#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b8p s TRP 56 N 0.00 0.36 -0.26 5.64 0.52 -0.43 -0.33 118.94 124.44 3b8p s TRP 56 Ca 0.00 0.02 -0.10 0.00 0.02 0.00 0.00 56.10 56.03 3b8p s TRP 56 Cb 0.00 -0.56 -0.05 0.00 -1.15 0.00 0.00 33.47 31.71 3b8p s TRP 56 CO 0.00 -0.21 0.17 0.95 0.02 0.00 0.00 176.95 177.87 3b8p s THR 57 N 1.66 5.23 0.16 2.01 -4.23 -1.26 -2.37 115.64 116.84 3b8p s THR 57 Ca -0.01 0.14 -0.22 0.00 -1.18 0.00 0.00 61.69 60.42 3b8p s THR 57 Cb -0.13 -3.47 -0.08 0.00 1.34 0.00 0.00 72.50 70.17 3b8p s THR 57 CO -0.03 0.29 0.71 -0.55 -0.54 0.00 0.00 174.62 174.51 3b8p s SER 58 N 1.49 7.22 -0.11 3.99 0.15 0.20 -4.58 113.70 122.06 3b8p s SER 58 Ca 0.07 1.49 0.01 0.00 0.70 0.00 0.00 55.95 58.22 3b8p s SER 58 Cb -0.15 -2.44 0.02 0.00 -1.71 0.00 0.00 66.02 61.73 3b8p s SER 58 CO 0.08 0.17 -0.14 -0.89 1.20 0.00 0.00 173.24 173.67 3b8p s THR 59 N -1.25 1.42 0.20 6.45 2.01 -1.26 -1.37 115.64 121.84 3b8p s THR 59 Ca 0.36 -0.58 0.07 0.00 0.31 0.00 0.00 61.69 61.85 3b8p s THR 59 Cb -0.20 -1.32 -0.04 0.00 0.01 0.00 0.00 72.50 70.95 3b8p s THR 59 CO 0.23 0.43 0.08 0.00 -0.69 0.00 0.00 174.62 174.67 3b8p s ALA 60 N 1.16 3.37 -0.09 7.40 0.00 0.41 -1.84 121.76 132.17 3b8p s ALA 60 Ca -0.03 -1.38 0.04 0.00 0.00 0.00 0.00 51.96 50.58 3b8p s ALA 60 Cb -0.14 -1.12 0.00 0.00 0.00 0.00 0.00 23.12 21.86 3b8p s ALA 60 CO -0.04 0.41 -0.22 0.42 0.00 0.00 0.00 175.76 176.33 3b8p s ILE 61 N -1.91 1.89 0.22 0.00 1.01 -1.26 -0.50 121.20 120.64 3b8p s ILE 61 Ca 0.30 -0.93 0.04 0.00 0.00 0.00 0.00 60.65 60.06 3b8p s ILE 61 Cb -0.09 -1.63 -0.05 0.00 0.01 0.00 0.00 42.46 40.70 3b8p s ILE 61 CO 0.21 0.52 -0.01 0.27 0.00 0.00 0.00 174.94 175.93 3b8p s ILE 62 N 0.33 1.06 0.32 2.92 -4.36 0.12 -0.75 121.20 120.84 3b8p s ILE 62 Ca -0.16 -2.04 -0.09 0.00 -0.26 0.00 0.00 60.65 58.10 3b8p s ILE 62 Cb -0.17 -2.30 0.01 0.00 1.25 0.00 0.00 42.46 41.25 3b8p s ILE 62 CO 0.07 -0.36 0.54 0.28 0.24 0.00 0.00 174.94 175.72 3b8p s THR 63 N -3.40 0.00 0.63 8.37 -1.32 0.30 -1.73 115.64 118.48 3b8p s THR 63 Ca 0.27 -1.41 -0.19 0.00 -1.21 0.00 0.00 61.69 59.16 3b8p s THR 63 Cb 0.05 -2.55 -0.02 0.00 -1.51 0.00 0.00 72.50 68.48 3b8p s THR 63 CO 0.08 0.00 1.30 0.00 -2.21 0.00 0.00 174.62 173.79 3b8p s GLN 64 N -3.21 2.69 0.30 7.08 -2.07 -1.26 -1.03 119.66 122.15 3b8p s GLN 64 Ca 0.25 2.08 -0.29 0.00 -1.82 0.00 0.00 55.36 55.58 3b8p s GLN 64 Cb -0.02 -1.92 -0.10 0.00 -1.09 0.00 0.00 33.01 29.88 3b8p s GLN 64 CO 0.15 -1.50 1.35 -1.25 -1.32 0.00 0.00 175.29 172.72 3b8p s PRO 65 N -3.29 4.32 0.77 9.60 0.04 -1.26 -4.28 135.00 140.91 3b8p s PRO 65 Ca 0.80 2.24 -0.12 0.00 0.04 0.00 0.00 61.00 63.97 3b8p s PRO 65 Cb -0.38 -3.09 0.06 0.00 0.04 0.00 0.00 34.50 31.14 3b8p s PRO 65 CO 0.41 -0.27 1.12 0.16 0.04 0.00 0.00 177.00 178.45 3b8p s ASP 66 N -0.17 4.29 0.26 6.66 3.84 -1.26 -4.78 116.67 125.51 3b8p s ASP 66 Ca 0.53 1.99 -0.05 0.00 -0.00 0.00 0.00 52.55 55.01 3b8p s ASP 66 Cb -0.40 -2.54 0.51 0.00 -1.38 0.00 0.00 42.92 39.10 3b8p s ASP 66 CO 0.50 -2.18 1.62 0.00 -0.00 0.00 0.00 175.17 175.10 3b8p h ALA 67 N -0.94 0.87 -0.52 2.11 0.00 -1.97 -0.02 119.26 118.79 3b8p h ALA 67 Ca -0.45 0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.81 3b8p h ALA 67 Cb 1.25 0.48 -0.09 0.00 0.00 0.00 0.00 17.79 19.42 3b8p h ALA 67 CO 0.50 -0.45 -0.50 0.00 0.00 0.00 0.00 179.25 178.79 3b8p h ALA 68 N 1.79 -0.57 0.00 0.00 0.00 -2.01 -0.10 119.26 118.38 3b8p h ALA 68 Ca 0.46 0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.42 3b8p h ALA 68 Cb 0.84 1.07 0.00 0.00 0.00 0.00 0.00 17.79 19.70 3b8p h ALA 68 CO -0.74 -0.95 0.09 1.96 0.00 0.00 0.00 179.25 179.61 3b8p h GLN 69 N -0.30 0.00 0.00 0.00 4.20 -1.34 -3.18 115.11 114.50 3b8p h GLN 69 Ca 0.13 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.46 3b8p h GLN 69 Cb 0.57 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.30 3b8p h GLN 69 CO -0.66 0.00 -2.06 1.33 -0.67 0.00 0.00 178.83 176.78 3b8p n VAL 70 N -2.96 1.54 0.00 -0.54 0.24 -0.19 -4.13 118.33 112.29 3b8p n VAL 70 Ca -0.03 -0.28 0.00 0.00 -2.04 0.00 0.00 64.34 62.00 3b8p n VAL 70 Cb 0.15 -1.91 0.00 0.00 -1.47 0.00 0.00 33.84 30.61 3b8p n VAL 70 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3b8p n ALA 71 N -3.84 0.00 0.11 2.33 0.00 -0.35 0.13 120.51 118.88 3b8p n ALA 71 Ca -0.45 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 52.87 3b8p n ALA 71 Cb 0.82 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.21 3b8p n ALA 71 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3b8p h THR 72 N 0.00 0.00 -0.93 0.00 1.35 -1.87 0.76 112.91 112.22 3b8p h THR 72 Ca 0.00 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.87 3b8p h THR 72 Cb 0.00 0.00 -0.05 0.00 -1.73 0.00 0.00 68.15 66.37 3b8p h THR 72 CO 0.00 0.00 0.62 0.22 -0.25 0.00 0.00 175.52 176.11 3b8p h TYR 73 N -0.57 1.17 -0.42 4.73 3.20 -0.65 -2.52 116.97 121.90 3b8p h TYR 73 Ca -0.01 0.03 -0.13 0.00 3.14 0.00 0.00 58.73 61.75 3b8p h TYR 73 Cb 0.55 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 38.42 3b8p h TYR 73 CO -0.36 0.73 -0.27 1.15 -1.64 0.00 0.00 178.16 177.78 3b8p h THR 74 N 1.26 1.27 -0.22 1.81 2.02 -1.37 -2.40 112.91 115.29 3b8p h THR 74 Ca 0.34 -1.42 -0.01 0.00 0.77 0.00 0.00 66.41 66.09 3b8p h THR 74 Cb -0.14 1.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 3b8p h THR 74 CO -0.08 0.48 0.08 0.78 0.37 0.00 0.00 175.52 177.16 3b8p h ASN 75 N 0.76 0.31 -0.76 4.18 2.35 -0.67 -2.16 115.58 119.59 3b8p h ASN 75 Ca 0.09 -0.18 0.18 0.00 -0.55 0.00 0.00 56.30 55.84 3b8p h ASN 75 Cb 0.82 -0.08 -0.12 0.00 0.05 0.00 0.00 38.32 38.99 3b8p h ASN 75 CO 0.07 0.40 0.13 0.00 -1.65 0.00 0.00 177.43 176.38 3b8p h ALA 76 N 0.92 0.95 -0.61 -0.83 0.00 -1.35 0.16 119.26 118.50 3b8p h ALA 76 Ca 0.07 0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.15 3b8p h ALA 76 Cb 0.19 0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3b8p h ALA 76 CO -0.00 -0.39 0.25 -0.07 0.00 0.00 0.00 179.25 179.04 3b8p h LEU 77 N 0.20 0.81 0.13 0.00 3.38 -1.01 0.64 115.31 119.45 3b8p h LEU 77 Ca 0.44 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.30 3b8p h LEU 77 Cb 0.78 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.33 3b8p h LEU 77 CO -0.58 0.72 -0.06 0.78 0.09 0.00 0.00 178.44 179.38 3b8p h ASN 78 N 0.88 -0.15 -0.27 -0.43 2.35 -0.30 0.38 115.58 118.04 3b8p h ASN 78 Ca 0.21 -0.21 0.06 0.00 -0.55 0.00 0.00 56.30 55.81 3b8p h ASN 78 Cb 0.16 0.04 -0.08 0.00 0.05 0.00 0.00 38.32 38.49 3b8p h ASN 78 CO -0.02 0.13 -0.29 0.58 -1.65 0.00 0.00 177.43 176.18 3b8p h VAL 79 N -0.43 0.31 0.00 2.81 2.07 -0.60 0.62 116.25 121.03 3b8p h VAL 79 Ca -0.02 0.00 -0.10 0.00 0.82 0.00 0.00 66.70 67.40 3b8p h VAL 79 Cb 0.35 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 3b8p h VAL 79 CO 0.03 0.00 -0.48 -0.07 0.02 0.00 0.00 177.57 177.07 3b8p h LEU 80 N -0.29 0.00 -1.99 2.57 3.38 -0.80 -3.39 115.31 114.80 3b8p h LEU 80 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3b8p h LEU 80 Cb 0.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3b8p h LEU 80 CO -0.43 0.48 0.00 -1.22 0.09 0.00 0.00 178.44 177.36 3b8p n TYR 81 N -3.69 0.00 0.00 1.13 4.02 0.13 -5.07 117.16 113.69 3b8p n TYR 81 Ca -0.01 -0.25 0.00 0.00 -0.01 0.00 0.00 57.90 57.63 3b8p n TYR 81 Cb 0.55 -0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.84 3b8p n TYR 81 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3b8p n GLY 82 N -0.25 3.13 1.08 2.72 0.00 0.21 -1.37 105.19 110.70 3b8p n GLY 82 Ca 0.00 0.24 0.08 0.00 0.00 0.00 0.00 46.02 46.33 3b8p n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3b8p n GLY 83 N 0.00 3.34 0.23 -0.02 0.00 -1.26 -3.77 105.19 103.71 3b8p n GLY 83 Ca 0.00 -0.82 0.07 0.00 0.00 0.00 0.00 46.02 45.27 3b8p n GLY 83 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3b8p n ASN 84 N 0.21 1.26 -4.77 1.61 3.02 -0.47 -4.97 115.26 111.15 3b8p n ASN 84 Ca 0.20 -1.13 -0.40 0.00 -0.03 0.00 0.00 54.58 53.22 3b8p n ASN 84 Cb 0.80 0.65 -0.03 0.00 -0.61 0.00 0.00 39.78 40.59 3b8p n ASN 84 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3b8p s ALA 85 N -1.98 3.44 0.57 5.41 0.00 -1.17 -5.00 121.76 123.03 3b8p s ALA 85 Ca 0.10 1.12 -0.17 0.00 0.00 0.00 0.00 51.96 53.01 3b8p s ALA 85 Cb 0.12 -3.42 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 3b8p s ALA 85 CO 0.44 -0.48 1.07 -1.25 0.00 0.00 0.00 175.76 175.54 3b8p s PRO 86 N -1.73 3.36 0.95 0.00 0.04 -1.26 -5.01 135.00 131.36 3b8p s PRO 86 Ca 0.48 1.30 -0.11 0.00 0.04 0.00 0.00 61.00 62.71 3b8p s PRO 86 Cb -0.37 -2.03 0.13 0.00 0.04 0.00 0.00 34.50 32.27 3b8p s PRO 86 CO 0.48 -0.79 0.89 1.63 0.04 0.00 0.00 177.00 179.26 3b8p n LYS 87 N -1.78 -0.59 0.09 4.56 5.02 -1.26 -4.82 118.16 119.38 3b8p n LYS 87 Ca 0.09 -0.12 -0.13 0.00 -2.02 0.00 0.00 58.31 56.14 3b8p n LYS 87 Cb 0.52 -2.20 -0.08 0.00 -0.02 0.00 0.00 35.03 33.26 3b8p n LYS 87 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 3b8p h ILE 88 N -1.87 0.94 -0.79 -0.18 5.03 -1.97 -2.41 117.51 116.25 3b8p h ILE 88 Ca -0.45 -0.18 0.19 0.00 -0.12 0.00 0.00 64.86 64.30 3b8p h ILE 88 Cb 1.28 1.05 -0.13 0.00 -3.03 0.00 0.00 36.82 36.00 3b8p h ILE 88 CO 0.40 0.04 0.16 0.77 -0.68 0.00 0.00 178.15 178.84 3b8p h SER 89 N -0.23 -0.06 -0.21 1.72 4.64 -2.01 0.22 113.55 117.62 3b8p h SER 89 Ca -0.02 0.17 -0.06 0.00 -0.47 0.00 0.00 61.79 61.42 3b8p h SER 89 Cb 0.19 0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.51 3b8p h SER 89 CO 0.03 -0.11 -0.05 -0.33 -0.87 0.00 0.00 176.83 175.50 3b8p h GLU 90 N 0.22 0.53 -0.49 4.77 5.08 -1.87 -2.15 114.58 120.67 3b8p h GLU 90 Ca 0.46 -0.13 -0.11 0.00 -1.00 0.00 0.00 59.36 58.58 3b8p h GLU 90 Cb 0.85 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.02 3b8p h GLU 90 CO -0.59 0.59 -0.12 0.28 -1.00 0.00 0.00 179.01 178.17 3b8p h VAL 91 N 0.50 1.27 -0.11 3.13 2.07 -0.06 -0.11 116.25 122.94 3b8p h VAL 91 Ca 0.10 -1.27 -0.03 0.00 0.82 0.00 0.00 66.70 66.33 3b8p h VAL 91 Cb 0.40 1.07 -0.00 0.00 -1.52 0.00 0.00 31.29 31.24 3b8p h VAL 91 CO 0.02 0.44 -0.05 1.56 0.02 0.00 0.00 177.57 179.55 3b8p h GLN 92 N 0.80 0.23 -0.66 1.57 4.20 -1.22 -1.59 115.11 118.45 3b8p h GLN 92 Ca 0.12 -0.10 0.13 0.00 0.06 0.00 0.00 58.65 58.87 3b8p h GLN 92 Cb 0.68 -0.01 -0.10 0.00 0.30 0.00 0.00 27.48 28.36 3b8p h GLN 92 CO 0.05 0.58 0.13 0.00 -0.67 0.00 0.00 178.83 178.92 3b8p h ALA 93 N 0.65 0.80 -0.35 3.87 0.00 -1.33 0.15 119.26 123.05 3b8p h ALA 93 Ca 0.03 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3b8p h ALA 93 Cb 0.51 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 3b8p h ALA 93 CO 0.02 -0.33 0.14 -0.97 0.00 0.00 0.00 179.25 178.11 3b8p h ASN 94 N 0.25 0.44 -0.07 0.00 -0.73 -0.57 -1.56 115.58 113.34 3b8p h ASN 94 Ca 0.36 -0.04 -0.06 0.00 1.87 0.00 0.00 56.30 58.43 3b8p h ASN 94 Cb 0.57 -0.11 0.00 0.00 0.27 0.00 0.00 38.32 39.05 3b8p h ASN 94 CO -0.46 0.40 -0.19 -0.26 -0.37 0.00 0.00 177.43 176.54 3b8p h PHE 95 N 0.49 0.33 -0.06 0.67 -1.00 -0.01 -1.38 116.94 115.98 3b8p h PHE 95 Ca 0.12 -0.13 -0.12 0.00 2.81 0.00 0.00 57.97 60.65 3b8p h PHE 95 Cb 0.10 -0.06 -0.01 0.00 3.61 0.00 0.00 35.95 39.59 3b8p h PHE 95 CO 0.00 0.81 -0.53 0.97 -1.61 0.00 0.00 178.31 177.95 3b8p h ILE 96 N -0.25 1.37 0.49 -0.55 6.09 -1.32 -0.64 117.51 122.71 3b8p h ILE 96 Ca -0.00 -1.81 -0.01 0.00 -1.37 0.00 0.00 64.86 61.66 3b8p h ILE 96 Cb 0.81 1.91 -0.02 0.00 0.47 0.00 0.00 36.82 39.99 3b8p h ILE 96 CO 0.04 0.53 -0.48 -1.28 -3.07 0.00 0.00 178.15 173.89 3b8p h SER 97 N 0.13 -1.32 -1.06 2.19 0.87 -1.18 -1.16 113.55 112.03 3b8p h SER 97 Ca 0.00 0.10 0.28 0.00 -1.23 0.00 0.00 61.79 60.94 3b8p h SER 97 Cb 0.98 0.43 -0.09 0.00 -0.44 0.00 0.00 62.40 63.28 3b8p h SER 97 CO 0.08 -0.64 0.69 0.03 -0.53 0.00 0.00 176.83 176.46 3b8p h ARG 98 N -0.97 0.32 0.35 2.24 3.08 -0.42 -0.97 114.38 118.01 3b8p h ARG 98 Ca -0.06 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 3b8p h ARG 98 Cb 0.84 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.82 3b8p h ARG 98 CO -0.05 0.21 -0.17 0.35 -1.07 0.00 0.00 179.97 179.24 3b8p h PHE 99 N 0.33 -0.43 -0.88 3.04 3.57 -0.81 -2.15 116.94 119.61 3b8p h PHE 99 Ca 0.59 -0.01 0.14 0.00 3.53 0.00 0.00 57.97 62.22 3b8p h PHE 99 Cb 1.62 0.14 -0.09 0.00 2.79 0.00 0.00 35.95 40.41 3b8p h PHE 99 CO -0.00 -0.27 0.49 0.66 -2.23 0.00 0.00 178.31 176.96 3b8p h SER 100 N -0.63 0.64 0.02 0.41 4.64 -0.62 0.32 113.55 118.34 3b8p h SER 100 Ca -0.05 0.08 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 3b8p h SER 100 Cb 0.36 -0.03 -0.00 0.00 -0.31 0.00 0.00 62.40 62.41 3b8p h SER 100 CO 0.08 0.29 -0.03 -1.28 -0.87 0.00 0.00 176.83 175.02 3b8p h SER 101 N 0.72 -0.08 -0.20 4.97 0.87 -1.27 -0.45 113.55 118.12 3b8p h SER 101 Ca 0.47 0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 60.90 3b8p h SER 101 Cb 0.61 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.59 3b8p h SER 101 CO -0.33 -0.05 -0.36 0.00 -0.53 0.00 0.00 176.83 175.56 3b8p h ALA 102 N 0.91 0.77 -0.50 6.23 0.00 -0.32 -3.09 119.26 123.26 3b8p h ALA 102 Ca 0.00 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.48 3b8p h ALA 102 Cb 0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3b8p h ALA 102 CO -0.01 0.65 0.28 0.35 0.00 0.00 0.00 179.25 180.52 3b8p h PHE 103 N 0.60 0.66 0.00 0.00 3.57 -0.19 -0.04 116.94 121.54 3b8p h PHE 103 Ca 0.06 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.56 3b8p h PHE 103 Cb 0.89 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.42 3b8p h PHE 103 CO 0.04 0.45 0.00 -1.13 -2.23 0.00 0.00 178.31 175.45 3b8p n SER 104 N -4.42 0.46 0.09 0.41 3.41 -0.20 -2.10 113.62 111.27 3b8p n SER 104 Ca 0.04 0.57 -0.23 0.00 -0.26 0.00 0.00 58.87 58.99 3b8p n SER 104 Cb 0.09 -0.68 -0.15 0.00 -0.26 0.00 0.00 64.21 63.21 3b8p n SER 104 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3b8p h ALA 105 N 2.56 0.10 -0.20 7.33 0.00 -1.05 -2.72 119.26 125.27 3b8p h ALA 105 Ca 0.00 -1.09 0.06 0.00 0.00 0.00 0.00 54.91 53.88 3b8p h ALA 105 Cb 0.51 0.40 -0.06 0.00 0.00 0.00 0.00 17.79 18.64 3b8p h ALA 105 CO 0.00 0.96 -0.21 1.25 0.00 0.00 0.00 179.25 181.25 3b8p h LEU 106 N 0.12 -0.67 -0.90 0.00 6.46 -1.16 -1.55 115.31 117.62 3b8p h LEU 106 Ca -0.33 0.12 0.12 0.00 -0.12 0.00 0.00 57.88 57.67 3b8p h LEU 106 Cb 2.11 0.32 -0.08 0.00 -0.73 0.00 0.00 40.66 42.28 3b8p h LEU 106 CO 0.20 -0.25 0.52 -1.28 -0.62 0.00 0.00 178.44 177.01 3b8p h SER 107 N -0.23 0.73 -0.61 1.25 0.87 -1.45 0.71 113.55 114.82 3b8p h SER 107 Ca 0.12 0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.66 3b8p h SER 107 Cb 0.42 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 3b8p h SER 107 CO -0.34 0.38 0.04 -0.33 -0.53 0.00 0.00 176.83 176.05 3b8p h GLU 108 N 0.82 1.05 -0.50 2.24 4.39 -1.02 -3.11 114.58 118.46 3b8p h GLU 108 Ca 0.45 -0.31 -0.02 0.00 0.34 0.00 0.00 59.36 59.82 3b8p h GLU 108 Cb 0.50 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 3b8p h GLU 108 CO -0.29 1.01 0.25 0.28 -1.16 0.00 0.00 179.01 179.10 3b8p h VAL 109 N 0.95 1.18 0.00 3.13 2.07 -0.61 -1.97 116.25 121.00 3b8p h VAL 109 Ca 0.18 -0.51 0.00 0.00 0.82 0.00 0.00 66.70 67.19 3b8p h VAL 109 Cb 0.51 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 3b8p h VAL 109 CO 0.02 0.20 0.00 -0.07 0.02 0.00 0.00 177.57 177.75 3b8p h LEU 110 N 0.66 0.00 0.00 2.57 3.38 -0.85 -0.02 115.31 121.05 3b8p h LEU 110 Ca 0.17 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 3b8p h LEU 110 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3b8p h LEU 110 CO -0.02 0.00 -1.51 -0.67 0.09 0.00 0.00 178.44 176.33 3b8p n ASP 111 N -2.86 0.52 -3.78 -0.43 2.03 -0.97 -0.83 116.55 110.23 3b8p n ASP 111 Ca -0.00 0.21 -0.42 0.00 0.52 0.00 0.00 54.79 55.10 3b8p n ASP 111 Cb 0.21 0.93 0.01 0.00 -0.72 0.00 0.00 41.12 41.54 3b8p n ASP 111 CO 0.00 0.00 0.00 -3.20 -1.92 0.00 0.00 177.20 172.08 3b8p n ASN 112 N -2.59 6.81 -3.87 1.67 4.05 -0.02 -4.76 115.26 116.54 3b8p n ASN 112 Ca -0.06 -3.42 -0.09 0.00 0.45 0.00 0.00 54.58 51.46 3b8p n ASN 112 Cb 0.66 -1.28 -0.05 0.00 1.23 0.00 0.00 39.78 40.34 3b8p n ASN 112 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3b8p s GLN 113 N -2.61 1.41 0.01 1.20 -2.07 -1.26 -4.94 119.66 111.40 3b8p s GLN 113 Ca 0.39 -1.06 -0.04 0.00 -1.82 0.00 0.00 55.36 52.83 3b8p s GLN 113 Cb 0.13 0.48 -0.02 0.00 -1.09 0.00 0.00 33.01 32.51 3b8p s GLN 113 CO -0.02 -0.59 1.06 1.57 -1.32 0.00 0.00 175.29 176.00 3b8p h LYS 114 N 2.27 -0.09 -5.21 9.60 2.10 -1.95 -3.22 116.57 120.07 3b8p h LYS 114 Ca -0.28 0.01 -0.66 0.00 -2.00 0.00 0.00 60.65 57.72 3b8p h LYS 114 Cb 1.25 0.02 -0.16 0.00 -0.90 0.00 0.00 32.23 32.44 3b8p h LYS 114 CO 0.38 -0.06 0.62 -1.83 -2.00 0.00 0.00 179.45 176.56 3b8p s GLU 115 N -3.30 3.30 0.45 0.07 -1.05 -1.26 -5.01 118.70 111.90 3b8p s GLU 115 Ca -0.02 -1.25 -0.23 0.00 -0.15 0.00 0.00 54.97 53.32 3b8p s GLU 115 Cb 0.01 -4.51 -0.08 0.00 -0.44 0.00 0.00 34.13 29.11 3b8p s GLU 115 CO 0.06 -1.78 1.16 -0.98 0.95 0.00 0.00 175.26 174.68 3b8p s ARG 116 N 3.39 3.83 0.01 -4.83 1.70 -1.22 -5.00 118.95 116.84 3b8p s ARG 116 Ca 0.25 1.77 0.06 0.00 -0.47 0.00 0.00 55.73 57.34 3b8p s ARG 116 Cb -0.13 -2.46 -0.02 0.00 -0.57 0.00 0.00 34.95 31.77 3b8p s ARG 116 CO 0.02 -0.49 -0.19 -1.21 -1.08 0.00 0.00 175.30 172.35 3b8p s GLU 117 N -2.62 1.45 -0.54 3.89 2.02 -0.01 -5.01 118.70 117.88 3b8p s GLU 117 Ca 0.62 -0.79 -0.12 0.00 0.02 0.00 0.00 54.97 54.70 3b8p s GLU 117 Cb -0.28 -1.47 0.13 0.00 0.10 0.00 0.00 34.13 32.61 3b8p s GLU 117 CO 0.35 0.39 0.45 -1.59 0.02 0.00 0.00 175.26 174.88 3b8p s LYS 118 N -0.77 2.79 0.06 1.61 0.00 -1.26 -3.84 119.74 118.33 3b8p s LYS 118 Ca 0.07 -1.83 0.00 0.00 0.00 0.00 0.00 55.97 54.21 3b8p s LYS 118 Cb -0.08 -4.12 -0.04 0.00 0.00 0.00 0.00 37.83 33.59 3b8p s LYS 118 CO 0.00 -1.26 0.18 -1.17 0.00 0.00 0.00 175.35 173.11 3b8p s LEU 119 N 1.30 4.25 -0.07 2.77 0.20 -1.26 -2.10 118.68 123.77 3b8p s LEU 119 Ca 0.06 0.22 -0.04 0.00 0.69 0.00 0.00 54.13 55.07 3b8p s LEU 119 Cb -0.26 -2.83 0.04 0.00 -0.43 0.00 0.00 46.19 42.71 3b8p s LEU 119 CO 0.00 0.18 0.17 -0.89 -0.29 0.00 0.00 176.35 175.52 3b8p s THR 120 N -1.47 -0.04 -0.14 3.68 2.01 -0.10 -4.85 115.64 114.73 3b8p s THR 120 Ca 0.33 0.16 0.00 0.00 0.31 0.00 0.00 61.69 62.49 3b8p s THR 120 Cb -0.13 -0.27 0.03 0.00 0.01 0.00 0.00 72.50 72.13 3b8p s THR 120 CO 0.26 0.07 -0.11 -0.51 -0.69 0.00 0.00 174.62 173.63 3b8p s ILE 121 N 1.12 1.37 0.06 1.82 2.07 -1.26 -1.91 121.20 124.46 3b8p s ILE 121 Ca -0.09 -0.53 -0.01 0.00 -1.41 0.00 0.00 60.65 58.61 3b8p s ILE 121 Cb -0.11 -1.33 -0.04 0.00 0.13 0.00 0.00 42.46 41.11 3b8p s ILE 121 CO -0.06 0.40 -0.03 -1.83 -1.91 0.00 0.00 174.94 171.51 3b8p s GLU 122 N 1.57 0.65 0.09 3.50 -1.05 -1.11 -5.00 118.70 117.34 3b8p s GLU 122 Ca 0.04 -1.24 -0.31 0.00 -0.15 0.00 0.00 54.97 53.31 3b8p s GLU 122 Cb -0.13 0.18 -0.07 0.00 -0.44 0.00 0.00 34.13 33.67 3b8p s GLU 122 CO -0.10 -0.11 1.35 -0.65 0.95 0.00 0.00 175.26 176.70 3b8p s GLN 123 N -3.92 4.34 0.09 -4.83 -0.21 -1.26 -0.47 119.66 113.40 3b8p s GLN 123 Ca 0.09 2.00 -0.23 0.00 0.02 0.00 0.00 55.36 57.23 3b8p s GLN 123 Cb 0.08 -3.30 -0.14 0.00 1.00 0.00 0.00 33.01 30.65 3b8p s GLN 123 CO -0.09 -0.41 1.73 0.77 -2.12 0.00 0.00 175.29 175.18 3b8p h SER 124 N 6.88 -0.03 -3.73 5.90 0.02 -1.35 -3.34 113.55 117.90 3b8p h SER 124 Ca -0.42 0.01 -0.67 0.00 -0.84 0.00 0.00 61.79 59.87 3b8p h SER 124 Cb 1.21 0.01 -0.20 0.00 0.14 0.00 0.00 62.40 63.57 3b8p h SER 124 CO 0.86 -0.02 -0.51 -0.69 -1.14 0.00 0.00 176.83 175.32 3b8p s VAL 125 N -6.19 5.05 -0.04 2.27 1.01 -1.26 -4.99 120.40 116.27 3b8p s VAL 125 Ca -0.13 -0.20 -0.30 0.00 0.00 0.00 0.00 61.98 61.35 3b8p s VAL 125 Cb 0.06 -3.55 -0.07 0.00 0.00 0.00 0.00 36.38 32.83 3b8p s VAL 125 CO 0.66 0.07 1.83 -1.59 0.00 0.00 0.00 175.10 176.07 3b8p s LYS 126 N 1.69 4.07 0.00 2.72 0.00 -1.25 -1.26 119.74 125.71 3b8p s LYS 126 Ca 0.06 2.33 0.00 0.00 0.00 0.00 0.00 55.97 58.36 3b8p s LYS 126 Cb -0.17 -4.09 0.00 0.00 0.00 0.00 0.00 37.83 33.57 3b8p s LYS 126 CO 0.09 -1.01 0.00 0.41 0.00 0.00 0.00 175.35 174.85 3b8p n GLY 127 N 4.46 0.78 3.24 0.59 0.00 -1.26 -5.08 105.19 107.91 3b8p n GLY 127 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 3b8p n GLY 127 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3b8p s GLN 128 N -0.47 3.11 0.19 1.61 0.74 -0.39 -5.06 119.66 119.39 3b8p s GLN 128 Ca 0.00 -0.85 -0.12 0.00 0.05 0.00 0.00 55.36 54.45 3b8p s GLN 128 Cb 0.00 -2.36 0.20 0.00 1.10 0.00 0.00 33.01 31.95 3b8p s GLN 128 CO 0.00 0.18 1.76 0.00 -0.55 0.00 0.00 175.29 176.68 3b8p h ALA 129 N 6.72 0.68 -3.64 1.58 0.00 -1.98 -3.43 119.26 119.19 3b8p h ALA 129 Ca -0.20 0.06 -0.37 0.00 0.00 0.00 0.00 54.91 54.39 3b8p h ALA 129 Cb 1.23 0.01 -0.25 0.00 0.00 0.00 0.00 17.79 18.79 3b8p h ALA 129 CO 0.49 -0.17 -0.77 -0.51 0.00 0.00 0.00 179.25 178.29 3b8p s LEU 130 N -10.35 2.15 0.68 0.00 1.43 -1.26 -4.69 118.68 106.65 3b8p s LEU 130 Ca -0.13 -0.39 -0.08 0.00 -1.03 0.00 0.00 54.13 52.50 3b8p s LEU 130 Cb 0.15 -0.41 0.04 0.00 0.03 0.00 0.00 46.19 46.00 3b8p s LEU 130 CO 0.74 -0.02 1.02 -2.16 0.23 0.00 0.00 176.35 176.15 3b8p s PRO 131 N -1.00 2.54 -0.14 1.29 0.05 -1.26 -4.90 135.00 131.58 3b8p s PRO 131 Ca -0.01 0.02 -0.02 0.00 0.05 0.00 0.00 61.00 61.04 3b8p s PRO 131 Cb -0.07 -2.14 -0.02 0.00 0.05 0.00 0.00 34.50 32.31 3b8p s PRO 131 CO 0.01 -1.07 -0.07 -0.51 0.05 0.00 0.00 177.00 175.41 3b8p s LEU 132 N -5.23 3.09 -0.17 -3.56 1.02 -0.71 -0.99 118.68 112.14 3b8p s LEU 132 Ca 0.58 -0.17 0.01 0.00 0.02 0.00 0.00 54.13 54.56 3b8p s LEU 132 Cb -0.11 -1.73 0.01 0.00 0.02 0.00 0.00 46.19 44.39 3b8p s LEU 132 CO 0.47 0.19 -0.19 -0.94 0.02 0.00 0.00 176.35 175.90 3b8p s SER 133 N 0.24 3.26 0.05 2.29 1.04 0.38 0.12 113.70 121.09 3b8p s SER 133 Ca -0.05 -0.60 -0.02 0.00 0.48 0.00 0.00 55.95 55.76 3b8p s SER 133 Cb -0.14 -1.50 -0.04 0.00 0.10 0.00 0.00 66.02 64.43 3b8p s SER 133 CO 0.04 0.03 0.24 0.68 0.98 0.00 0.00 173.24 175.20 3b8p s VAL 134 N 1.15 5.35 0.08 5.02 -7.23 0.34 -2.75 120.40 122.36 3b8p s VAL 134 Ca 0.01 -0.21 -0.04 0.00 -1.81 0.00 0.00 61.98 59.93 3b8p s VAL 134 Cb -0.14 -3.60 -0.03 0.00 0.56 0.00 0.00 36.38 33.17 3b8p s VAL 134 CO -0.08 0.18 0.07 -0.94 -0.31 0.00 0.00 175.10 174.02 3b8p s SER 135 N -2.30 0.32 -0.08 4.85 1.04 -0.80 -0.45 113.70 116.28 3b8p s SER 135 Ca 0.34 -0.92 -0.13 0.00 0.48 0.00 0.00 55.95 55.72 3b8p s SER 135 Cb -0.13 0.27 0.03 0.00 0.10 0.00 0.00 66.02 66.29 3b8p s SER 135 CO 0.24 -0.68 0.33 -0.47 0.98 0.00 0.00 173.24 173.65 3b8p s TYR 136 N -3.92 -0.30 -0.11 5.02 5.04 -0.47 -0.92 117.35 121.68 3b8p s TYR 136 Ca 0.10 0.65 -0.02 0.00 -2.44 0.00 0.00 57.07 55.35 3b8p s TYR 136 Cb 0.07 0.12 -0.03 0.00 0.35 0.00 0.00 41.96 42.46 3b8p s TYR 136 CO -0.08 -0.27 -0.02 0.08 -1.34 0.00 0.00 175.55 173.92 3b8p s VAL 137 N -0.45 4.13 0.22 3.14 1.01 -0.89 -0.63 120.40 126.94 3b8p s VAL 137 Ca -0.06 -0.30 -0.02 0.00 0.00 0.00 0.00 61.98 61.60 3b8p s VAL 137 Cb -0.04 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.55 3b8p s VAL 137 CO 0.02 0.56 0.20 -0.55 0.00 0.00 0.00 175.10 175.33 3b8p s SER 138 N -0.43 0.22 0.19 3.32 0.15 -1.00 -4.48 113.70 111.67 3b8p s SER 138 Ca 0.08 -1.35 -0.10 0.00 0.70 0.00 0.00 55.95 55.28 3b8p s SER 138 Cb -0.12 0.43 0.10 0.00 -1.71 0.00 0.00 66.02 64.71 3b8p s SER 138 CO 0.02 -0.91 1.71 0.71 1.20 0.00 0.00 173.24 175.97 3b8p h THR 139 N 2.52 1.25 -4.55 6.45 1.35 -1.94 -1.13 112.91 116.87 3b8p h THR 139 Ca -0.34 -0.89 -0.69 0.00 -0.55 0.00 0.00 66.41 63.94 3b8p h THR 139 Cb 1.25 0.58 -0.29 0.00 -1.73 0.00 0.00 68.15 67.95 3b8p h THR 139 CO 0.49 0.34 -0.89 0.42 -0.25 0.00 0.00 175.52 175.64 3b8p s THR 140 N -5.37 2.03 0.26 6.82 -4.23 -1.26 -3.96 115.64 109.93 3b8p s THR 140 Ca -0.12 -1.14 -0.09 0.00 -1.18 0.00 0.00 61.69 59.15 3b8p s THR 140 Cb 0.14 -1.70 0.40 0.00 1.34 0.00 0.00 72.50 72.68 3b8p s THR 140 CO 0.83 0.54 1.47 0.00 -0.54 0.00 0.00 174.62 176.92 3b8p n ALA 141 N 2.34 0.17 0.20 3.99 0.00 -1.26 0.79 120.51 126.73 3b8p n ALA 141 Ca -0.16 1.02 0.07 0.00 0.00 0.00 0.00 53.44 54.37 3b8p n ALA 141 Cb 0.51 -0.59 0.37 0.00 0.00 0.00 0.00 19.45 19.75 3b8p n ALA 141 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3b8p h GLU 142 N 0.00 0.00 -0.54 0.00 -0.00 -1.95 -3.04 114.58 109.05 3b8p h GLU 142 Ca 0.43 0.00 -0.04 0.00 -0.00 0.00 0.00 59.36 59.75 3b8p h GLU 142 Cb 0.67 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.39 3b8p h GLU 142 CO -0.97 0.31 0.17 0.78 -0.00 0.00 0.00 179.01 179.30 3b8p h GLY 143 N 2.14 0.90 0.04 1.06 0.00 -0.02 -2.48 103.07 104.71 3b8p h GLY 143 Ca -0.00 -0.54 -0.00 0.00 0.00 0.00 0.00 47.33 46.79 3b8p h GLY 143 CO 0.04 0.50 -0.02 0.00 0.00 0.00 0.00 176.54 177.06 3b8p h ALA 144 N 1.03 -0.83 -1.44 3.60 0.00 -1.41 -1.52 119.26 118.69 3b8p h ALA 144 Ca 0.17 -0.01 0.44 0.00 0.00 0.00 0.00 54.91 55.51 3b8p h ALA 144 Cb 0.28 0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.02 3b8p h ALA 144 CO -0.00 -0.83 1.01 0.94 0.00 0.00 0.00 179.25 180.37 3b8p n GLN 145 N -2.16 -0.01 -0.03 0.00 -0.06 -1.16 -0.30 117.38 113.66 3b8p n GLN 145 Ca -0.01 0.91 -0.16 0.00 -2.00 0.00 0.00 57.00 55.75 3b8p n GLN 145 Cb 0.02 -2.00 -0.14 0.00 -4.06 0.00 0.00 30.24 24.06 3b8p n GLN 145 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 3b8p n ARG 146 N -3.77 0.70 -0.03 3.69 5.12 -0.93 -3.98 116.66 117.44 3b8p n ARG 146 Ca 0.35 0.23 -0.16 0.00 -1.93 0.00 0.00 57.85 56.33 3b8p n ARG 146 Cb 1.51 -1.68 -0.08 0.00 -1.16 0.00 0.00 32.46 31.05 3b8p n ARG 146 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3b8p h ARG 147 N 0.03 0.63 0.21 5.56 2.47 0.43 -2.31 114.38 121.40 3b8p h ARG 147 Ca -0.42 -0.49 0.00 0.00 -1.26 0.00 0.00 59.98 57.81 3b8p h ARG 147 Cb 2.03 0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 30.42 3b8p h ARG 147 CO 0.05 1.11 -0.37 1.25 0.56 0.00 0.00 179.97 182.57 3b8p h LEU 148 N 0.28 -1.08 -0.88 3.04 6.46 -1.32 0.46 115.31 122.27 3b8p h LEU 148 Ca -0.03 0.10 0.23 0.00 -0.12 0.00 0.00 57.88 58.06 3b8p h LEU 148 Cb 1.20 0.38 -0.14 0.00 -0.73 0.00 0.00 40.66 41.36 3b8p h LEU 148 CO 0.12 -0.44 0.22 0.00 -0.62 0.00 0.00 178.44 177.72 3b8p h ALA 149 N -0.97 1.25 0.02 1.25 0.00 -1.69 0.29 119.26 119.41 3b8p h ALA 149 Ca -0.02 0.23 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 3b8p h ALA 149 Cb 0.58 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.70 3b8p h ALA 149 CO -0.14 -0.47 -0.01 1.05 0.00 0.00 0.00 179.25 179.68 3b8p h GLU 150 N 0.19 -0.03 -0.38 0.00 9.09 -0.44 -1.26 114.58 121.76 3b8p h GLU 150 Ca 0.55 0.00 0.02 0.00 0.05 0.00 0.00 59.36 59.98 3b8p h GLU 150 Cb 1.10 0.01 -0.03 0.00 -1.65 0.00 0.00 28.75 28.18 3b8p h GLU 150 CO -0.67 0.05 0.21 1.88 0.05 0.00 0.00 179.01 180.54 3b8p h TYR 151 N -0.10 0.39 -0.87 2.06 0.99 0.33 0.62 116.97 120.39 3b8p h TYR 151 Ca -0.00 0.01 0.09 0.00 2.00 0.00 0.00 58.73 60.83 3b8p h TYR 151 Cb 0.09 -0.12 -0.07 0.00 1.00 0.00 0.00 36.73 37.63 3b8p h TYR 151 CO -0.05 0.22 0.51 0.82 -0.00 0.00 0.00 178.16 179.66 3b8p h ILE 152 N 0.42 0.94 -0.19 -2.88 2.04 -0.77 0.54 117.51 117.61 3b8p h ILE 152 Ca 0.16 -0.30 -0.19 0.00 1.00 0.00 0.00 64.86 65.52 3b8p h ILE 152 Cb 0.04 -0.01 0.01 0.00 -0.74 0.00 0.00 36.82 36.12 3b8p h ILE 152 CO -0.09 0.16 -0.64 -0.61 0.00 0.00 0.00 178.15 176.97 3b8p h GLN 153 N 0.87 0.76 -0.57 2.37 4.15 -0.63 -2.27 115.11 119.80 3b8p h GLN 153 Ca 0.41 -0.57 0.08 0.00 0.77 0.00 0.00 58.65 59.35 3b8p h GLN 153 Cb 0.35 0.10 -0.07 0.00 0.21 0.00 0.00 27.48 28.07 3b8p h GLN 153 CO -0.24 1.19 0.21 0.37 -1.93 0.00 0.00 178.83 178.43 3b8p h GLN 154 N 0.49 0.38 0.50 1.69 -0.00 0.21 -0.46 115.11 117.91 3b8p h GLN 154 Ca -0.03 -0.02 -0.02 0.00 -0.00 0.00 0.00 58.65 58.58 3b8p h GLN 154 Cb 1.26 -0.09 0.00 0.00 0.00 0.00 0.00 27.48 28.66 3b8p h GLN 154 CO 0.14 0.25 -0.24 0.28 0.00 0.00 0.00 178.83 179.25 3b8p h VAL 155 N 0.39 0.42 -0.59 2.39 2.07 -1.02 -2.35 116.25 117.57 3b8p h VAL 155 Ca 0.28 -0.36 0.07 0.00 0.82 0.00 0.00 66.70 67.51 3b8p h VAL 155 Cb 0.33 0.56 -0.10 0.00 -1.52 0.00 0.00 31.29 30.56 3b8p h VAL 155 CO -0.29 0.05 -0.53 -0.78 0.02 0.00 0.00 177.57 176.04 3b8p h ASP 156 N -0.91 -1.84 -0.37 0.57 3.58 -0.85 -0.10 116.42 116.50 3b8p h ASP 156 Ca -0.07 0.27 0.08 0.00 0.42 0.00 0.00 57.03 57.72 3b8p h ASP 156 Cb 0.60 0.79 -0.08 0.00 1.72 0.00 0.00 39.33 42.36 3b8p h ASP 156 CO 0.11 -0.35 -0.16 -0.33 -2.88 0.00 0.00 179.24 175.64 3b8p h GLU 157 N -0.26 -0.08 -0.04 0.28 5.08 -1.16 0.12 114.58 118.51 3b8p h GLU 157 Ca 0.12 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.41 3b8p h GLU 157 Cb 0.55 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 3b8p h GLU 157 CO -0.70 -0.06 -0.35 1.05 -1.00 0.00 0.00 179.01 177.96 3b8p h GLU 158 N -0.09 0.07 0.02 2.33 -0.00 -0.59 0.78 114.58 117.10 3b8p h GLU 158 Ca 0.18 -0.03 -0.00 0.00 -0.00 0.00 0.00 59.36 59.52 3b8p h GLU 158 Cb 0.37 -0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.11 3b8p h GLU 158 CO -0.43 0.42 -0.01 0.28 -0.00 0.00 0.00 179.01 179.27 3b8p h VAL 159 N 0.07 1.51 -0.39 -1.06 2.07 -0.80 -3.13 116.25 114.52 3b8p h VAL 159 Ca 0.01 -1.88 0.08 0.00 0.82 0.00 0.00 66.70 65.73 3b8p h VAL 159 Cb 0.65 2.74 -0.08 0.00 -1.52 0.00 0.00 31.29 33.08 3b8p h VAL 159 CO 0.05 0.47 -0.15 0.00 0.02 0.00 0.00 177.57 177.95 3b8p h ALA 160 N 0.04 0.17 -0.28 1.67 0.00 -0.47 -1.58 119.26 118.81 3b8p h ALA 160 Ca -0.00 0.14 0.07 0.00 0.00 0.00 0.00 54.91 55.12 3b8p h ALA 160 Cb 0.78 0.39 -0.08 0.00 0.00 0.00 0.00 17.79 18.88 3b8p h ALA 160 CO 0.00 -0.51 -0.28 -0.22 0.00 0.00 0.00 179.25 178.24 3b8p h LYS 161 N -0.07 -0.26 -0.16 0.00 3.11 -0.94 0.43 116.57 118.67 3b8p h LYS 161 Ca 0.19 0.02 0.04 0.00 -2.81 0.00 0.00 60.65 58.09 3b8p h LYS 161 Cb 0.36 0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 31.65 3b8p h LYS 161 CO -0.44 -0.17 0.11 1.49 -2.81 0.00 0.00 179.45 177.63 3b8p h GLU 162 N -0.27 0.04 0.02 1.90 4.81 -1.29 -1.56 114.58 118.22 3b8p h GLU 162 Ca 0.14 -0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.14 3b8p h GLU 162 Cb 0.50 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.85 3b8p h GLU 162 CO -0.44 0.02 -1.14 1.25 -0.73 0.00 0.00 179.01 177.98 3b8p h LEU 163 N 0.04 0.06 -0.37 1.64 5.85 -0.14 -2.58 115.31 119.81 3b8p h LEU 163 Ca 0.07 -0.07 -0.11 0.00 0.84 0.00 0.00 57.88 58.62 3b8p h LEU 163 Cb 0.24 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 3b8p h LEU 163 CO -0.00 1.06 -0.18 -0.33 -0.34 0.00 0.00 178.44 178.64 3b8p h GLU 164 N 0.01 0.78 -0.07 1.25 5.08 -0.38 -3.07 114.58 118.18 3b8p h GLU 164 Ca -0.07 -0.34 0.04 0.00 -1.00 0.00 0.00 59.36 57.99 3b8p h GLU 164 Cb 1.83 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 31.01 3b8p h GLU 164 CO 0.13 0.96 -0.28 0.28 -1.00 0.00 0.00 179.01 179.11 3b8p h VAL 165 N 0.58 0.36 -0.76 3.13 2.07 -1.26 -0.54 116.25 119.83 3b8p h VAL 165 Ca 0.08 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.77 3b8p h VAL 165 Cb 0.73 0.36 -0.14 0.00 -1.52 0.00 0.00 31.29 30.73 3b8p h VAL 165 CO 0.05 0.00 -0.11 0.44 0.02 0.00 0.00 177.57 177.98 3b8p h ASP 166 N -0.38 -0.55 0.03 0.57 3.32 -1.40 0.38 116.42 118.38 3b8p h ASP 166 Ca 0.08 0.21 -0.00 0.00 0.02 0.00 0.00 57.03 57.35 3b8p h ASP 166 Cb 0.50 0.42 0.00 0.00 0.22 0.00 0.00 39.33 40.47 3b8p h ASP 166 CO -0.29 -0.23 -0.01 -0.07 -1.72 0.00 0.00 179.24 176.92 3b8p h LEU 167 N 0.04 -0.03 -2.29 1.55 3.38 -1.38 0.53 115.31 117.11 3b8p h LEU 167 Ca 0.39 -0.29 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 3b8p h LEU 167 Cb 0.64 0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 3b8p h LEU 167 CO -0.73 0.27 -0.01 0.11 0.09 0.00 0.00 178.44 178.17 3b8p h LYS 168 N -0.34 0.00 0.00 1.13 1.57 -0.80 0.58 116.57 118.72 3b8p h LYS 168 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3b8p h LYS 168 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 3b8p h LYS 168 CO 0.01 0.01 -0.00 0.22 -0.57 0.00 0.00 179.45 179.12 3b8p h ASP 169 N 0.00 -0.01 0.39 0.86 3.58 -0.82 -3.32 116.42 117.10 3b8p h ASP 169 Ca -0.00 -0.86 -0.03 0.00 0.42 0.00 0.00 57.03 56.55 3b8p h ASP 169 Cb 0.23 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.28 3b8p h ASP 169 CO 0.00 0.89 -0.16 0.78 -2.88 0.00 0.00 179.24 177.87 3b8p h ASN 170 N -0.93 0.00 -0.75 2.28 4.21 0.95 0.22 115.58 121.57 3b8p h ASN 170 Ca -0.00 0.00 -0.05 0.00 1.21 0.00 0.00 56.30 57.46 3b8p h ASN 170 Cb 0.87 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 38.04 3b8p h ASN 170 CO 0.00 0.16 0.29 0.40 -1.29 0.00 0.00 177.43 177.00 3b8p h ILE 171 N 0.00 1.25 0.10 2.81 5.03 -0.07 -0.06 117.51 126.58 3b8p h ILE 171 Ca -0.00 -0.81 -0.33 0.00 -0.12 0.00 0.00 64.86 63.60 3b8p h ILE 171 Cb 0.40 0.36 -0.02 0.00 -3.03 0.00 0.00 36.82 34.53 3b8p h ILE 171 CO 0.02 0.33 -1.77 0.74 -0.68 0.00 0.00 178.15 176.79 3b8p h THR 172 N 1.10 0.86 0.00 -0.27 2.02 -1.53 -3.34 112.91 111.75 3b8p h THR 172 Ca 0.25 -2.58 -0.04 0.00 0.77 0.00 0.00 66.41 64.82 3b8p h THR 172 Cb 0.22 2.58 -0.01 0.00 -1.74 0.00 0.00 68.15 69.20 3b8p h THR 172 CO -0.02 0.77 -0.17 -0.07 0.37 0.00 0.00 175.52 176.40 3b8p h LEU 173 N 0.06 0.00 -5.16 2.58 3.38 -0.55 -3.06 115.31 112.55 3b8p h LEU 173 Ca -0.33 0.00 -0.62 0.00 0.09 0.00 0.00 57.88 57.02 3b8p h LEU 173 Cb 2.03 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 42.38 3b8p h LEU 173 CO 0.11 0.17 -0.43 0.00 0.09 0.00 0.00 178.44 178.38 3b8p n GLN 174 N -3.29 3.49 0.00 1.13 10.64 -0.04 -4.06 117.38 125.24 3b8p n GLN 174 Ca 0.01 -4.70 0.00 0.00 -1.83 0.00 0.00 57.00 50.48 3b8p n GLN 174 Cb 0.42 -2.27 0.00 0.00 -0.86 0.00 0.00 30.24 27.54 3b8p n GLN 174 CO 0.00 0.00 0.00 2.41 -1.83 0.00 0.00 177.06 177.64 3b8p n THR 175 N -0.31 0.00 0.95 -0.39 -1.04 -1.16 -4.72 114.28 107.62 3b8p n THR 175 Ca 0.36 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.37 3b8p n THR 175 Cb 0.44 0.08 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 3b8p n THR 175 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 3b8p n LYS 176 N -0.90 0.95 0.00 -2.82 5.02 -1.25 0.19 118.16 119.35 3b8p n LYS 176 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3b8p n LYS 176 Cb 0.06 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.60 3b8p n LYS 176 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3b8p n THR 177 N 0.03 0.00 -0.02 -0.18 -1.04 -1.26 -4.56 114.28 107.25 3b8p n THR 177 Ca 0.00 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.79 3b8p n THR 177 Cb 0.24 0.02 -0.13 0.00 -1.82 0.00 0.00 70.33 68.64 3b8p n THR 177 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 3b8p h LEU 178 N 0.00 0.33 -0.18 -4.42 3.38 -1.58 -3.26 115.31 109.57 3b8p h LEU 178 Ca 0.00 -0.84 0.00 0.00 0.09 0.00 0.00 57.88 57.13 3b8p h LEU 178 Cb 0.09 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.73 3b8p h LEU 178 CO 0.00 1.76 -0.12 0.00 0.09 0.00 0.00 178.44 180.17 3b8p n GLN 179 N -3.75 0.56 -0.37 1.13 6.02 0.13 -3.69 117.38 117.42 3b8p n GLN 179 Ca -0.31 -0.18 0.09 0.00 -0.01 0.00 0.00 57.00 56.59 3b8p n GLN 179 Cb 0.95 -1.50 0.28 0.00 1.02 0.00 0.00 30.24 31.00 3b8p n GLN 179 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 177.06 175.20 3b8p n GLU 180 N -1.06 2.97 -0.01 -1.09 0.00 -1.25 -3.92 120.64 116.27 3b8p n GLU 180 Ca 0.13 -2.54 0.03 0.00 0.00 0.00 0.00 57.16 54.78 3b8p n GLU 180 Cb 0.28 -1.56 -0.06 0.00 0.00 0.00 0.00 31.44 30.10 3b8p n GLU 180 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.13 176.00 3b8p n SER 181 N 1.14 3.14 0.03 -1.84 3.41 -1.23 -4.06 113.62 114.21 3b8p n SER 181 Ca 0.21 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.73 3b8p n SER 181 Cb 0.63 1.26 0.05 0.00 -0.26 0.00 0.00 64.21 65.89 3b8p n SER 181 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3b8p h LEU 182 N 0.00 0.55 -0.02 1.04 3.38 -1.74 -2.34 115.31 116.18 3b8p h LEU 182 Ca -0.03 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3b8p h LEU 182 Cb 0.55 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.14 3b8p h LEU 182 CO 0.00 1.04 -0.16 -0.62 0.09 0.00 0.00 178.44 178.79 3b8p n GLU 183 N -3.91 0.08 0.06 1.13 1.02 -1.25 -1.47 120.64 116.29 3b8p n GLU 183 Ca -0.04 -0.02 -0.19 0.00 -0.02 0.00 0.00 57.16 56.90 3b8p n GLU 183 Cb 0.64 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.42 3b8p n GLU 183 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3b8p h THR 184 N 0.05 1.01 0.12 2.62 2.02 -1.66 -3.38 112.91 113.69 3b8p h THR 184 Ca 0.00 -2.65 -0.01 0.00 0.77 0.00 0.00 66.41 64.52 3b8p h THR 184 Cb 0.48 2.71 0.00 0.00 -1.74 0.00 0.00 68.15 69.61 3b8p h THR 184 CO 0.00 0.82 -0.06 0.06 0.37 0.00 0.00 175.52 176.71 3b8p h GLN 185 N 0.08 -0.15 -1.73 6.66 -0.00 -1.45 -3.51 115.11 115.01 3b8p h GLN 185 Ca -0.30 0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.36 3b8p h GLN 185 Cb 2.04 0.04 0.00 0.00 -0.00 0.00 0.00 27.48 29.56 3b8p h GLN 185 CO 0.15 -0.10 0.00 0.39 -0.00 0.00 0.00 178.83 179.27 3b8p n GLU 186 N -4.63 0.99 0.00 0.06 1.02 -0.54 -5.11 120.64 112.43 3b8p n GLU 186 Ca -0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.12 3b8p n GLU 186 Cb 0.06 -1.00 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 3b8p n GLU 186 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 3b8p n SER 251 N 1.23 0.00 0.01 1.62 7.64 -1.26 -4.93 113.62 117.94 3b8p n SER 251 Ca 0.00 0.00 -0.01 0.00 1.01 0.00 0.00 58.87 59.87 3b8p n SER 251 Cb 0.50 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.69 3b8p n SER 251 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3b8p h PRO 252 N 0.00 -0.06 -0.33 1.43 0.13 -2.08 -3.26 132.00 127.83 3b8p h PRO 252 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.05 3b8p h PRO 252 Cb 0.00 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 31.13 3b8p h PRO 252 CO 0.00 -0.04 -0.15 0.00 -0.23 0.00 0.00 178.00 177.58 3b8p h ALA 253 N -1.77 1.13 -1.36 -0.56 0.00 -2.09 -3.20 119.26 111.41 3b8p h ALA 253 Ca -0.01 -0.30 0.39 0.00 0.00 0.00 0.00 54.91 54.99 3b8p h ALA 253 Cb 0.05 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 17.64 3b8p h ALA 253 CO 0.01 0.54 0.97 0.10 0.00 0.00 0.00 179.25 180.87 3b8p h TYR 254 N 0.53 0.05 0.00 0.00 -0.00 -2.05 -1.44 116.97 114.05 3b8p h TYR 254 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.82 3b8p h TYR 254 Cb 0.57 -0.01 0.00 0.00 -0.00 0.00 0.00 36.73 37.28 3b8p h TYR 254 CO 0.02 -0.00 0.00 2.48 -0.00 0.00 0.00 178.16 180.66 3b8p n TYR 255 N -4.16 0.00 0.10 0.10 4.11 -1.21 -3.40 117.16 112.70 3b8p n TYR 255 Ca 0.30 0.00 -0.04 0.00 -0.00 0.00 0.00 57.90 58.16 3b8p n TYR 255 Cb 1.40 -0.47 0.13 0.00 -0.00 0.00 0.00 39.34 40.40 3b8p n TYR 255 CO 0.00 0.00 0.00 1.96 -0.00 0.00 0.00 176.86 178.82 3b8p h GLN 256 N 0.00 0.15 -0.42 -3.48 4.20 -1.49 -2.91 115.11 111.16 3b8p h GLN 256 Ca 0.00 -0.11 0.04 0.00 0.06 0.00 0.00 58.65 58.64 3b8p h GLN 256 Cb 0.36 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 3b8p h GLN 256 CO 0.00 0.72 0.28 1.15 -0.67 0.00 0.00 178.83 180.31 3b8p h THR 257 N 0.11 1.01 -0.41 -0.54 2.02 -1.75 -1.35 112.91 112.00 3b8p h THR 257 Ca -0.01 -0.14 -0.09 0.00 0.77 0.00 0.00 66.41 66.94 3b8p h THR 257 Cb 1.12 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 3b8p h THR 257 CO 0.09 0.08 -0.12 0.11 0.37 0.00 0.00 175.52 176.05 3b8p h LYS 258 N 0.42 0.73 -0.17 6.66 6.56 -1.69 -2.44 116.57 126.63 3b8p h LYS 258 Ca 0.17 -0.24 -0.16 0.00 -1.06 0.00 0.00 60.65 59.36 3b8p h LYS 258 Cb 0.17 -0.06 0.00 0.00 -0.57 0.00 0.00 32.23 31.77 3b8p h LYS 258 CO -0.04 0.82 -0.51 -0.56 -2.06 0.00 0.00 179.45 177.11 3b8p h GLN 259 N 0.67 0.65 -0.40 3.15 3.07 -1.34 -3.00 115.11 117.90 3b8p h GLN 259 Ca 0.11 -0.47 -0.02 0.00 0.09 0.00 0.00 58.65 58.36 3b8p h GLN 259 Cb 0.58 0.08 -0.02 0.00 0.08 0.00 0.00 27.48 28.20 3b8p h GLN 259 CO 0.04 1.09 0.16 1.79 0.09 0.00 0.00 178.83 181.99 3b8p h THR 260 N 0.33 1.20 0.00 1.86 1.35 -1.34 -1.92 112.91 114.38 3b8p h THR 260 Ca -0.01 -0.61 -0.03 0.00 -0.55 0.00 0.00 66.41 65.21 3b8p h THR 260 Cb 1.13 0.85 -0.00 0.00 -1.73 0.00 0.00 68.15 68.40 3b8p h THR 260 CO 0.11 0.22 -0.12 -0.07 -0.25 0.00 0.00 175.52 175.41 3b8p h LEU 261 N 0.50 0.00 -0.45 3.87 4.07 -1.53 0.88 115.31 122.66 3b8p h LEU 261 Ca 0.13 0.00 -0.17 0.00 0.08 0.00 0.00 57.88 57.92 3b8p h LEU 261 Cb 0.20 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.93 3b8p h LEU 261 CO -0.01 0.12 -0.62 0.17 -1.08 0.00 0.00 178.44 177.02 3b8p h LEU 262 N 0.00 0.62 0.00 1.67 -0.00 -1.29 -2.86 115.31 113.47 3b8p h LEU 262 Ca -0.00 -0.36 -0.27 0.00 -0.00 0.00 0.00 57.88 57.25 3b8p h LEU 262 Cb 0.24 -0.18 0.02 0.00 -0.00 0.00 0.00 40.66 40.74 3b8p h LEU 262 CO 0.02 1.09 -1.10 0.44 -0.00 0.00 0.00 178.44 178.89 3b8p h ASP 263 N 0.41 0.81 0.02 0.17 5.19 -0.62 -0.34 116.42 122.05 3b8p h ASP 263 Ca -0.01 -0.68 0.00 0.00 -0.62 0.00 0.00 57.03 55.72 3b8p h ASP 263 Cb 1.18 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 40.44 3b8p h ASP 263 CO 0.12 1.49 0.00 -0.38 -3.12 0.00 0.00 179.24 177.34 3b8p n ILE 264 N -3.80 0.07 -0.03 0.35 -0.00 0.23 -1.41 119.36 114.77 3b8p n ILE 264 Ca -0.11 0.02 -0.04 0.00 -0.00 0.00 0.00 62.75 62.62 3b8p n ILE 264 Cb 0.91 -0.85 -0.04 0.00 -0.00 0.00 0.00 39.64 39.66 3b8p n ILE 264 CO 0.00 0.00 0.00 2.29 -0.00 0.00 0.00 176.55 178.84 3b8p n LYS 265 N -1.02 2.14 0.27 0.38 2.85 -1.08 -4.70 118.16 116.99 3b8p n LYS 265 Ca 0.07 0.01 0.13 0.00 -1.05 0.00 0.00 58.31 57.48 3b8p n LYS 265 Cb 0.04 -1.15 0.74 0.00 -0.65 0.00 0.00 35.03 34.01 3b8p n LYS 265 CO 0.00 0.00 0.00 -2.95 -0.05 0.00 0.00 177.40 174.40 3b8p h ASN 266 N 0.00 0.00 -2.79 -5.58 7.08 0.16 -3.43 115.58 111.02 3b8p h ASN 266 Ca -0.16 0.00 -0.65 0.00 -3.08 0.00 0.00 56.30 52.41 3b8p h ASN 266 Cb 1.32 0.00 -0.07 0.00 -2.08 0.00 0.00 38.32 37.49 3b8p h ASN 266 CO -0.00 0.11 -0.42 -0.76 -2.08 0.00 0.00 177.43 174.28 3b8p s LEU 267 N -7.16 4.38 -0.19 6.14 1.43 -1.04 -5.07 118.68 117.17 3b8p s LEU 267 Ca -0.03 0.55 0.01 0.00 -1.03 0.00 0.00 54.13 53.63 3b8p s LEU 267 Cb 0.13 -2.18 0.04 0.00 0.03 0.00 0.00 46.19 44.20 3b8p s LEU 267 CO 0.58 0.36 -0.12 -0.54 0.23 0.00 0.00 176.35 176.85 3b8p s LYS 268 N -0.85 2.21 -1.18 1.70 3.01 -1.26 -4.98 119.74 118.40 3b8p s LYS 268 Ca 0.16 -0.83 -0.21 0.00 -1.01 0.00 0.00 55.97 54.09 3b8p s LYS 268 Cb -0.13 -2.42 0.03 0.00 -1.01 0.00 0.00 37.83 34.31 3b8p s LYS 268 CO 0.05 -0.38 1.70 0.54 0.51 0.00 0.00 175.35 177.77 3b8p s VAL 269 N 1.38 3.93 0.40 3.17 0.11 -1.26 -4.98 120.40 123.15 3b8p s VAL 269 Ca 0.00 -1.34 -0.26 0.00 -2.93 0.00 0.00 61.98 57.45 3b8p s VAL 269 Cb -0.15 -4.99 -0.09 0.00 -1.53 0.00 0.00 36.38 29.62 3b8p s VAL 269 CO -0.09 -1.78 1.32 0.28 -3.33 0.00 0.00 175.10 171.49 3b8p s THR 270 N 5.81 2.58 0.00 5.04 -1.32 -1.26 -4.89 115.64 121.60 3b8p s THR 270 Ca 0.55 0.53 0.00 0.00 -1.21 0.00 0.00 61.69 61.55 3b8p s THR 270 Cb 0.01 -3.31 0.00 0.00 -1.51 0.00 0.00 72.50 67.69 3b8p s THR 270 CO 0.03 0.08 0.71 0.00 -2.21 0.00 0.00 174.62 173.23 3b8p n ALA 271 N 0.18 2.28 -1.98 11.08 0.00 -1.26 -2.18 120.51 128.62 3b8p n ALA 271 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3b8p n ALA 271 Cb 0.43 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.77 3b8p n ALA 271 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3b8p n ASP 272 N 0.98 0.00 -0.08 0.00 5.68 -1.26 -4.95 116.55 116.92 3b8p n ASP 272 Ca 0.00 -1.01 -0.14 0.00 -0.50 0.00 0.00 54.79 53.14 3b8p n ASP 272 Cb 0.28 -0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.15 3b8p n ASP 272 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3b8p h THR 273 N 3.79 1.25 -3.30 2.12 1.35 -1.82 -3.47 112.91 112.83 3b8p h THR 273 Ca 0.00 -2.08 -0.55 0.00 -0.55 0.00 0.00 66.41 63.23 3b8p h THR 273 Cb 1.00 2.50 -0.04 0.00 -1.73 0.00 0.00 68.15 69.89 3b8p h THR 273 CO 0.00 0.42 0.51 0.68 -0.25 0.00 0.00 175.52 176.88 3b8p s VAL 274 N -2.19 4.81 -0.06 6.82 -7.23 -1.26 -4.88 120.40 116.41 3b8p s VAL 274 Ca -0.19 2.03 0.03 0.00 -1.81 0.00 0.00 61.98 62.03 3b8p s VAL 274 Cb 0.00 -4.31 0.00 0.00 0.56 0.00 0.00 36.38 32.64 3b8p s VAL 274 CO 0.56 0.05 -0.16 -1.00 -0.31 0.00 0.00 175.10 174.24 3b8p s HIS 275 N 1.76 1.71 -1.78 2.82 3.76 -1.26 -4.88 115.29 117.41 3b8p s HIS 275 Ca 0.49 -0.58 0.21 0.00 -0.15 0.00 0.00 55.06 55.03 3b8p s HIS 275 Cb -0.19 -1.19 0.64 0.00 1.11 0.00 0.00 32.58 32.96 3b8p s HIS 275 CO 0.20 -0.25 1.54 1.33 -0.85 0.00 0.00 174.74 176.71 3b8p n VAL 276 N 3.47 1.13 -3.83 -0.90 0.24 -1.26 -4.70 118.33 112.48 3b8p n VAL 276 Ca -0.20 -1.03 -0.06 0.00 -2.04 0.00 0.00 64.34 61.00 3b8p n VAL 276 Cb 0.52 0.44 -0.01 0.00 -1.47 0.00 0.00 33.84 33.33 3b8p n VAL 276 CO 0.00 0.00 0.00 -0.72 -2.14 0.00 0.00 176.83 173.97 3b8p s TYR 277 N -1.13 -0.13 -0.13 6.34 -0.85 -1.26 -3.34 117.35 116.85 3b8p s TYR 277 Ca 0.48 -0.32 -0.10 0.00 -0.52 0.00 0.00 57.07 56.62 3b8p s TYR 277 Cb 0.26 0.71 0.04 0.00 0.38 0.00 0.00 41.96 43.35 3b8p s TYR 277 CO 0.31 -1.16 0.33 0.50 -1.52 0.00 0.00 175.55 174.01 3b8p s ARG 278 N -3.50 0.36 0.68 -3.49 3.52 -0.20 -4.45 118.95 111.86 3b8p s ARG 278 Ca 0.12 0.55 -0.12 0.00 -0.13 0.00 0.00 55.73 56.15 3b8p s ARG 278 Cb -0.05 0.09 0.00 0.00 -1.56 0.00 0.00 34.95 33.43 3b8p s ARG 278 CO 0.06 -0.09 1.06 0.71 -0.81 0.00 0.00 175.30 176.23 3b8p s TYR 279 N 0.64 3.00 0.00 5.12 1.51 -1.26 -0.54 117.35 125.82 3b8p s TYR 279 Ca -0.04 1.47 0.00 0.00 -1.01 0.00 0.00 57.07 57.49 3b8p s TYR 279 Cb -0.05 -2.94 0.00 0.00 -0.11 0.00 0.00 41.96 38.85 3b8p s TYR 279 CO -0.04 -1.28 0.54 0.28 -1.11 0.00 0.00 175.55 173.94 3b8p n VAL 280 N -2.85 0.20 -4.27 0.71 0.31 0.07 -4.78 118.33 107.72 3b8p n VAL 280 Ca 0.08 -0.52 -0.19 0.00 -0.01 0.00 0.00 64.34 63.70 3b8p n VAL 280 Cb 0.53 1.02 -0.13 0.00 -0.91 0.00 0.00 33.84 34.35 3b8p n VAL 280 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 3b8p s LYS 282 N -0.20 0.85 0.28 5.55 0.00 -1.26 -4.96 119.74 120.01 3b8p s LYS 282 Ca 0.00 -0.79 -0.28 0.00 0.00 0.00 0.00 55.97 54.90 3b8p s LYS 282 Cb 0.00 -0.84 -0.14 0.00 0.00 0.00 0.00 37.83 36.85 3b8p s LYS 282 CO 0.00 0.20 0.99 -0.35 0.00 0.00 0.00 175.35 176.19 3b8p n PRO 283 N 1.74 1.28 -3.48 1.78 -0.04 -1.26 -4.71 135.00 130.30 3b8p n PRO 283 Ca -0.19 0.45 -0.32 0.00 -0.04 0.00 0.00 63.50 63.40 3b8p n PRO 283 Cb 0.55 -1.80 -0.05 0.00 -0.04 0.00 0.00 33.50 32.16 3b8p n PRO 283 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 3b8p s THR 284 N -1.04 5.00 -0.49 0.52 -4.23 -0.77 -4.88 115.64 109.76 3b8p s THR 284 Ca 0.59 0.32 -0.26 0.00 -1.18 0.00 0.00 61.69 61.16 3b8p s THR 284 Cb -0.71 -3.63 0.03 0.00 1.34 0.00 0.00 72.50 69.53 3b8p s THR 284 CO 0.60 -0.06 0.96 -0.76 -0.54 0.00 0.00 174.62 174.82 3b8p s LEU 285 N -2.82 3.96 0.12 4.79 1.43 -1.26 -4.15 118.68 120.74 3b8p s LEU 285 Ca 0.45 0.05 -0.30 0.00 -1.03 0.00 0.00 54.13 53.30 3b8p s LEU 285 Cb -0.11 -3.15 -0.07 0.00 0.03 0.00 0.00 46.19 42.89 3b8p s LEU 285 CO 0.23 -1.13 1.17 -2.16 0.23 0.00 0.00 176.35 174.69 3b8p s PRO 286 N 3.93 4.49 -0.03 1.29 0.04 -1.26 -4.90 135.00 138.55 3b8p s PRO 286 Ca 0.37 1.77 -0.22 0.00 0.04 0.00 0.00 61.00 62.96 3b8p s PRO 286 Cb -0.10 -3.31 -0.26 0.00 0.04 0.00 0.00 34.50 30.87 3b8p s PRO 286 CO 0.25 -0.14 0.99 0.28 0.04 0.00 0.00 177.00 178.43 3b8p h VAL 287 N 4.16 1.51 -2.38 -0.36 2.07 -1.95 -3.46 116.25 115.83 3b8p h VAL 287 Ca -0.43 -2.23 -0.52 0.00 0.82 0.00 0.00 66.70 64.34 3b8p h VAL 287 Cb 1.21 2.89 -0.05 0.00 -1.52 0.00 0.00 31.29 33.83 3b8p h VAL 287 CO 0.77 0.63 -0.52 -0.13 0.02 0.00 0.00 177.57 178.35 3b8p s ARG 288 N -2.86 3.05 0.59 1.57 0.52 -1.26 -5.13 118.95 115.44 3b8p s ARG 288 Ca -0.14 -0.91 -0.02 0.00 -0.52 0.00 0.00 55.73 54.14 3b8p s ARG 288 Cb 0.02 -2.68 0.04 0.00 0.52 0.00 0.00 34.95 32.84 3b8p s ARG 288 CO 0.80 0.44 0.85 -0.98 0.02 0.00 0.00 175.30 176.43 3b8p s ARG 289 N -3.58 2.51 0.29 3.54 1.04 -1.26 -4.81 118.95 116.68 3b8p s ARG 289 Ca 0.33 -0.54 -0.28 0.00 -1.04 0.00 0.00 55.73 54.19 3b8p s ARG 289 Cb -0.09 -2.38 -0.09 0.00 -2.04 0.00 0.00 34.95 30.35 3b8p s ARG 289 CO 0.25 -0.83 1.05 -0.51 -0.04 0.00 0.00 175.30 175.22 3b8p s ASP 290 N -4.43 7.27 0.01 -2.89 -0.00 0.55 -5.00 116.67 112.17 3b8p s ASP 290 Ca 0.57 2.14 -0.30 0.00 -0.00 0.00 0.00 52.55 54.96 3b8p s ASP 290 Cb -0.10 -2.61 -0.05 0.00 -0.00 0.00 0.00 42.92 40.15 3b8p s ASP 290 CO 0.41 -0.13 1.29 -0.55 -0.00 0.00 0.00 175.17 176.18 3b8p s SER 291 N -1.10 6.97 0.00 0.27 0.15 -1.26 -4.91 113.70 113.81 3b8p s SER 291 Ca 0.46 2.01 0.26 0.00 0.70 0.00 0.00 55.95 59.38 3b8p s SER 291 Cb -0.28 -2.57 0.65 0.00 -1.71 0.00 0.00 66.02 62.12 3b8p s SER 291 CO 0.36 -0.61 1.52 -0.81 1.20 0.00 0.00 173.24 174.90