 0.01 0.00 0.00 72.50 69.94 3b8m s THR 170 CO -0.04 0.00 0.00 -1.54 -0.69 0.00 0.00 174.62 172.35 3b8m n SER 171 N -4.64 0.00 -4.28 3.53 3.41 -1.26 -4.72 113.62 105.66 3b8m n SER 171 Ca 0.13 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.53 3b8m n SER 171 Cb 0.59 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.43 3b8m n SER 171 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 3b8m s TRP 172 N -0.25 1.67 -0.26 7.33 0.52 0.48 -1.69 118.94 126.74 3b8m s TRP 172 Ca 0.00 -0.46 -0.07 0.00 0.02 0.00 0.00 56.10 55.59 3b8m s TRP 172 Cb 0.00 -0.88 -0.02 0.00 -1.15 0.00 0.00 33.47 31.42 3b8m s TRP 172 CO 0.00 0.22 0.07 0.99 0.02 0.00 0.00 176.95 178.25 3b8m s THR 173 N -1.62 4.19 -0.08 2.01 2.01 0.95 -0.79 115.64 122.30 3b8m s THR 173 Ca 0.09 -0.32 -0.03 0.00 0.31 0.00 0.00 61.69 61.75 3b8m s THR 173 Cb -0.08 -3.01 -0.04 0.00 0.01 0.00 0.00 72.50 69.39 3b8m s THR 173 CO 0.05 0.28 0.04 -0.76 -0.69 0.00 0.00 174.62 173.53 3b8m s LEU 174 N 1.58 3.79 0.01 4.42 1.43 0.12 -0.86 118.68 129.17 3b8m s LEU 174 Ca 0.06 0.21 -0.18 0.00 -1.03 0.00 0.00 54.13 53.18 3b8m s LEU 174 Cb -0.16 -1.94 0.04 0.00 0.03 0.00 0.00 46.19 44.16 3b8m s LEU 174 CO 0.03 0.37 0.41 -0.94 0.23 0.00 0.00 176.35 176.44 3b8m s SER 175 N -1.05 -0.29 -0.03 2.29 1.04 -0.36 -0.06 113.70 115.24 3b8m s SER 175 Ca 0.15 0.10 0.01 0.00 0.48 0.00 0.00 55.95 56.69 3b8m s SER 175 Cb -0.12 0.40 0.01 0.00 0.10 0.00 0.00 66.02 66.42 3b8m s SER 175 CO 0.04 -0.59 -0.03 0.12 0.98 0.00 0.00 173.24 173.77 3b8m s PHE 176 N -1.96 0.51 -0.17 5.02 5.36 -0.46 -1.67 117.98 124.61 3b8m s PHE 176 Ca -0.09 -0.10 -0.06 0.00 -0.96 0.00 0.00 56.93 55.72 3b8m s PHE 176 Cb -0.02 -0.46 -0.04 0.00 -0.34 0.00 0.00 43.02 42.17 3b8m s PHE 176 CO 0.01 -0.11 0.03 0.99 -1.46 0.00 0.00 175.22 174.68 3b8m s THR 177 N 0.59 4.50 0.11 0.12 2.01 -1.14 0.89 115.64 122.72 3b8m s THR 177 Ca -0.07 -0.14 0.00 0.00 0.31 0.00 0.00 61.69 61.80 3b8m s THR 177 Cb -0.10 -3.01 -0.04 0.00 0.01 0.00 0.00 72.50 69.36 3b8m s THR 177 CO -0.00 0.48 -0.01 0.00 -0.69 0.00 0.00 174.62 174.39 3b8m s ALA 178 N 0.32 0.94 0.21 7.40 0.00 0.75 -4.90 121.76 126.47 3b8m s ALA 178 Ca 0.01 -1.41 -0.19 0.00 0.00 0.00 0.00 51.96 50.37 3b8m s ALA 178 Cb -0.13 0.44 0.18 0.00 0.00 0.00 0.00 23.12 23.61 3b8m s ALA 178 CO 0.01 -0.34 1.57 -1.35 0.00 0.00 0.00 175.76 175.65 3b8m h PRO 179 N 2.92 -0.09 -6.13 0.00 0.11 -1.96 -0.05 132.00 126.80 3b8m h PRO 179 Ca -0.35 0.01 -0.55 0.00 0.11 0.00 0.00 66.00 65.22 3b8m h PRO 179 Cb 1.18 0.02 -0.08 0.00 0.11 0.00 0.00 31.00 32.23 3b8m h PRO 179 CO 0.63 -0.06 -0.57 0.95 -0.21 0.00 0.00 178.00 178.74 3b8m s THR 180 N -5.99 3.24 0.04 -1.15 -4.23 -1.26 -4.57 115.64 101.72 3b8m s THR 180 Ca -0.14 -1.76 -0.28 0.00 -1.18 0.00 0.00 61.69 58.33 3b8m s THR 180 Cb 0.18 -2.96 -0.17 0.00 1.34 0.00 0.00 72.50 70.89 3b8m s THR 180 CO 0.70 -0.26 1.41 -1.28 -0.54 0.00 0.00 174.62 174.66 3b8m h SER 181 N 1.66 -0.50 -0.54 3.99 0.87 -1.89 -2.79 113.55 114.35 3b8m h SER 181 Ca -0.44 -0.07 0.11 0.00 -1.23 0.00 0.00 61.79 60.16 3b8m h SER 181 Cb 1.25 0.13 -0.10 0.00 -0.44 0.00 0.00 62.40 63.24 3b8m h SER 181 CO 0.62 -0.22 -0.14 -0.33 -0.53 0.00 0.00 176.83 176.23 3b8m h GLU 182 N -0.78 -0.01 -0.28 2.24 5.08 -1.96 -2.73 114.58 116.14 3b8m h GLU 182 Ca -0.06 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.35 3b8m h GLU 182 Cb 0.54 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.75 3b8m h GLU 182 CO 0.10 -0.01 0.00 1.49 -1.00 0.00 0.00 179.01 179.60 3b8m h GLU 183 N -0.01 0.09 -0.40 2.33 4.81 -1.96 -0.81 114.58 118.63 3b8m h GLU 183 Ca 0.26 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.47 3b8m h GLU 183 Cb 0.40 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.74 3b8m h GLU 183 CO -0.56 0.06 0.20 0.00 -0.73 0.00 0.00 179.01 177.98 3b8m h ALA 184 N 1.24 1.60 0.19 2.92 0.00 -1.23 -1.82 119.26 122.16 3b8m h ALA 184 Ca 0.13 -0.08 -0.32 0.00 0.00 0.00 0.00 54.91 54.65 3b8m h ALA 184 Cb 0.17 -0.17 0.02 0.00 0.00 0.00 0.00 17.79 17.82 3b8m h ALA 184 CO -0.22 0.33 -1.45 0.37 0.00 0.00 0.00 179.25 178.28 3b8m h GLN 185 N 0.55 0.40 -0.05 0.00 4.15 -1.13 -2.70 115.11 116.34 3b8m h GLN 185 Ca 0.14 -0.69 -0.10 0.00 0.77 0.00 0.00 58.65 58.77 3b8m h GLN 185 Cb 0.05 0.26 -0.01 0.00 0.21 0.00 0.00 27.48 27.99 3b8m h GLN 185 CO -0.02 1.32 -0.43 1.15 -1.93 0.00 0.00 178.83 178.92 3b8m h THR 186 N 0.11 1.31 0.00 2.39 2.02 -0.91 -2.48 112.91 115.35 3b8m h THR 186 Ca -0.23 -1.52 -0.14 0.00 0.77 0.00 0.00 66.41 65.29 3b8m h THR 186 Cb 2.08 1.75 -0.02 0.00 -1.74 0.00 0.00 68.15 70.22 3b8m h THR 186 CO 0.23 0.44 -0.84 0.58 0.37 0.00 0.00 175.52 176.31 3b8m h VAL 187 N 0.10 0.94 -0.01 3.16 2.07 -1.41 -1.37 116.25 119.73 3b8m h VAL 187 Ca 0.01 -2.41 -0.11 0.00 0.82 0.00 0.00 66.70 65.01 3b8m h VAL 187 Cb 0.80 2.42 0.01 0.00 -1.52 0.00 0.00 31.29 32.99 3b8m h VAL 187 CO 0.06 0.54 -0.41 0.25 0.02 0.00 0.00 177.57 178.03 3b8m h LEU 188 N 0.00 0.38 0.36 2.57 5.85 -1.42 -2.42 115.31 120.62 3b8m h LEU 188 Ca -0.05 -0.75 -0.01 0.00 0.84 0.00 0.00 57.88 57.90 3b8m h LEU 188 Cb 1.52 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 42.44 3b8m h LEU 188 CO 0.07 1.08 -0.20 0.28 -0.34 0.00 0.00 178.44 179.33 3b8m h SER 189 N -0.29 -0.48 -0.32 1.25 0.02 -1.50 -0.40 113.55 111.83 3b8m h SER 189 Ca -0.05 0.02 0.07 0.00 -0.84 0.00 0.00 61.79 61.00 3b8m h SER 189 Cb 1.13 0.14 -0.08 0.00 0.14 0.00 0.00 62.40 63.73 3b8m h SER 189 CO 0.08 -0.32 -0.25 1.23 -1.14 0.00 0.00 176.83 176.43 3b8m h GLY 190 N -0.52 -0.11 1.01 -3.77 0.00 -1.35 0.57 103.07 98.90 3b8m h GLY 190 Ca -0.04 0.31 -0.03 0.00 0.00 0.00 0.00 47.33 47.57 3b8m h GLY 190 CO 0.06 -0.20 0.31 -1.82 0.00 0.00 0.00 176.54 174.89 3b8m h TYR 191 N -0.22 0.98 0.25 5.60 3.20 -1.29 -1.15 116.97 124.34 3b8m h TYR 191 Ca 0.16 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.98 3b8m h TYR 191 Cb 0.47 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 3b8m h TYR 191 CO -0.44 0.74 -0.22 0.82 -1.64 0.00 0.00 178.16 177.42 3b8m h ILE 192 N 0.94 0.52 -0.43 1.81 2.04 -0.34 -0.49 117.51 121.56 3b8m h ILE 192 Ca 0.23 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.11 3b8m h ILE 192 Cb 0.14 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 3b8m h ILE 192 CO -0.03 0.00 0.29 0.44 0.00 0.00 0.00 178.15 178.85 3b8m h ASP 193 N -0.49 0.45 0.52 1.72 3.32 -0.66 0.27 116.42 121.54 3b8m h ASP 193 Ca -0.01 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 3b8m h ASP 193 Cb 0.45 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 39.90 3b8m h ASP 193 CO -0.04 0.31 -0.25 0.22 -1.72 0.00 0.00 179.24 177.77 3b8m h TYR 194 N 0.52 -0.65 -0.90 4.55 3.20 -0.81 -2.00 116.97 120.88 3b8m h TYR 194 Ca 0.17 -0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.09 3b8m h TYR 194 Cb 0.03 0.22 -0.07 0.00 1.54 0.00 0.00 36.73 38.45 3b8m h TYR 194 CO -0.00 -0.33 0.56 0.82 -1.64 0.00 0.00 178.16 177.57 3b8m h ILE 195 N -0.95 1.03 -0.50 1.81 1.08 -0.62 -2.47 117.51 116.89 3b8m h ILE 195 Ca -0.07 -0.34 0.03 0.00 -0.39 0.00 0.00 64.86 64.09 3b8m h ILE 195 Cb 0.62 -0.06 -0.04 0.00 -3.07 0.00 0.00 36.82 34.27 3b8m h ILE 195 CO 0.12 0.18 0.28 -1.28 -0.69 0.00 0.00 178.15 176.76 3b8m h SER 196 N 1.00 0.43 -0.61 1.72 0.87 -0.42 -1.01 113.55 115.53 3b8m h SER 196 Ca 0.40 0.01 0.04 0.00 -1.23 0.00 0.00 61.79 61.02 3b8m h SER 196 Cb 0.22 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.07 3b8m h SER 196 CO -0.19 0.30 0.40 0.00 -0.53 0.00 0.00 176.83 176.82 3b8m h ALA 197 N 1.24 1.71 -0.66 6.23 0.00 -0.93 -0.30 119.26 126.56 3b8m h ALA 197 Ca 0.21 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 3b8m h ALA 197 Cb 0.07 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 3b8m h ALA 197 CO -0.12 0.22 0.17 -0.07 0.00 0.00 0.00 179.25 179.45 3b8m h LEU 198 N 0.69 0.97 -0.12 0.00 4.07 -0.82 -0.06 115.31 120.04 3b8m h LEU 198 Ca 0.25 -0.19 -0.04 0.00 0.08 0.00 0.00 57.88 57.98 3b8m h LEU 198 Cb 0.13 -0.25 -0.00 0.00 1.08 0.00 0.00 40.66 41.61 3b8m h LEU 198 CO -0.07 0.93 -0.07 0.58 -1.08 0.00 0.00 178.44 178.72 3b8m h VAL 199 N 0.98 1.33 -0.18 1.22 2.07 -0.19 -2.20 116.25 119.28 3b8m h VAL 199 Ca 0.21 -1.14 0.04 0.00 0.82 0.00 0.00 66.70 66.63 3b8m h VAL 199 Cb 0.33 1.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.91 3b8m h VAL 199 CO -0.00 0.33 -0.06 0.58 0.02 0.00 0.00 177.57 178.44 3b8m h VAL 200 N -0.11 0.79 -0.34 2.57 2.07 -1.01 0.13 116.25 120.34 3b8m h VAL 200 Ca 0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.58 3b8m h VAL 200 Cb 0.55 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 3b8m h VAL 200 CO 0.02 0.00 0.13 0.50 0.02 0.00 0.00 177.57 178.24 3b8m h LYS 201 N -0.02 0.27 -0.24 1.57 3.64 -0.97 -1.56 116.57 119.25 3b8m h LYS 201 Ca 0.09 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.33 3b8m h LYS 201 Cb 0.16 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 3b8m h LYS 201 CO -0.20 0.18 -0.39 0.93 -2.27 0.00 0.00 179.45 177.69 3b8m h GLU 202 N 0.27 0.55 -0.47 1.90 5.08 -1.11 -1.61 114.58 119.20 3b8m h GLU 202 Ca 0.15 -0.28 -0.13 0.00 -1.00 0.00 0.00 59.36 58.11 3b8m h GLU 202 Cb 0.12 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.36 3b8m h GLU 202 CO -0.15 0.86 -0.22 0.77 -1.00 0.00 0.00 179.01 179.26 3b8m h SER 203 N 0.46 0.99 -0.62 1.42 0.02 -0.38 -0.89 113.55 114.54 3b8m h SER 203 Ca 0.04 -0.37 -0.09 0.00 -0.84 0.00 0.00 61.79 60.53 3b8m h SER 203 Cb 0.88 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.13 3b8m h SER 203 CO 0.08 1.16 0.05 0.40 -1.14 0.00 0.00 176.83 177.38 3b8m h ILE 204 N 0.83 1.26 -0.37 3.27 5.03 -1.23 -2.60 117.51 123.69 3b8m h ILE 204 Ca 0.11 -1.09 0.08 0.00 -0.12 0.00 0.00 64.86 63.83 3b8m h ILE 204 Cb 0.79 0.75 -0.07 0.00 -3.03 0.00 0.00 36.82 35.26 3b8m h ILE 204 CO 0.07 0.40 -0.10 -0.08 -0.68 0.00 0.00 178.15 177.76 3b8m h GLU 205 N 0.97 -0.01 -0.57 2.37 4.81 -0.78 0.97 114.58 122.35 3b8m h GLU 205 Ca 0.18 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.47 3b8m h GLU 205 Cb 0.50 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.83 3b8m h GLU 205 CO 0.02 -0.00 0.28 -0.91 -0.73 0.00 0.00 179.01 177.67 3b8m h ASN 206 N -0.01 0.38 0.16 1.04 -0.26 -1.02 0.22 115.58 116.09 3b8m h ASN 206 Ca 0.18 0.04 -0.01 0.00 -0.56 0.00 0.00 56.30 55.95 3b8m h ASN 206 Cb 0.28 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 37.51 3b8m h ASN 206 CO -0.39 0.25 -0.08 0.58 -1.06 0.00 0.00 177.43 176.73 3b8m h VAL 207 N 0.52 0.83 -0.90 2.81 2.07 -0.93 -0.15 116.25 120.50 3b8m h VAL 207 Ca 0.26 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.89 3b8m h VAL 207 Cb 0.20 0.83 -0.07 0.00 -1.52 0.00 0.00 31.29 30.73 3b8m h VAL 207 CO -0.19 0.00 0.58 0.03 0.02 0.00 0.00 177.57 178.01 3b8m h ARG 208 N -0.23 0.84 -0.53 1.57 3.08 -0.27 -1.38 114.38 117.47 3b8m h ARG 208 Ca -0.02 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 59.91 3b8m h ARG 208 Cb 0.18 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 3b8m h ARG 208 CO 0.03 0.56 0.06 -0.91 -1.07 0.00 0.00 179.97 178.64 3b8m h ASN 209 N 0.87 0.86 -0.53 7.04 4.21 0.07 -0.93 115.58 127.17 3b8m h ASN 209 Ca 0.43 -0.28 -0.02 0.00 1.21 0.00 0.00 56.30 57.64 3b8m h ASN 209 Cb 0.46 -0.23 -0.03 0.00 -1.12 0.00 0.00 38.32 37.41 3b8m h ASN 209 CO -0.19 0.92 0.28 0.11 -1.29 0.00 0.00 177.43 177.26 3b8m h LYS 210 N 0.77 0.79 -0.38 0.81 1.57 -0.01 -1.12 116.57 119.01 3b8m h LYS 210 Ca 0.16 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 3b8m h LYS 210 Cb 0.44 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 3b8m h LYS 210 CO 0.02 0.61 0.04 1.25 -0.57 0.00 0.00 179.45 180.79 3b8m h LEU 211 N 0.79 0.63 -0.35 2.94 5.85 -1.01 -0.79 115.31 123.38 3b8m h LEU 211 Ca 0.20 -0.28 0.06 0.00 0.84 0.00 0.00 57.88 58.69 3b8m h LEU 211 Cb 0.08 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 40.89 3b8m h LEU 211 CO -0.03 0.75 0.04 -0.08 -0.34 0.00 0.00 178.44 178.79 3b8m h GLU 212 N 0.49 0.14 -0.30 1.25 4.81 -0.32 -0.35 114.58 120.30 3b8m h GLU 212 Ca 0.11 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.29 3b8m h GLU 212 Cb 0.41 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 3b8m h GLU 212 CO 0.01 0.09 -0.01 0.82 -0.73 0.00 0.00 179.01 179.20 3b8m h ILE 213 N 0.15 1.26 -0.44 2.32 1.08 -1.13 0.31 117.51 121.05 3b8m h ILE 213 Ca 0.17 -0.96 0.06 0.00 -0.39 0.00 0.00 64.86 63.74 3b8m h ILE 213 Cb 0.21 1.29 -0.05 0.00 -3.07 0.00 0.00 36.82 35.20 3b8m h ILE 213 CO -0.25 0.31 0.14 0.50 -0.69 0.00 0.00 178.15 178.16 3b8m h LYS 214 N 0.32 0.29 -0.17 2.37 1.63 -0.88 0.15 116.57 120.28 3b8m h LYS 214 Ca 0.08 -0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.85 3b8m h LYS 214 Cb 0.45 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.00 3b8m h LYS 214 CO 0.02 0.19 0.05 1.15 -3.45 0.00 0.00 179.45 177.41 3b8m h THR 215 N 0.30 1.18 -0.55 1.00 2.02 -0.78 -1.07 112.91 115.00 3b8m h THR 215 Ca 0.21 -0.57 0.08 0.00 0.77 0.00 0.00 66.41 66.89 3b8m h THR 215 Cb 0.23 1.24 -0.06 0.00 -1.74 0.00 0.00 68.15 67.81 3b8m h THR 215 CO -0.23 0.18 0.21 -0.61 0.37 0.00 0.00 175.52 175.44 3b8m h GLN 216 N 0.11 0.39 0.43 6.66 4.15 -0.59 -1.51 115.11 124.75 3b8m h GLN 216 Ca 0.06 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.43 3b8m h GLN 216 Cb 0.23 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 27.83 3b8m h GLN 216 CO -0.00 0.26 -0.21 0.35 -1.93 0.00 0.00 178.83 177.30 3b8m h PHE 217 N 0.40 -0.53 -0.69 3.99 3.57 -0.64 -1.32 116.94 121.72 3b8m h PHE 217 Ca 0.27 -0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.73 3b8m h PHE 217 Cb 0.30 0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.18 3b8m h PHE 217 CO -0.16 -0.28 0.32 0.93 -2.23 0.00 0.00 178.31 176.90 3b8m h GLU 218 N -0.68 1.00 -0.44 1.11 4.39 -1.02 0.11 114.58 119.05 3b8m h GLU 218 Ca -0.06 -0.15 0.01 0.00 0.34 0.00 0.00 59.36 59.50 3b8m h GLU 218 Cb 0.50 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 3b8m h GLU 218 CO 0.10 0.80 0.29 -0.22 -1.16 0.00 0.00 179.01 178.81 3b8m h LYS 219 N 0.96 0.57 -0.20 2.33 3.64 -1.22 -0.78 116.57 121.86 3b8m h LYS 219 Ca 0.24 -0.03 -0.06 0.00 -1.27 0.00 0.00 60.65 59.53 3b8m h LYS 219 Cb 0.13 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 3b8m h LYS 219 CO -0.03 0.38 -0.09 0.93 -2.27 0.00 0.00 179.45 178.37 3b8m h GLU 220 N 0.59 0.42 -0.72 1.90 5.08 -0.78 -2.77 114.58 118.29 3b8m h GLU 220 Ca 0.16 -0.18 0.05 0.00 -1.00 0.00 0.00 59.36 58.39 3b8m h GLU 220 Cb -0.06 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.14 3b8m h GLU 220 CO -0.04 0.71 0.48 0.87 -1.00 0.00 0.00 179.01 180.02 3b8m h LYS 221 N 0.12 0.81 -0.40 2.33 1.79 -0.54 -2.04 116.57 118.64 3b8m h LYS 221 Ca 0.05 -0.05 -0.03 0.00 -2.18 0.00 0.00 60.65 58.44 3b8m h LYS 221 Cb 0.58 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 31.03 3b8m h LYS 221 CO 0.03 0.53 0.13 1.25 -1.08 0.00 0.00 179.45 180.31 3b8m h LEU 222 N 0.83 0.59 -0.79 2.94 5.85 -1.12 0.11 115.31 123.71 3b8m h LEU 222 Ca 0.30 -0.20 0.04 0.00 0.84 0.00 0.00 57.88 58.85 3b8m h LEU 222 Cb 0.13 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 40.96 3b8m h LEU 222 CO -0.09 0.63 0.50 0.00 -0.34 0.00 0.00 178.44 179.14 3b8m h ALA 223 N 0.98 1.05 -0.15 1.25 0.00 -1.09 -0.22 119.26 121.07 3b8m h ALA 223 Ca 0.13 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.99 3b8m h ALA 223 Cb 0.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3b8m h ALA 223 CO -0.00 0.29 -0.00 0.37 0.00 0.00 0.00 179.25 179.91 3b8m h GLN 224 N 0.96 0.27 -0.86 0.00 4.15 -1.22 -2.45 115.11 115.97 3b8m h GLN 224 Ca 0.32 -0.09 0.02 0.00 0.77 0.00 0.00 58.65 59.68 3b8m h GLN 224 Cb 0.05 -0.02 -0.05 0.00 0.21 0.00 0.00 27.48 27.67 3b8m h GLN 224 CO -0.13 0.50 0.56 -0.44 -1.93 0.00 0.00 178.83 177.39 3b8m h ASP 225 N 0.01 0.94 -0.47 -0.69 3.32 -0.15 0.18 116.42 119.56 3b8m h ASP 225 Ca 0.04 -0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.09 3b8m h ASP 225 Cb 0.38 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 3b8m h ASP 225 CO 0.01 0.66 0.31 0.03 -1.72 0.00 0.00 179.24 178.52 3b8m h ARG 226 N 1.10 0.61 -0.40 3.56 3.08 -0.96 -0.98 114.38 120.40 3b8m h ARG 226 Ca 0.33 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 60.25 3b8m h ARG 226 Cb -0.05 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.85 3b8m h ARG 226 CO -0.10 0.40 -0.12 0.82 -1.07 0.00 0.00 179.97 179.90 3b8m h ILE 227 N 0.62 1.25 -0.05 2.04 2.04 -0.88 -1.50 117.51 121.03 3b8m h ILE 227 Ca 0.18 -1.15 -0.02 0.00 1.00 0.00 0.00 64.86 64.86 3b8m h ILE 227 Cb -0.06 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.10 3b8m h ILE 227 CO -0.05 0.39 -0.08 0.11 0.00 0.00 0.00 178.15 178.52 3b8m h LYS 228 N 0.64 0.08 0.10 2.37 1.57 -0.03 -1.25 116.57 120.04 3b8m h LYS 228 Ca 0.11 -0.01 -0.31 0.00 -1.87 0.00 0.00 60.65 58.57 3b8m h LYS 228 Cb 0.58 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.86 3b8m h LYS 228 CO 0.04 0.17 -1.60 0.52 -0.57 0.00 0.00 179.45 178.00 3b8m h MET 229 N 0.08 0.20 -0.69 3.15 2.86 -0.80 -2.09 114.93 117.64 3b8m h MET 229 Ca 0.02 -0.35 0.05 0.00 -2.06 0.00 0.00 59.70 57.36 3b8m h MET 229 Cb 0.19 0.13 -0.05 0.00 0.06 0.00 0.00 31.60 31.93 3b8m h MET 229 CO 0.01 1.03 0.40 -0.22 1.06 0.00 0.00 176.91 179.18 3b8m h LYS 230 N 0.06 0.72 -0.28 1.72 1.63 -1.13 0.44 116.57 119.73 3b8m h LYS 230 Ca -0.27 -0.04 0.03 0.00 -0.85 0.00 0.00 60.65 59.52 3b8m h LYS 230 Cb 2.01 -0.16 -0.03 0.00 -0.60 0.00 0.00 32.23 33.45 3b8m h LYS 230 CO 0.14 0.48 0.09 -0.91 -3.45 0.00 0.00 179.45 175.80 3b8m h ASN 231 N 0.74 0.10 -0.57 4.20 2.35 -1.23 0.85 115.58 122.03 3b8m h ASN 231 Ca 0.30 0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 56.05 3b8m h ASN 231 Cb 0.15 0.02 -0.03 0.00 0.05 0.00 0.00 38.32 38.51 3b8m h ASN 231 CO -0.17 0.09 0.24 -0.61 -1.65 0.00 0.00 177.43 175.33 3b8m h GLN 232 N 0.22 0.89 -0.16 0.81 5.75 -0.81 -1.62 115.11 120.19 3b8m h GLN 232 Ca 0.12 -0.14 -0.15 0.00 -0.15 0.00 0.00 58.65 58.33 3b8m h GLN 232 Cb 0.09 -0.15 -0.01 0.00 1.07 0.00 0.00 27.48 28.48 3b8m h GLN 232 CO -0.13 0.73 -0.52 1.25 -2.65 0.00 0.00 178.83 177.51 3b8m h LEU 233 N 0.87 0.48 -0.31 -2.39 5.85 0.45 -1.62 115.31 118.64 3b8m h LEU 233 Ca 0.21 -0.25 -0.13 0.00 0.84 0.00 0.00 57.88 58.54 3b8m h LEU 233 Cb 0.18 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.07 3b8m h LEU 233 CO -0.02 0.92 -0.33 0.44 -0.34 0.00 0.00 178.44 179.11 3b8m h ASP 234 N 0.34 0.83 -0.73 1.25 3.32 -0.32 -1.00 116.42 120.12 3b8m h ASP 234 Ca 0.01 -0.48 0.10 0.00 0.02 0.00 0.00 57.03 56.69 3b8m h ASP 234 Cb 1.03 -0.24 -0.08 0.00 0.22 0.00 0.00 39.33 40.27 3b8m h ASP 234 CO 0.09 1.14 0.36 0.00 -1.72 0.00 0.00 179.24 179.11 3b8m h ALA 235 N 0.72 1.02 -0.38 3.45 0.00 -1.25 -2.38 119.26 120.44 3b8m h ALA 235 Ca 0.05 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 3b8m h ALA 235 Cb 0.91 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 3b8m h ALA 235 CO 0.08 -0.06 -0.06 -0.91 0.00 0.00 0.00 179.25 178.30 3b8m h ASN 236 N 0.59 0.62 -0.41 0.00 2.35 -0.68 -2.12 115.58 115.94 3b8m h ASN 236 Ca 0.37 -0.15 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 3b8m h ASN 236 Cb 0.42 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 3b8m h ASN 236 CO -0.29 0.72 0.20 0.40 -1.65 0.00 0.00 177.43 176.81 3b8m h ILE 237 N 0.60 1.17 -0.45 2.81 2.04 -0.76 0.94 117.51 123.85 3b8m h ILE 237 Ca 0.12 -0.48 0.05 0.00 1.00 0.00 0.00 64.86 65.54 3b8m h ILE 237 Cb 0.46 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 37.24 3b8m h ILE 237 CO 0.02 0.18 0.19 1.56 0.00 0.00 0.00 178.15 180.11 3b8m h GLN 238 N 0.52 0.38 -0.82 2.37 1.08 -1.20 -0.07 115.11 117.36 3b8m h GLN 238 Ca 0.14 -0.02 -0.01 0.00 -1.45 0.00 0.00 58.65 57.30 3b8m h GLN 238 Cb 0.11 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.42 3b8m h GLN 238 CO -0.02 0.25 0.46 -0.09 -0.95 0.00 0.00 178.83 178.48 3b8m h ARG 239 N 0.39 1.13 -0.17 1.46 2.43 -0.93 -1.92 114.38 116.77 3b8m h ARG 239 Ca 0.21 -0.12 -0.14 0.00 -0.81 0.00 0.00 59.98 59.12 3b8m h ARG 239 Cb 0.16 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 29.48 3b8m h ARG 239 CO -0.18 0.82 -0.48 1.25 -1.51 0.00 0.00 179.97 179.88 3b8m h LEU 240 N 1.14 0.49 -0.57 3.80 5.85 -0.30 0.20 115.31 125.92 3b8m h LEU 240 Ca 0.29 -0.23 0.01 0.00 0.84 0.00 0.00 57.88 58.79 3b8m h LEU 240 Cb 0.01 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 3b8m h LEU 240 CO -0.05 0.89 0.37 0.78 -0.34 0.00 0.00 178.44 180.09 3b8m h ASN 241 N 0.36 0.62 -0.29 1.25 2.35 -0.28 -1.03 115.58 118.56 3b8m h ASN 241 Ca 0.02 -0.01 -0.16 0.00 -0.55 0.00 0.00 56.30 55.60 3b8m h ASN 241 Cb 0.97 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.19 3b8m h ASN 241 CO 0.08 0.45 -0.41 1.88 -1.65 0.00 0.00 177.43 177.78 3b8m h TYR 242 N 0.74 1.02 -0.82 1.19 0.05 -0.80 -2.20 116.97 116.15 3b8m h TYR 242 Ca 0.22 -0.31 0.14 0.00 0.05 0.00 0.00 58.73 58.82 3b8m h TYR 242 Cb -0.05 -0.21 -0.06 0.00 1.01 0.00 0.00 36.73 37.42 3b8m h TYR 242 CO -0.04 1.11 0.54 0.77 -1.05 0.00 0.00 178.16 179.49 3b8m h SER 243 N 0.69 0.56 -0.40 3.88 0.02 -0.24 -0.63 113.55 117.43 3b8m h SER 243 Ca 0.05 0.03 -0.13 0.00 -0.84 0.00 0.00 61.79 60.90 3b8m h SER 243 Cb 0.99 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 3b8m h SER 243 CO 0.10 0.30 -0.25 0.25 -1.14 0.00 0.00 176.83 176.08 3b8m h LEU 244 N 0.60 0.91 -0.34 5.07 5.85 -0.58 0.20 115.31 127.02 3b8m h LEU 244 Ca 0.40 -0.42 -0.06 0.00 0.84 0.00 0.00 57.88 58.64 3b8m h LEU 244 Cb 0.71 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 3b8m h LEU 244 CO -0.16 1.14 -0.01 0.44 -0.34 0.00 0.00 178.44 179.50 3b8m h ASP 245 N 0.69 0.60 0.08 1.25 3.32 -0.95 -1.79 116.42 119.62 3b8m h ASP 245 Ca 0.08 -0.32 -0.00 0.00 0.02 0.00 0.00 57.03 56.81 3b8m h ASP 245 Cb 0.82 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 40.21 3b8m h ASP 245 CO 0.07 0.78 -0.04 0.40 -1.72 0.00 0.00 179.24 178.73 3b8m h ILE 246 N 0.42 0.99 -0.70 0.35 2.04 -1.03 -0.28 117.51 119.29 3b8m h ILE 246 Ca 0.10 -0.23 0.08 0.00 1.00 0.00 0.00 64.86 65.80 3b8m h ILE 246 Cb 0.47 1.14 -0.07 0.00 -0.74 0.00 0.00 36.82 37.63 3b8m h ILE 246 CO 0.02 0.06 0.37 0.00 0.00 0.00 0.00 178.15 178.59 3b8m h ALA 247 N 0.70 0.96 -0.41 1.87 0.00 -0.88 0.96 119.26 122.45 3b8m h ALA 247 Ca -0.01 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.95 3b8m h ALA 247 Cb 0.18 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 3b8m h ALA 247 CO 0.02 -0.00 0.25 -0.91 0.00 0.00 0.00 179.25 178.60 3b8m h ASN 248 N 0.64 0.41 -0.85 0.00 2.35 -1.03 -0.08 115.58 117.02 3b8m h ASN 248 Ca 0.33 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 56.07 3b8m h ASN 248 Cb 0.30 -0.09 -0.04 0.00 0.05 0.00 0.00 38.32 38.54 3b8m h ASN 248 CO -0.24 0.29 0.48 0.00 -1.65 0.00 0.00 177.43 176.32 3b8m h ALA 249 N 1.18 1.23 -0.00 -0.83 0.00 0.35 -2.02 119.26 119.16 3b8m h ALA 249 Ca 0.16 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3b8m h ALA 249 Cb -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.44 3b8m h ALA 249 CO -0.07 0.63 -0.07 0.00 0.00 0.00 0.00 179.25 179.75 3b8m n ALA 250 N -2.41 2.63 -1.40 0.00 0.00 0.19 -4.92 120.51 114.61 3b8m n ALA 250 Ca 0.09 -0.20 -0.04 0.00 0.00 0.00 0.00 53.44 53.29 3b8m n ALA 250 Cb 0.09 -1.41 -0.01 0.00 0.00 0.00 0.00 19.45 18.12 3b8m n ALA 250 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3b8m n GLY 251 N 1.32 0.55 3.43 0.00 0.00 -0.13 -5.00 105.19 105.35 3b8m n GLY 251 Ca 0.13 -0.84 -0.44 0.00 0.00 0.00 0.00 46.02 44.88 3b8m n GLY 251 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3b8m s ILE 252 N -2.17 4.62 -0.27 -0.61 1.01 -0.66 -4.85 121.20 118.27 3b8m s ILE 252 Ca 0.00 -0.55 -0.11 0.00 0.00 0.00 0.00 60.65 59.98 3b8m s ILE 252 Cb 0.00 -4.52 -0.13 0.00 0.01 0.00 0.00 42.46 37.82 3b8m s ILE 252 CO 0.00 -1.18 -0.34 0.29 0.00 0.00 0.00 174.94 173.72 3b8m n LYS 253 N 6.88 0.59 -2.88 2.79 5.02 -1.26 -0.72 118.16 128.58 3b8m n LYS 253 Ca -0.06 0.24 -0.25 0.00 -2.02 0.00 0.00 58.31 56.22 3b8m n LYS 253 Cb 0.44 -1.49 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 3b8m n LYS 253 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3b8m s LYS 254 N -2.51 3.33 0.68 1.97 1.02 -1.26 -1.80 119.74 121.17 3b8m s LYS 254 Ca -0.38 -0.13 -0.17 0.00 0.02 0.00 0.00 55.97 55.31 3b8m s LYS 254 Cb 0.14 -2.48 -0.01 0.00 -0.52 0.00 0.00 37.83 34.96 3b8m s LYS 254 CO 0.50 -0.19 1.06 -2.30 -0.92 0.00 0.00 175.35 173.50 3b8m n PRO 255 N -2.14 0.73 -2.30 -1.68 -0.02 -1.16 -4.25 135.00 124.18 3b8m n PRO 255 Ca -0.00 0.30 -0.41 0.00 -2.02 0.00 0.00 63.50 61.37 3b8m n PRO 255 Cb 0.56 -2.29 -0.03 0.00 -0.02 0.00 0.00 33.50 31.72 3b8m n PRO 255 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3b8m s VAL 256 N -1.65 3.30 -0.45 -1.45 1.01 0.26 -4.91 120.40 116.51 3b8m s VAL 256 Ca 0.77 1.16 0.04 0.00 0.00 0.00 0.00 61.98 63.95 3b8m s VAL 256 Cb -0.37 -3.74 0.43 0.00 0.00 0.00 0.00 36.38 32.70 3b8m s VAL 256 CO 0.47 0.22 1.30 -1.22 0.00 0.00 0.00 175.10 175.86 3b8m n TYR 257 N 1.98 3.14 0.00 5.22 0.53 -1.26 -4.99 117.16 121.77 3b8m n TYR 257 Ca 0.03 -2.73 0.00 0.00 -1.02 0.00 0.00 57.90 54.18 3b8m n TYR 257 Cb 0.44 -0.38 0.00 0.00 -1.03 0.00 0.00 39.34 38.37 3b8m n TYR 257 CO 0.00 0.00 0.00 1.63 -1.02 0.00 0.00 176.86 177.47 3b8m n LYS 264 N -0.59 0.00 -1.05 -0.72 5.02 -1.26 -5.32 118.16 114.24 3b8m n LYS 264 Ca 0.44 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 56.40 3b8m n LYS 264 Cb 0.72 0.00 0.13 0.00 -0.02 0.00 0.00 35.03 35.86 3b8m n LYS 264 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3b8m s ASP 265 N 2.00 3.54 0.19 4.39 -1.08 -1.26 -4.97 116.67 119.48 3b8m s ASP 265 Ca 0.00 2.28 -0.30 0.00 -0.52 0.00 0.00 52.55 54.01 3b8m s ASP 265 Cb 0.00 -2.58 -0.08 0.00 -1.46 0.00 0.00 42.92 38.80 3b8m s ASP 265 CO 0.00 -2.70 1.24 -0.62 0.52 0.00 0.00 175.17 173.61 3b8m s ASP 266 N -2.36 7.02 0.31 -0.34 -1.08 -1.26 -4.94 116.67 114.01 3b8m s ASP 266 Ca 0.71 2.29 0.26 0.00 -0.52 0.00 0.00 52.55 55.29 3b8m s ASP 266 Cb -0.26 -2.61 0.84 0.00 -1.46 0.00 0.00 42.92 39.43 3b8m s ASP 266 CO 0.52 -0.43 1.76 1.55 0.52 0.00 0.00 175.17 179.09 3b8m h PRO 267 N 5.30 0.00 0.02 4.34 0.13 -2.02 -3.33 132.00 136.44 3b8m h PRO 267 Ca -0.45 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.30 3b8m h PRO 267 Cb 1.21 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.28 3b8m h PRO 267 CO 0.75 0.00 -2.40 -0.25 -0.23 0.00 0.00 178.00 175.88 3b8m n ASP 268 N -2.51 1.87 -3.66 1.44 8.00 -1.26 -4.82 116.55 115.61 3b8m n ASP 268 Ca 0.04 -0.07 -0.30 0.00 0.71 0.00 0.00 54.79 55.17 3b8m n ASP 268 Cb 0.38 -0.39 -0.14 0.00 -0.02 0.00 0.00 41.12 40.95 3b8m n ASP 268 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3b8m s PHE 269 N -2.52 1.37 0.32 1.24 0.40 -1.25 -5.01 117.98 112.52 3b8m s PHE 269 Ca -0.31 -1.69 -0.29 0.00 -0.60 0.00 0.00 56.93 54.04 3b8m s PHE 269 Cb 0.08 -1.49 -0.10 0.00 0.51 0.00 0.00 43.02 42.02 3b8m s PHE 269 CO 0.64 -0.85 1.41 0.45 0.70 0.00 0.00 175.22 177.57 3b8m s SER 270 N 1.41 6.60 0.00 1.36 0.15 -1.25 -4.47 113.70 117.50 3b8m s SER 270 Ca 0.12 2.80 0.00 0.00 0.70 0.00 0.00 55.95 59.57 3b8m s SER 270 Cb -0.19 -2.65 0.00 0.00 -1.71 0.00 0.00 66.02 61.47 3b8m s SER 270 CO -0.19 -0.69 0.30 2.30 1.20 0.00 0.00 173.24 176.15 3b8m n ILE 271 N 1.21 0.04 0.26 6.45 -5.35 -1.26 -4.74 119.36 115.98 3b8m n ILE 271 Ca 0.03 -0.07 0.13 0.00 -0.27 0.00 0.00 62.75 62.57 3b8m n ILE 271 Cb 0.40 1.43 0.72 0.00 -1.74 0.00 0.00 39.64 40.45 3b8m n ILE 271 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 3b8m h SER 272 N 0.00 0.00 0.07 7.28 4.64 -1.97 -1.18 113.55 122.39 3b8m h SER 272 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3b8m h SER 272 Cb 0.71 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.80 3b8m h SER 272 CO 0.00 0.12 -0.06 0.25 -0.87 0.00 0.00 176.83 176.27 3b8m h LEU 273 N 0.00 0.00 0.00 5.97 5.85 -1.91 0.77 115.31 125.99 3b8m h LEU 273 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3b8m h LEU 273 Cb 0.36 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.39 3b8m h LEU 273 CO 0.02 0.06 0.00 0.61 -0.34 0.00 0.00 178.44 178.79 3b8m n GLY 274 N -1.31 -0.57 0.26 3.75 0.00 -0.45 -3.00 105.19 103.88 3b8m n GLY 274 Ca -0.03 -1.56 -0.04 0.00 0.00 0.00 0.00 46.02 44.39 3b8m n GLY 274 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3b8m h ALA 275 N 0.00 0.88 -0.84 4.61 0.00 -0.76 -0.06 119.26 123.09 3b8m h ALA 275 Ca 0.00 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.96 3b8m h ALA 275 Cb 0.00 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 17.52 3b8m h ALA 275 CO 0.00 0.17 0.51 -0.44 0.00 0.00 0.00 179.25 179.50 3b8m h ASP 276 N 0.81 0.78 0.12 0.00 3.32 -1.63 0.85 116.42 120.67 3b8m h ASP 276 Ca 0.27 0.03 -0.27 0.00 0.02 0.00 0.00 57.03 57.08 3b8m h ASP 276 Cb 0.03 -0.14 0.02 0.00 0.22 0.00 0.00 39.33 39.46 3b8m h ASP 276 CO -0.11 0.49 -1.10 1.23 -1.72 0.00 0.00 179.24 178.03 3b8m h GLY 277 N 0.91 0.69 0.95 2.75 0.00 -1.62 -3.11 103.07 103.65 3b8m h GLY 277 Ca 0.38 -1.30 -0.01 0.00 0.00 0.00 0.00 47.33 46.40 3b8m h GLY 277 CO -0.19 1.14 0.18 -2.22 0.00 0.00 0.00 176.54 175.45 3b8m h ILE 278 N 0.32 1.15 -0.47 2.60 2.04 -0.63 -0.66 117.51 121.86 3b8m h ILE 278 Ca -0.14 -0.41 0.09 0.00 1.00 0.00 0.00 64.86 65.40 3b8m h ILE 278 Cb 1.75 0.79 -0.10 0.00 -0.74 0.00 0.00 36.82 38.53 3b8m h ILE 278 CO 0.21 0.16 -0.24 -0.33 0.00 0.00 0.00 178.15 177.94 3b8m h GLU 279 N 0.43 -0.14 -0.54 2.37 5.08 -0.84 0.55 114.58 121.49 3b8m h GLU 279 Ca 0.12 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.46 3b8m h GLU 279 Cb 0.09 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.35 3b8m h GLU 279 CO -0.02 -0.09 0.21 -0.09 -1.00 0.00 0.00 179.01 178.02 3b8m h ARG 280 N -0.14 0.81 -0.54 2.33 9.65 -1.45 -1.09 114.38 123.93 3b8m h ARG 280 Ca 0.22 -0.15 0.03 0.00 -1.10 0.00 0.00 59.98 58.98 3b8m h ARG 280 Cb 0.48 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.91 3b8m h ARG 280 CO -0.55 0.71 0.36 -0.22 2.80 0.00 0.00 179.97 183.07 3b8m h LYS 281 N 0.73 0.61 -0.15 0.20 3.64 0.10 -1.58 116.57 120.13 3b8m h LYS 281 Ca 0.18 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.44 3b8m h LYS 281 Cb 0.21 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3b8m h LYS 281 CO -0.01 0.41 -0.22 1.25 -2.27 0.00 0.00 179.45 178.61 3b8m h LEU 282 N 0.63 0.45 -0.82 5.20 5.85 0.83 -1.31 115.31 126.14 3b8m h LEU 282 Ca 0.22 -0.52 0.03 0.00 0.84 0.00 0.00 57.88 58.44 3b8m h LEU 282 Cb 0.08 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 40.94 3b8m h LEU 282 CO -0.06 0.88 0.53 -0.33 -0.34 0.00 0.00 178.44 179.13 3b8m h GLU 283 N 0.03 1.02 -0.26 1.25 5.08 -0.94 -1.60 114.58 119.15 3b8m h GLU 283 Ca 0.02 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.34 3b8m h GLU 283 Cb 0.78 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 3b8m h GLU 283 CO 0.05 0.67 0.11 0.82 -1.00 0.00 0.00 179.01 179.67 3b8m h ILE 284 N 1.05 0.97 -0.04 3.13 2.04 -1.16 -0.94 117.51 122.56 3b8m h ILE 284 Ca 0.32 -0.09 -0.11 0.00 1.00 0.00 0.00 64.86 65.98 3b8m h ILE 284 Cb -0.03 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 3b8m h ILE 284 CO -0.10 0.05 -0.50 -0.33 0.00 0.00 0.00 178.15 177.27 3b8m h GLU 285 N 0.25 0.10 0.00 2.37 5.08 -0.92 -2.25 114.58 119.21 3b8m h GLU 285 Ca 0.11 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 3b8m h GLU 285 Cb 0.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.30 3b8m h GLU 285 CO -0.09 0.58 -0.12 0.87 -1.00 0.00 0.00 179.01 179.24 3b8m h LYS 286 N 0.08 0.00 -0.39 2.33 1.57 -0.98 -2.96 116.57 116.22 3b8m h LYS 286 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3b8m h LYS 286 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 3b8m h LYS 286 CO 0.07 0.12 0.00 0.00 -0.57 0.00 0.00 179.45 179.07 3b8m n ALA 287 N -2.15 2.45 -2.71 3.86 0.00 -0.39 -4.89 120.51 116.68 3b8m n ALA 287 Ca 0.01 -0.78 -0.40 0.00 0.00 0.00 0.00 53.44 52.27 3b8m n ALA 287 Cb 0.44 -0.98 -0.04 0.00 0.00 0.00 0.00 19.45 18.86 3b8m n ALA 287 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3b8m s VAL 288 N -1.48 5.01 -0.01 0.00 1.01 -1.12 -4.94 120.40 118.87 3b8m s VAL 288 Ca 0.33 1.57 -0.03 0.00 0.00 0.00 0.00 61.98 63.84 3b8m s VAL 288 Cb 0.17 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 32.45 3b8m s VAL 288 CO 0.24 0.23 -0.07 0.41 0.00 0.00 0.00 175.10 175.91 3b8m n THR 289 N 3.81 0.63 -3.09 3.92 -1.04 -1.26 -4.93 114.28 112.32 3b8m n THR 289 Ca 0.00 0.25 -0.41 0.00 -2.04 0.00 0.00 64.05 61.85 3b8m n THR 289 Cb 0.51 -1.53 -0.06 0.00 -1.82 0.00 0.00 70.33 67.43 3b8m n THR 289 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3b8m s ASP 290 N -5.24 6.55 0.37 8.00 -1.08 -1.26 -4.91 116.67 119.09 3b8m s ASP 290 Ca -0.06 0.57 0.27 0.00 -0.52 0.00 0.00 52.55 52.81 3b8m s ASP 290 Cb 0.01 -2.34 1.30 0.00 -1.46 0.00 0.00 42.92 40.43 3b8m s ASP 290 CO 0.08 -0.45 1.81 -0.37 0.52 0.00 0.00 175.17 176.76 3b8m h VAL 291 N 5.49 0.00 0.00 1.11 -1.51 -1.93 -1.91 116.25 117.50 3b8m h VAL 291 Ca -0.26 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 65.08 3b8m h VAL 291 Cb 1.12 0.81 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 3b8m h VAL 291 CO 0.80 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 177.14 3b8m h ALA 292 N 2.09 1.00 -0.68 5.19 0.00 -1.91 -3.24 119.26 121.71 3b8m h ALA 292 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.04 3b8m h ALA 292 Cb 0.17 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 17.87 3b8m h ALA 292 CO 0.00 0.00 0.21 1.49 0.00 0.00 0.00 179.25 180.95 3b8m h GLU 293 N 0.00 0.34 -0.37 0.00 4.81 -1.76 -2.15 114.58 115.44 3b8m h GLU 293 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 3b8m h GLU 293 Cb 0.62 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.92 3b8m h GLU 293 CO 0.00 0.22 0.00 1.28 -0.73 0.00 0.00 179.01 179.78 3b8m n LEU 294 N -5.07 3.23 -3.98 1.64 4.77 -1.24 -4.88 117.00 111.47 3b8m n LEU 294 Ca 0.12 -1.59 -0.31 0.00 -0.03 0.00 0.00 56.01 54.20 3b8m n LEU 294 Cb 0.37 -0.24 -0.15 0.00 -2.33 0.00 0.00 43.42 41.06 3b8m n LEU 294 CO 0.18 0.72 -0.37 0.21 -1.33 0.00 0.00 177.39 176.80 3b8m s ASN 295 N -1.26 4.48 0.41 -1.43 3.84 -0.81 -4.97 114.94 115.19 3b8m s ASN 295 Ca 0.34 -1.81 0.16 0.00 0.21 0.00 0.00 52.86 51.75 3b8m s ASN 295 Cb 0.19 -1.44 0.88 0.00 -0.55 0.00 0.00 41.25 40.34 3b8m s ASN 295 CO 0.26 -0.33 1.89 1.23 -2.79 0.00 0.00 177.10 177.37 3b8m h GLY 296 N 7.76 0.00 1.90 1.21 0.00 -1.90 -1.43 103.07 110.60 3b8m h GLY 296 Ca -0.10 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.17 3b8m h GLY 296 CO 0.49 0.00 -0.25 0.83 0.00 0.00 0.00 176.54 177.61 3b8m h GLU 297 N 0.00 0.12 0.04 4.80 5.08 -1.93 -0.76 114.58 121.93 3b8m h GLU 297 Ca -0.00 -0.04 -0.28 0.00 -1.00 0.00 0.00 59.36 58.04 3b8m h GLU 297 Cb 0.55 -0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.81 3b8m h GLU 297 CO 0.04 0.37 -1.11 -0.07 -1.00 0.00 0.00 179.01 177.23 3b8m h LEU 298 N 0.11 0.89 -0.97 1.33 4.07 -1.62 -1.76 115.31 117.36 3b8m h LEU 298 Ca 0.02 -0.75 0.06 0.00 0.08 0.00 0.00 57.88 57.29 3b8m h LEU 298 Cb 0.51 -0.28 -0.07 0.00 1.08 0.00 0.00 40.66 41.91 3b8m h LEU 298 CO 0.04 1.56 0.62 0.03 -1.08 0.00 0.00 178.44 179.60 3b8m h ARG 299 N 0.35 1.10 0.00 1.13 3.08 -1.12 0.34 114.38 119.27 3b8m h ARG 299 Ca -0.15 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 59.79 3b8m h ARG 299 Cb 1.77 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 31.57 3b8m h ARG 299 CO 0.22 0.73 -0.19 -0.91 -1.07 0.00 0.00 179.97 178.75 3b8m h ASN 300 N 1.13 0.00 0.79 7.04 2.35 -1.09 -0.21 115.58 125.60 3b8m h ASN 300 Ca 0.42 0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.96 3b8m h ASN 300 Cb 0.16 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.52 3b8m h ASN 300 CO -0.17 0.19 -0.97 0.03 -1.65 0.00 0.00 177.43 174.85 3b8m h ARG 301 N 0.00 0.10 -0.15 0.81 3.08 -0.56 -2.04 114.38 115.61 3b8m h ARG 301 Ca -0.00 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 3b8m h ARG 301 Cb 1.03 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.12 3b8m h ARG 301 CO 0.02 0.99 0.01 0.37 -1.07 0.00 0.00 179.97 180.29 3b8m h GLN 302 N 0.04 0.27 -0.68 0.04 5.75 -0.38 -2.39 115.11 117.76 3b8m h GLN 302 Ca -0.04 -0.08 0.10 0.00 -0.15 0.00 0.00 58.65 58.48 3b8m h GLN 302 Cb 1.67 -0.03 -0.08 0.00 1.07 0.00 0.00 27.48 30.12 3b8m h GLN 302 CO 0.14 0.48 0.29 -0.92 -2.65 0.00 0.00 178.83 176.17 3b8m h TYR 303 N 0.02 0.51 -0.14 3.99 3.20 -1.06 -0.69 116.97 122.79 3b8m h TYR 303 Ca 0.04 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.95 3b8m h TYR 303 Cb 0.36 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 3b8m h TYR 303 CO 0.03 0.14 0.09 1.25 -1.64 0.00 0.00 178.16 178.03 3b8m h LEU 304 N 0.49 0.15 -1.05 2.82 5.85 -1.16 -0.56 115.31 121.86 3b8m h LEU 304 Ca 0.34 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 59.04 3b8m h LEU 304 Cb 0.42 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.38 3b8m h LEU 304 CO -0.31 0.11 0.41 0.58 -0.34 0.00 0.00 178.44 178.89 3b8m h VAL 305 N 0.19 1.23 -0.19 1.05 2.07 -0.97 0.76 116.25 120.38 3b8m h VAL 305 Ca 0.05 -0.59 0.02 0.00 0.82 0.00 0.00 66.70 67.00 3b8m h VAL 305 Cb -0.02 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 29.94 3b8m h VAL 305 CO -0.02 0.26 0.06 -0.33 0.02 0.00 0.00 177.57 177.57 3b8m h GLU 306 N 1.08 0.15 -0.81 1.57 5.08 -0.57 -1.41 114.58 119.68 3b8m h GLU 306 Ca 0.27 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.58 3b8m h GLU 306 Cb 0.05 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 3b8m h GLU 306 CO -0.04 0.10 0.36 1.96 -1.00 0.00 0.00 179.01 180.39 3b8m h GLN 307 N 0.15 1.18 -0.68 2.33 1.08 -0.32 -1.54 115.11 117.32 3b8m h GLN 307 Ca 0.08 -0.19 -0.05 0.00 -1.45 0.00 0.00 58.65 57.04 3b8m h GLN 307 Cb 0.05 -0.20 -0.03 0.00 -0.05 0.00 0.00 27.48 27.25 3b8m h GLN 307 CO -0.09 0.93 0.23 -0.07 -0.95 0.00 0.00 178.83 178.89 3b8m h LEU 308 N 1.16 0.97 -1.34 1.46 3.38 -0.76 -1.59 115.31 118.59 3b8m h LEU 308 Ca 0.27 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 3b8m h LEU 308 Cb 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.64 3b8m h LEU 308 CO -0.03 0.91 -0.19 0.74 0.09 0.00 0.00 178.44 179.96 3b8m h THR 309 N 0.98 1.20 -0.00 0.22 2.02 -0.76 -2.32 112.91 114.25 3b8m h THR 309 Ca 0.22 -0.91 0.00 0.00 0.77 0.00 0.00 66.41 66.49 3b8m h THR 309 Cb 0.27 1.32 0.00 0.00 -1.74 0.00 0.00 68.15 68.00 3b8m h THR 309 CO -0.01 0.28 -0.46 0.29 0.37 0.00 0.00 175.52 175.99 3b8m n LYS 310 N -4.23 0.07 -2.96 6.66 5.02 -0.62 -4.89 118.16 117.21 3b8m n LYS 310 Ca -0.01 -0.04 -0.37 0.00 -2.02 0.00 0.00 58.31 55.87 3b8m n LYS 310 Cb 0.31 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.76 3b8m n LYS 310 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3b8m s ALA 311 N -2.96 3.33 0.06 7.82 0.00 -0.63 -5.06 121.76 124.33 3b8m s ALA 311 Ca 0.12 0.33 -0.04 0.00 0.00 0.00 0.00 51.96 52.37 3b8m s ALA 311 Cb 0.18 -2.98 -0.03 0.00 0.00 0.00 0.00 23.12 20.29 3b8m s ALA 311 CO 0.68 0.26 0.05 0.54 0.00 0.00 0.00 175.76 177.29 3b8m s ASN 312 N -1.61 0.35 -0.29 0.00 2.20 -1.26 -4.99 114.94 109.34 3b8m s ASN 312 Ca 0.45 -0.86 -0.09 0.00 -0.94 0.00 0.00 52.86 51.43 3b8m s ASN 312 Cb -0.18 0.25 -0.02 0.00 -2.00 0.00 0.00 41.25 39.30 3b8m s ASN 312 CO 0.22 -0.64 0.13 -0.63 -2.94 0.00 0.00 177.10 173.24 3b8m s ILE 313 N -3.84 4.59 0.53 0.54 1.01 -1.26 -5.07 121.20 117.69 3b8m s ILE 313 Ca 0.06 -0.27 -0.18 0.00 0.00 0.00 0.00 60.65 60.26 3b8m s ILE 313 Cb 0.06 -3.26 -0.06 0.00 0.01 0.00 0.00 42.46 39.21 3b8m s ILE 313 CO -0.10 0.18 1.05 0.20 0.00 0.00 0.00 174.94 176.27 3b8m s ASN 314 N 1.63 6.08 -0.46 3.58 0.01 -1.26 -4.90 114.94 119.63 3b8m s ASN 314 Ca 0.05 1.90 -0.26 0.00 -0.71 0.00 0.00 52.86 53.85 3b8m s ASN 314 Cb -0.16 -2.55 -0.06 0.00 0.41 0.00 0.00 41.25 38.88 3b8m s ASN 314 CO 0.06 -0.96 2.35 -1.81 -1.51 0.00 0.00 177.10 175.23 3b8m s ASP 315 N -2.27 4.63 -0.06 -1.22 1.01 -1.26 -4.91 116.67 112.59 3b8m s ASP 315 Ca 0.66 1.17 -0.02 0.00 0.71 0.00 0.00 52.55 55.07 3b8m s ASP 315 Cb -0.17 -2.50 -0.04 0.00 1.01 0.00 0.00 42.92 41.22 3b8m s ASP 315 CO 0.27 -2.72 0.05 -0.69 0.21 0.00 0.00 175.17 172.29 3b8m s VAL 316 N 11.48 4.61 -0.10 -1.27 1.01 -1.26 -5.10 120.40 129.77 3b8m s VAL 316 Ca 0.96 -0.27 -0.01 0.00 0.00 0.00 0.00 61.98 62.67 3b8m s VAL 316 Cb -0.19 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 3b8m s VAL 316 CO 0.27 0.50 -0.07 0.21 0.00 0.00 0.00 175.10 176.02 3b8m s ASN 317 N -1.25 4.63 0.19 3.32 3.84 -1.26 -4.99 114.94 119.42 3b8m s ASN 317 Ca 0.17 -0.08 -0.13 0.00 0.21 0.00 0.00 52.86 53.03 3b8m s ASN 317 Cb -0.12 -1.38 0.01 0.00 -0.55 0.00 0.00 41.25 39.21 3b8m s ASN 317 CO 0.07 0.29 0.41 0.72 -2.79 0.00 0.00 177.10 175.80 3b8m s PHE 318 N -0.38 0.16 -0.15 0.43 -0.12 -1.26 -4.94 117.98 111.72 3b8m s PHE 318 Ca 0.06 -0.51 -0.05 0.00 -0.05 0.00 0.00 56.93 56.38 3b8m s PHE 318 Cb -0.12 0.17 -0.03 0.00 -0.63 0.00 0.00 43.02 42.40 3b8m s PHE 318 CO 0.02 -0.83 0.01 0.99 -0.05 0.00 0.00 175.22 175.36 3b8m s THR 319 N -3.93 4.38 -0.39 -4.49 2.01 -1.26 -4.88 115.64 107.08 3b8m s THR 319 Ca 0.14 -0.19 0.02 0.00 0.31 0.00 0.00 61.69 61.97 3b8m s THR 319 Cb 0.01 -2.92 0.22 0.00 0.01 0.00 0.00 72.50 69.82 3b8m s THR 319 CO -0.01 0.51 1.12 -0.81 -0.69 0.00 0.00 174.62 174.75 3b8m n PRO 320 N 3.13 1.71 -3.73 4.92 -0.04 -1.26 -4.82 135.00 134.91 3b8m n PRO 320 Ca -0.17 -0.94 -0.07 0.00 -0.04 0.00 0.00 63.50 62.28 3b8m n PRO 320 Cb 0.53 -1.51 -0.02 0.00 -0.04 0.00 0.00 33.50 32.46 3b8m n PRO 320 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 3b8m s PHE 321 N -1.22 -0.23 -0.10 0.54 -0.12 -1.26 -3.73 117.98 111.87 3b8m s PHE 321 Ca 0.17 -0.11 0.02 0.00 -0.05 0.00 0.00 56.93 56.97 3b8m s PHE 321 Cb 0.14 0.65 -0.01 0.00 -0.63 0.00 0.00 43.02 43.16 3b8m s PHE 321 CO 0.04 -0.97 -0.17 0.21 -0.05 0.00 0.00 175.22 174.28 3b8m s LYS 322 N -3.59 3.00 0.20 1.99 2.47 0.13 -4.57 119.74 119.37 3b8m s LYS 322 Ca 0.09 -0.76 -0.30 0.00 -1.56 0.00 0.00 55.97 53.44 3b8m s LYS 322 Cb -0.03 -2.44 -0.08 0.00 -1.46 0.00 0.00 37.83 33.82 3b8m s LYS 322 CO 0.01 0.32 1.14 0.71 0.16 0.00 0.00 175.35 177.68 3b8m s TYR 323 N 0.05 3.53 -0.25 4.03 4.12 -1.26 -0.65 117.35 126.91 3b8m s TYR 323 Ca -0.07 1.55 -0.09 0.00 0.02 0.00 0.00 57.07 58.49 3b8m s TYR 323 Cb -0.15 -3.33 -0.16 0.00 -1.52 0.00 0.00 41.96 36.80 3b8m s TYR 323 CO 0.05 -0.81 -0.16 1.04 0.02 0.00 0.00 175.55 175.69 3b8m n GLN 324 N 2.20 0.63 -4.05 -0.62 1.13 0.12 -4.85 117.38 111.94 3b8m n GLN 324 Ca 0.03 0.27 -0.31 0.00 -1.94 0.00 0.00 57.00 55.04 3b8m n GLN 324 Cb 0.45 -1.56 -0.16 0.00 0.11 0.00 0.00 30.24 29.08 3b8m n GLN 324 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 3b8m s LEU 325 N -7.19 2.16 0.38 1.08 2.96 -0.88 -4.94 118.68 112.26 3b8m s LEU 325 Ca -0.34 -0.74 -0.15 0.00 -0.22 0.00 0.00 54.13 52.67 3b8m s LEU 325 Cb 0.11 -1.32 -0.08 0.00 0.50 0.00 0.00 46.19 45.40 3b8m s LEU 325 CO 0.57 -0.08 0.80 -0.94 -1.32 0.00 0.00 176.35 175.38 3b8m s SER 326 N 1.37 6.71 -0.17 3.68 1.04 -1.26 -0.10 113.70 124.97 3b8m s SER 326 Ca 0.02 1.33 -0.38 0.00 0.48 0.00 0.00 55.95 57.39 3b8m s SER 326 Cb -0.15 -2.40 -0.15 0.00 0.10 0.00 0.00 66.02 63.42 3b8m s SER 326 CO -0.10 -0.32 1.70 -2.65 0.98 0.00 0.00 173.24 172.84 3b8m n PRO 327 N -0.80 1.36 -1.60 4.02 -0.02 -1.25 -4.79 135.00 131.92 3b8m n PRO 327 Ca 0.04 0.50 -0.29 0.00 -2.02 0.00 0.00 63.50 61.73 3b8m n PRO 327 Cb 0.54 -2.20 0.14 0.00 -0.02 0.00 0.00 33.50 31.96 3b8m n PRO 327 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 3b8m s SER 328 N 3.03 3.40 -0.35 2.55 1.04 0.11 -4.89 113.70 118.60 3b8m s SER 328 Ca 0.94 0.82 0.03 0.00 0.48 0.00 0.00 55.95 58.23 3b8m s SER 328 Cb -0.98 -1.30 0.10 0.00 0.10 0.00 0.00 66.02 63.95 3b8m s SER 328 CO 0.59 -2.61 0.06 -0.22 0.98 0.00 0.00 173.24 172.05 3b8m s LEU 329 N -6.02 4.80 0.00 2.42 2.96 -1.26 -4.51 118.68 117.06 3b8m s LEU 329 Ca 0.65 -2.13 0.07 0.00 -0.22 0.00 0.00 54.13 52.51 3b8m s LEU 329 Cb -0.12 -1.65 0.43 0.00 0.50 0.00 0.00 46.19 45.34 3b8m s LEU 329 CO 0.53 -0.40 0.89 -0.81 -1.32 0.00 0.00 176.35 175.24