#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3b8p s LYS 55 N 0.00 0.35 0.04 5.31 -0.14 -1.26 -4.40 119.74 119.64 3b8p s LYS 55 Ca 0.00 0.96 0.08 0.00 -1.36 0.00 0.00 55.97 55.65 3b8p s LYS 55 Cb 0.00 0.21 -0.03 0.00 -1.68 0.00 0.00 37.83 36.33 3b8p s LYS 55 CO 0.00 -0.34 -0.22 -1.58 -0.76 0.00 0.00 175.35 172.45 3b8p s TRP 56 N 2.62 1.95 -0.22 3.18 0.52 -0.50 -1.31 118.94 125.18 3b8p s TRP 56 Ca 0.02 -0.38 0.02 0.00 0.02 0.00 0.00 56.10 55.77 3b8p s TRP 56 Cb -0.13 -1.16 0.04 0.00 -1.15 0.00 0.00 33.47 31.07 3b8p s TRP 56 CO -0.14 0.10 -0.15 0.99 0.02 0.00 0.00 176.95 177.77 3b8p s THR 57 N -0.80 2.09 0.18 2.01 2.01 -1.26 -1.61 115.64 118.25 3b8p s THR 57 Ca 0.09 -1.30 -0.08 0.00 0.31 0.00 0.00 61.69 60.71 3b8p s THR 57 Cb -0.09 -2.06 -0.06 0.00 0.01 0.00 0.00 72.50 70.29 3b8p s THR 57 CO 0.02 0.23 0.47 -0.55 -0.69 0.00 0.00 174.62 174.11 3b8p s SER 58 N 1.20 6.60 -0.02 3.53 0.15 0.46 -4.61 113.70 121.00 3b8p s SER 58 Ca -0.02 0.81 0.00 0.00 0.70 0.00 0.00 55.95 57.43 3b8p s SER 58 Cb -0.17 -2.18 0.03 0.00 -1.71 0.00 0.00 66.02 61.99 3b8p s SER 58 CO -0.09 0.01 0.02 -0.89 1.20 0.00 0.00 173.24 173.49 3b8p s THR 59 N -1.69 0.02 0.17 6.45 2.01 -1.26 -1.30 115.64 120.04 3b8p s THR 59 Ca 0.43 0.15 0.11 0.00 0.31 0.00 0.00 61.69 62.69 3b8p s THR 59 Cb -0.12 -0.14 -0.04 0.00 0.01 0.00 0.00 72.50 72.21 3b8p s THR 59 CO 0.22 0.10 -0.25 0.00 -0.69 0.00 0.00 174.62 174.00 3b8p s ALA 60 N 0.94 2.47 -0.15 7.40 0.00 0.45 -1.29 121.76 131.58 3b8p s ALA 60 Ca -0.08 -1.58 0.01 0.00 0.00 0.00 0.00 51.96 50.31 3b8p s ALA 60 Cb -0.12 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.67 3b8p s ALA 60 CO -0.02 0.46 -0.19 0.42 0.00 0.00 0.00 175.76 176.43 3b8p s ILE 61 N -1.49 2.34 0.19 0.00 1.01 -1.26 0.16 121.20 122.15 3b8p s ILE 61 Ca 0.18 -0.88 0.07 0.00 0.00 0.00 0.00 60.65 60.03 3b8p s ILE 61 Cb -0.08 -1.96 -0.05 0.00 0.01 0.00 0.00 42.46 40.38 3b8p s ILE 61 CO 0.09 0.53 -0.14 0.27 0.00 0.00 0.00 174.94 175.69 3b8p s ILE 62 N 0.83 1.66 0.00 2.92 -4.36 -0.27 -0.16 121.20 121.83 3b8p s ILE 62 Ca -0.06 -2.15 0.00 0.00 -0.26 0.00 0.00 60.65 58.18 3b8p s ILE 62 Cb -0.15 -1.98 0.00 0.00 1.25 0.00 0.00 42.46 41.57 3b8p s ILE 62 CO -0.01 -0.59 0.00 1.07 0.24 0.00 0.00 174.94 175.65 3b8p n THR 63 N -0.27 0.00 -2.47 8.37 5.66 -0.56 -1.06 114.28 123.95 3b8p n THR 63 Ca -0.09 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.55 3b8p n THR 63 Cb 0.60 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.35 3b8p n THR 63 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3b8p s GLN 64 N -1.22 3.92 0.50 1.09 -2.07 -1.26 -2.77 119.66 117.84 3b8p s GLN 64 Ca 0.00 1.52 -0.22 0.00 -1.82 0.00 0.00 55.36 54.84 3b8p s GLN 64 Cb 0.00 -2.34 -0.06 0.00 -1.09 0.00 0.00 33.01 29.52 3b8p s GLN 64 CO 0.00 -0.36 1.18 -1.25 -1.32 0.00 0.00 175.29 173.55 3b8p s PRO 65 N -2.82 3.53 0.83 9.60 0.04 -1.26 -4.21 135.00 140.71 3b8p s PRO 65 Ca 0.63 1.80 -0.12 0.00 0.04 0.00 0.00 61.00 63.35 3b8p s PRO 65 Cb -0.22 -2.26 0.09 0.00 0.04 0.00 0.00 34.50 32.15 3b8p s PRO 65 CO 0.26 -0.75 1.10 0.16 0.04 0.00 0.00 177.00 177.81 3b8p s ASP 66 N -1.42 4.17 0.15 6.66 3.84 -1.26 -4.81 116.67 124.01 3b8p s ASP 66 Ca 0.68 1.31 -0.26 0.00 -0.00 0.00 0.00 52.55 54.28 3b8p s ASP 66 Cb -0.29 -2.01 0.02 0.00 -1.38 0.00 0.00 42.92 39.25 3b8p s ASP 66 CO 0.34 -2.17 1.59 0.00 -0.00 0.00 0.00 175.17 174.93 3b8p h ALA 67 N -1.23 -0.35 -0.81 2.11 0.00 -1.97 -2.28 119.26 114.73 3b8p h ALA 67 Ca -0.48 0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.57 3b8p h ALA 67 Cb 1.28 0.79 -0.10 0.00 0.00 0.00 0.00 17.79 19.76 3b8p h ALA 67 CO 0.59 -0.82 -0.48 0.00 0.00 0.00 0.00 179.25 178.54 3b8p n ALA 68 N -3.01 -0.52 0.29 0.00 0.00 -1.26 -0.05 120.51 115.96 3b8p n ALA 68 Ca -0.01 0.69 0.04 0.00 0.00 0.00 0.00 53.44 54.17 3b8p n ALA 68 Cb 0.35 -0.08 0.20 0.00 0.00 0.00 0.00 19.45 19.91 3b8p n ALA 68 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3b8p n GLN 69 N -4.93 0.01 -0.00 0.00 6.02 -0.87 -2.66 117.38 114.94 3b8p n GLN 69 Ca 0.02 0.36 0.03 0.00 -0.01 0.00 0.00 57.00 57.40 3b8p n GLN 69 Cb 0.21 -1.52 -0.05 0.00 1.02 0.00 0.00 30.24 29.91 3b8p n GLN 69 CO 0.00 0.00 0.00 1.55 -1.01 0.00 0.00 177.06 177.60 3b8p n VAL 70 N -1.53 0.00 -0.10 5.09 3.14 0.93 -3.80 118.33 122.06 3b8p n VAL 70 Ca 0.02 -0.21 -0.03 0.00 -2.96 0.00 0.00 64.34 61.16 3b8p n VAL 70 Cb 0.10 0.56 -0.02 0.00 -1.06 0.00 0.00 33.84 33.42 3b8p n VAL 70 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3b8p n ALA 71 N -1.54 -0.15 -0.29 1.55 0.00 0.78 -1.12 120.51 119.75 3b8p n ALA 71 Ca -0.00 0.20 -0.04 0.00 0.00 0.00 0.00 53.44 53.59 3b8p n ALA 71 Cb 0.15 0.35 -0.02 0.00 0.00 0.00 0.00 19.45 19.93 3b8p n ALA 71 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3b8p n THR 72 N -3.52 -0.42 -0.01 0.00 -1.04 -1.26 0.04 114.28 108.06 3b8p n THR 72 Ca 0.00 1.69 -0.07 0.00 -2.04 0.00 0.00 64.05 63.63 3b8p n THR 72 Cb 0.06 -2.17 0.10 0.00 -1.82 0.00 0.00 70.33 66.51 3b8p n THR 72 CO 0.00 0.00 0.00 0.22 -0.64 0.00 0.00 175.07 174.65 3b8p h TYR 73 N 0.00 0.69 -0.10 -1.42 3.20 -1.53 -3.00 116.97 114.81 3b8p h TYR 73 Ca 0.19 -0.19 -0.07 0.00 3.14 0.00 0.00 58.73 61.79 3b8p h TYR 73 Cb 0.37 -0.15 0.00 0.00 1.54 0.00 0.00 36.73 38.49 3b8p h TYR 73 CO -0.67 0.88 -0.20 1.15 -1.64 0.00 0.00 178.16 177.68 3b8p h THR 74 N 0.48 1.39 -0.58 1.81 2.02 0.12 -2.96 112.91 115.20 3b8p h THR 74 Ca 0.04 -1.49 0.09 0.00 0.77 0.00 0.00 66.41 65.82 3b8p h THR 74 Cb 0.89 2.12 -0.11 0.00 -1.74 0.00 0.00 68.15 69.31 3b8p h THR 74 CO 0.08 0.43 -0.40 0.78 0.37 0.00 0.00 175.52 176.77 3b8p h ASN 75 N -0.13 -1.39 -0.96 4.18 4.21 -0.78 0.51 115.58 121.22 3b8p h ASN 75 Ca 0.00 0.24 0.23 0.00 1.21 0.00 0.00 56.30 57.98 3b8p h ASN 75 Cb 0.79 0.65 -0.07 0.00 -1.12 0.00 0.00 38.32 38.57 3b8p h ASN 75 CO 0.05 -0.33 0.63 0.00 -1.29 0.00 0.00 177.43 176.49 3b8p h ALA 76 N 0.73 2.24 0.01 -0.83 0.00 -1.50 0.06 119.26 119.97 3b8p h ALA 76 Ca 0.20 0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.93 3b8p h ALA 76 Cb 0.56 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 3b8p h ALA 76 CO -0.68 -0.56 -0.97 -0.07 0.00 0.00 0.00 179.25 176.96 3b8p h LEU 77 N 0.39 0.04 -0.79 0.00 3.38 0.06 -2.81 115.31 115.58 3b8p h LEU 77 Ca 0.51 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.44 3b8p h LEU 77 Cb 1.31 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.04 3b8p h LEU 77 CO -0.21 0.98 0.00 0.78 0.09 0.00 0.00 178.44 180.09 3b8p h ASN 78 N 0.01 0.00 0.00 -0.43 4.21 0.11 -1.74 115.58 117.74 3b8p h ASN 78 Ca -0.02 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.49 3b8p h ASN 78 Cb 1.69 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.89 3b8p h ASN 78 CO 0.13 0.00 0.00 0.52 -1.29 0.00 0.00 177.43 176.79 3b8p n VAL 79 N -2.39 0.00 0.28 2.81 0.31 -0.65 -3.15 118.33 115.54 3b8p n VAL 79 Ca 0.02 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.40 3b8p n VAL 79 Cb 0.25 -0.09 0.29 0.00 -0.91 0.00 0.00 33.84 33.38 3b8p n VAL 79 CO 0.00 0.00 0.00 0.17 -1.32 0.00 0.00 176.83 175.68 3b8p h LEU 80 N 0.00 0.00 0.00 7.52 -0.00 -1.57 0.31 115.31 121.57 3b8p h LEU 80 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 3b8p h LEU 80 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 3b8p h LEU 80 CO 0.00 0.00 -0.09 -1.22 -0.00 0.00 0.00 178.44 177.13 3b8p n TYR 81 N -2.42 0.00 0.00 0.17 4.01 -0.66 -5.02 117.16 113.24 3b8p n TYR 81 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.73 3b8p n TYR 81 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.71 3b8p n TYR 81 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3b8p n GLY 82 N 1.08 0.22 0.00 2.72 0.00 0.11 -0.89 105.19 108.42 3b8p n GLY 82 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.66 1.03 -0.02 0.00 -1.26 -4.69 105.19 100.91 3b8p n GLY 83 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.00 3.41 -4.77 1.61 4.13 -0.07 -4.95 115.26 114.61 3b8p n ASN 84 Ca 0.00 -1.97 -0.41 0.00 1.68 0.00 0.00 54.58 53.89 3b8p n ASN 84 Cb 0.22 -0.33 -0.02 0.00 -1.54 0.00 0.00 39.78 38.11 3b8p n ASN 84 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3b8p s ALA 85 N -1.09 3.48 0.81 5.41 0.00 -1.25 -5.00 121.76 124.13 3b8p s ALA 85 Ca 0.36 1.25 -0.11 0.00 0.00 0.00 0.00 51.96 53.47 3b8p s ALA 85 Cb 0.20 -3.48 0.08 0.00 0.00 0.00 0.00 23.12 19.92 3b8p s ALA 85 CO 0.26 -0.65 1.09 -2.14 0.00 0.00 0.00 175.76 174.32 3b8p s PRO 86 N -1.83 1.93 0.73 0.00 0.02 -1.26 -5.01 135.00 129.58 3b8p s PRO 86 Ca 0.49 0.90 -0.11 0.00 0.02 0.00 0.00 61.00 62.30 3b8p s PRO 86 Cb -0.39 -1.88 0.03 0.00 0.02 0.00 0.00 34.50 32.28 3b8p s PRO 86 CO 0.52 -1.80 1.08 -1.59 -0.33 0.00 0.00 177.00 174.89 3b8p s LYS 87 N -4.98 2.57 0.27 5.54 0.00 -1.26 -4.84 119.74 117.04 3b8p s LYS 87 Ca 0.62 1.14 -0.04 0.00 0.00 0.00 0.00 55.97 57.69 3b8p s LYS 87 Cb -0.16 -1.94 0.36 0.00 0.00 0.00 0.00 37.83 36.09 3b8p s LYS 87 CO 0.56 -1.40 1.92 -0.84 0.00 0.00 0.00 175.35 175.59 3b8p h ILE 88 N -0.79 1.23 -0.40 3.79 -2.65 -1.99 -0.50 117.51 116.21 3b8p h ILE 88 Ca -0.44 -0.52 0.05 0.00 1.03 0.00 0.00 64.86 64.98 3b8p h ILE 88 Cb 1.23 0.07 -0.07 0.00 -2.05 0.00 0.00 36.82 35.99 3b8p h ILE 88 CO 0.53 0.24 -0.47 0.28 0.03 0.00 0.00 178.15 178.77 3b8p h SER 89 N 1.14 -1.60 -0.58 2.16 0.02 -1.99 0.46 113.55 113.16 3b8p h SER 89 Ca 0.30 0.21 0.15 0.00 -0.84 0.00 0.00 61.79 61.61 3b8p h SER 89 Cb -0.04 0.66 -0.03 0.00 0.14 0.00 0.00 62.40 63.14 3b8p h SER 89 CO -0.05 -0.32 0.41 -0.33 -1.14 0.00 0.00 176.83 175.39 3b8p h GLU 90 N -0.29 0.09 0.08 3.45 5.08 -1.71 -1.64 114.58 119.63 3b8p h GLU 90 Ca 0.07 -0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3b8p h GLU 90 Cb 0.48 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.71 3b8p h GLU 90 CO -0.54 0.06 -0.04 0.28 -1.00 0.00 0.00 179.01 177.77 3b8p h VAL 91 N 0.09 0.81 -0.69 3.13 2.07 0.14 -2.53 116.25 119.26 3b8p h VAL 91 Ca 0.28 -1.40 0.14 0.00 0.82 0.00 0.00 66.70 66.53 3b8p h VAL 91 Cb 0.97 1.46 -0.13 0.00 -1.52 0.00 0.00 31.29 32.07 3b8p h VAL 91 CO -0.03 0.25 -0.21 1.56 0.02 0.00 0.00 177.57 179.16 3b8p h GLN 92 N -0.96 -0.03 -0.35 1.57 4.20 -0.60 0.38 115.11 119.32 3b8p h GLN 92 Ca -0.01 0.00 0.08 0.00 0.06 0.00 0.00 58.65 58.78 3b8p h GLN 92 Cb 0.49 0.01 -0.08 0.00 0.30 0.00 0.00 27.48 28.20 3b8p h GLN 92 CO 0.02 -0.02 -0.21 0.00 -0.67 0.00 0.00 178.83 177.95 3b8p h ALA 93 N 1.57 0.03 -0.55 3.87 0.00 -1.37 -1.83 119.26 120.98 3b8p h ALA 93 Ca 0.32 0.12 -0.03 0.00 0.00 0.00 0.00 54.91 55.32 3b8p h ALA 93 Cb 0.53 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 3b8p h ALA 93 CO -0.73 -0.59 0.22 -0.97 0.00 0.00 0.00 179.25 177.18 3b8p h ASN 94 N -0.16 0.73 0.52 0.00 -0.73 -0.53 -1.58 115.58 113.82 3b8p h ASN 94 Ca 0.18 -0.09 -0.03 0.00 1.87 0.00 0.00 56.30 58.23 3b8p h ASN 94 Cb 0.43 -0.19 0.01 0.00 0.27 0.00 0.00 38.32 38.84 3b8p h ASN 94 CO -0.45 0.66 -0.25 -0.26 -0.37 0.00 0.00 177.43 176.77 3b8p h PHE 95 N 0.79 -0.64 -0.79 0.67 -1.00 -0.38 0.34 116.94 115.92 3b8p h PHE 95 Ca 0.19 -0.02 0.09 0.00 2.81 0.00 0.00 57.97 61.05 3b8p h PHE 95 Cb 0.16 0.21 -0.05 0.00 3.61 0.00 0.00 35.95 39.88 3b8p h PHE 95 CO 0.01 -0.40 0.52 0.97 -1.61 0.00 0.00 178.31 177.80 3b8p h ILE 96 N -0.80 0.96 0.18 -0.55 6.09 -1.35 0.85 117.51 122.89 3b8p h ILE 96 Ca -0.07 -0.26 0.01 0.00 -1.37 0.00 0.00 64.86 63.18 3b8p h ILE 96 Cb 0.53 0.15 -0.04 0.00 0.47 0.00 0.00 36.82 37.93 3b8p h ILE 96 CO 0.12 0.14 -0.41 -1.28 -3.07 0.00 0.00 178.15 173.64 3b8p h SER 97 N 0.74 -1.20 -0.92 2.19 0.87 -1.14 -1.66 113.55 112.44 3b8p h SER 97 Ca 0.36 0.13 0.20 0.00 -1.23 0.00 0.00 61.79 61.25 3b8p h SER 97 Cb 0.42 0.44 -0.11 0.00 -0.44 0.00 0.00 62.40 62.71 3b8p h SER 97 CO -0.14 -0.50 0.47 0.03 -0.53 0.00 0.00 176.83 176.16 3b8p h ARG 98 N -0.69 0.52 0.73 2.24 2.47 0.13 -1.22 114.38 118.56 3b8p h ARG 98 Ca 0.01 -0.03 -0.04 0.00 -1.26 0.00 0.00 59.98 58.66 3b8p h ARG 98 Cb 0.69 -0.12 0.01 0.00 -1.65 0.00 0.00 29.97 28.90 3b8p h ARG 98 CO -0.20 0.34 -0.35 0.35 0.56 0.00 0.00 179.97 180.67 3b8p h PHE 99 N 0.53 -0.91 -0.42 3.04 3.57 -0.71 -2.39 116.94 119.66 3b8p h PHE 99 Ca 0.55 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.98 3b8p h PHE 99 Cb 0.97 0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.99 3b8p h PHE 99 CO -0.08 -0.56 0.03 0.66 -2.23 0.00 0.00 178.31 176.13 3b8p h SER 100 N -1.01 0.62 -1.01 0.41 4.64 -0.89 0.16 113.55 116.48 3b8p h SER 100 Ca -0.10 -0.12 0.03 0.00 -0.47 0.00 0.00 61.79 61.13 3b8p h SER 100 Cb 0.76 -0.16 -0.06 0.00 -0.31 0.00 0.00 62.40 62.63 3b8p h SER 100 CO 0.16 0.67 0.66 0.28 -0.87 0.00 0.00 176.83 177.74 3b8p h SER 101 N 0.63 1.12 0.15 4.97 0.02 -1.18 -0.10 113.55 119.17 3b8p h SER 101 Ca 0.13 -0.02 -0.23 0.00 -0.84 0.00 0.00 61.79 60.83 3b8p h SER 101 Cb 0.35 -0.27 0.01 0.00 0.14 0.00 0.00 62.40 62.63 3b8p h SER 101 CO 0.01 0.78 -0.91 0.00 -1.14 0.00 0.00 176.83 175.57 3b8p h ALA 102 N 1.40 0.33 -0.71 3.77 0.00 -0.68 -3.00 119.26 120.37 3b8p h ALA 102 Ca 0.39 -0.67 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 3b8p h ALA 102 Cb -0.06 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 3b8p h ALA 102 CO -0.11 0.75 0.39 0.35 0.00 0.00 0.00 179.25 180.63 3b8p h PHE 103 N 0.33 0.96 -0.00 0.00 3.57 -0.18 0.00 116.94 121.63 3b8p h PHE 103 Ca -0.08 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.40 3b8p h PHE 103 Cb 1.54 -0.31 0.00 0.00 2.79 0.00 0.00 35.95 39.97 3b8p h PHE 103 CO 0.07 0.67 -0.03 -1.13 -2.23 0.00 0.00 178.31 175.67 3b8p n SER 104 N -4.36 0.03 0.06 0.41 3.41 -0.10 -1.84 113.62 111.23 3b8p n SER 104 Ca 0.07 0.39 -0.22 0.00 -0.26 0.00 0.00 58.87 58.85 3b8p n SER 104 Cb 0.10 -0.44 -0.15 0.00 -0.26 0.00 0.00 64.21 63.46 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 3.05 0.21 0.31 7.33 0.00 -0.93 -2.84 119.26 126.38 3b8p h ALA 105 Ca 0.00 -1.18 -0.00 0.00 0.00 0.00 0.00 54.91 53.73 3b8p h ALA 105 Cb 0.48 0.49 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 3b8p h ALA 105 CO 0.00 1.08 -0.29 1.25 0.00 0.00 0.00 179.25 181.29 3b8p h LEU 106 N 0.10 -0.76 -0.73 0.00 6.46 -0.98 -0.89 115.31 118.50 3b8p h LEU 106 Ca -0.35 0.07 0.15 0.00 -0.12 0.00 0.00 57.88 57.63 3b8p h LEU 106 Cb 2.09 0.26 -0.14 0.00 -0.73 0.00 0.00 40.66 42.14 3b8p h LEU 106 CO 0.16 -0.42 -0.13 -1.28 -0.62 0.00 0.00 178.44 176.16 3b8p h SER 107 N -0.62 -0.59 -0.84 1.25 0.87 -1.46 0.14 113.55 112.29 3b8p h SER 107 Ca -0.02 0.21 0.04 0.00 -1.23 0.00 0.00 61.79 60.80 3b8p h SER 107 Cb 0.56 0.42 -0.05 0.00 -0.44 0.00 0.00 62.40 62.89 3b8p h SER 107 CO -0.04 -0.23 0.54 -0.33 -0.53 0.00 0.00 176.83 176.23 3b8p h GLU 108 N 0.02 0.99 0.79 2.24 4.39 -1.07 -2.65 114.58 119.30 3b8p h GLU 108 Ca 0.37 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.97 3b8p h GLU 108 Cb 0.59 -0.22 0.01 0.00 -0.10 0.00 0.00 28.75 29.02 3b8p h GLU 108 CO -0.73 0.66 -0.38 0.28 -1.16 0.00 0.00 179.01 177.68 3b8p h VAL 109 N 1.02 0.00 -0.49 3.13 2.07 0.16 -3.01 116.25 119.13 3b8p h VAL 109 Ca 0.35 -0.17 0.14 0.00 0.82 0.00 0.00 66.70 67.84 3b8p h VAL 109 Cb 0.06 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.81 3b8p h VAL 109 CO -0.13 0.00 0.62 -0.07 0.02 0.00 0.00 177.57 178.01 3b8p h LEU 110 N -1.22 0.00 0.07 2.57 3.38 -0.71 0.19 115.31 119.59 3b8p h LEU 110 Ca -0.11 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.73 3b8p h LEU 110 Cb 0.81 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.57 3b8p h LEU 110 CO 0.18 0.00 -0.57 -0.78 0.09 0.00 0.00 178.44 177.35 3b8p h ASP 111 N 0.00 0.38 0.00 -0.43 -0.00 -1.45 0.94 116.42 115.87 3b8p h ASP 111 Ca 0.23 -0.89 0.00 0.00 -0.00 0.00 0.00 57.03 56.37 3b8p h ASP 111 Cb 1.47 -0.12 0.00 0.00 -0.00 0.00 0.00 39.33 40.68 3b8p h ASP 111 CO -0.00 1.24 0.02 -1.13 -0.00 0.00 0.00 179.24 179.37 3b8p h ASN 112 N -0.42 0.00 -3.94 2.28 -0.00 -0.48 -3.38 115.58 109.65 3b8p h ASN 112 Ca -0.09 0.00 -0.55 0.00 -0.00 0.00 0.00 56.30 55.65 3b8p h ASN 112 Cb 1.39 0.00 0.14 0.00 -0.00 0.00 0.00 38.32 39.85 3b8p h ASN 112 CO 0.11 0.00 0.59 0.00 -0.00 0.00 0.00 177.43 178.13 3b8p n GLN 113 N -2.62 1.78 -0.24 6.67 6.02 -1.13 -4.92 117.38 122.93 3b8p n GLN 113 Ca -0.02 0.65 -0.09 0.00 -0.01 0.00 0.00 57.00 57.53 3b8p n GLN 113 Cb 0.07 -2.55 -0.05 0.00 1.02 0.00 0.00 30.24 28.73 3b8p n GLN 113 CO 0.00 0.00 0.00 1.57 -1.01 0.00 0.00 177.06 177.62 3b8p h LYS 114 N 1.61 -0.20 -5.46 -1.09 5.09 -1.94 -2.60 116.57 111.98 3b8p h LYS 114 Ca -0.50 0.01 -0.64 0.00 0.09 0.00 0.00 60.65 59.61 3b8p h LYS 114 Cb 1.30 0.05 -0.14 0.00 0.10 0.00 0.00 32.23 33.54 3b8p h LYS 114 CO 0.58 -0.14 0.14 -2.00 -2.09 0.00 0.00 179.45 175.94 3b8p s GLU 115 N -5.76 3.55 0.49 0.07 -6.30 -1.26 -5.02 118.70 104.47 3b8p s GLU 115 Ca -0.14 -0.09 -0.23 0.00 -2.50 0.00 0.00 54.97 52.01 3b8p s GLU 115 Cb 0.12 -3.86 -0.06 0.00 0.00 0.00 0.00 34.13 30.34 3b8p s GLU 115 CO 0.65 -0.83 1.34 1.03 0.02 0.00 0.00 175.26 177.47 3b8p s ARG 116 N 2.75 3.45 0.01 4.30 0.52 -0.98 -5.01 118.95 123.99 3b8p s ARG 116 Ca 0.24 2.20 0.05 0.00 -0.52 0.00 0.00 55.73 57.69 3b8p s ARG 116 Cb -0.14 -2.43 -0.01 0.00 0.52 0.00 0.00 34.95 32.88 3b8p s ARG 116 CO 0.16 -0.93 -0.14 -2.00 0.02 0.00 0.00 175.30 172.41 3b8p s GLU 117 N -2.69 1.09 -0.38 3.54 2.12 0.33 -5.01 118.70 117.69 3b8p s GLU 117 Ca 0.66 -0.60 -0.03 0.00 0.36 0.00 0.00 54.97 55.36 3b8p s GLU 117 Cb -0.39 -1.08 0.09 0.00 0.26 0.00 0.00 34.13 33.01 3b8p s GLU 117 CO 0.48 0.29 0.16 0.21 -0.54 0.00 0.00 175.26 175.85 3b8p s LYS 118 N -0.62 2.14 -0.04 4.30 2.47 -1.26 -3.25 119.74 123.47 3b8p s LYS 118 Ca 0.04 -1.66 0.03 0.00 -1.56 0.00 0.00 55.97 52.83 3b8p s LYS 118 Cb -0.06 -3.49 -0.03 0.00 -1.46 0.00 0.00 37.83 32.79 3b8p s LYS 118 CO 0.00 -0.95 -0.13 -1.17 0.16 0.00 0.00 175.35 173.26 3b8p s LEU 119 N 1.19 2.80 -0.03 5.43 0.20 -1.26 -2.58 118.68 124.43 3b8p s LEU 119 Ca 0.05 -0.18 0.03 0.00 0.69 0.00 0.00 54.13 54.71 3b8p s LEU 119 Cb -0.22 -1.58 0.00 0.00 -0.43 0.00 0.00 46.19 43.96 3b8p s LEU 119 CO -0.03 0.34 -0.10 -0.89 -0.29 0.00 0.00 176.35 175.38 3b8p s THR 120 N -0.77 0.89 -0.08 3.68 2.01 0.50 -4.78 115.64 117.10 3b8p s THR 120 Ca 0.12 -0.43 -0.01 0.00 0.31 0.00 0.00 61.69 61.69 3b8p s THR 120 Cb -0.11 -0.79 0.03 0.00 0.01 0.00 0.00 72.50 71.64 3b8p s THR 120 CO 0.01 0.27 -0.03 -0.51 -0.69 0.00 0.00 174.62 173.67 3b8p s ILE 121 N 0.14 0.62 0.04 1.82 2.07 -1.26 -1.12 121.20 123.51 3b8p s ILE 121 Ca -0.03 -0.05 -0.09 0.00 -1.41 0.00 0.00 60.65 59.07 3b8p s ILE 121 Cb -0.09 -0.72 0.00 0.00 0.13 0.00 0.00 42.46 41.79 3b8p s ILE 121 CO 0.01 0.29 0.19 -1.83 -1.91 0.00 0.00 174.94 171.69 3b8p s GLU 122 N 1.76 0.70 0.06 3.50 -1.05 -0.61 -4.98 118.70 118.08 3b8p s GLU 122 Ca 0.03 -0.65 -0.31 0.00 -0.15 0.00 0.00 54.97 53.90 3b8p s GLU 122 Cb -0.13 0.29 -0.08 0.00 -0.44 0.00 0.00 34.13 33.78 3b8p s GLU 122 CO -0.06 -0.20 1.54 -0.65 0.95 0.00 0.00 175.26 176.84 3b8p s GLN 123 N -2.62 4.24 0.16 -4.83 -0.21 -1.26 -0.30 119.66 114.84 3b8p s GLN 123 Ca -0.05 2.20 -0.23 0.00 0.02 0.00 0.00 55.36 57.30 3b8p s GLN 123 Cb -0.01 -3.52 0.05 0.00 1.00 0.00 0.00 33.01 30.54 3b8p s GLN 123 CO -0.04 -0.64 1.60 0.77 -2.12 0.00 0.00 175.29 174.85 3b8p h SER 124 N 7.89 -1.10 -3.80 5.90 0.02 -1.21 -3.31 113.55 117.94 3b8p h SER 124 Ca -0.41 0.19 -0.64 0.00 -0.84 0.00 0.00 61.79 60.09 3b8p h SER 124 Cb 1.20 0.51 -0.19 0.00 0.14 0.00 0.00 62.40 64.06 3b8p h SER 124 CO 0.91 -0.33 -0.56 -0.69 -1.14 0.00 0.00 176.83 175.03 3b8p s VAL 125 N -5.99 4.96 0.15 2.27 1.01 -1.26 -5.00 120.40 116.54 3b8p s VAL 125 Ca -0.15 0.04 -0.33 0.00 0.00 0.00 0.00 61.98 61.54 3b8p s VAL 125 Cb 0.13 -3.35 -0.13 0.00 0.00 0.00 0.00 36.38 33.03 3b8p s VAL 125 CO 0.68 0.27 1.63 0.29 0.00 0.00 0.00 175.10 177.97 3b8p n LYS 126 N 5.01 2.29 -1.12 2.72 4.01 -1.25 -1.71 118.16 128.12 3b8p n LYS 126 Ca -0.15 0.83 -0.04 0.00 -0.51 0.00 0.00 58.31 58.44 3b8p n LYS 126 Cb 0.52 -2.62 -0.02 0.00 -0.51 0.00 0.00 35.03 32.40 3b8p n LYS 126 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3b8p n GLY 127 N 3.61 0.70 3.29 0.72 0.00 -1.26 -5.03 105.19 107.22 3b8p n GLY 127 Ca 0.17 -0.84 -0.30 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.29 1.92 0.07 1.61 0.74 -0.69 -5.08 119.66 115.94 3b8p s GLN 128 Ca 0.00 -0.90 -0.20 0.00 0.05 0.00 0.00 55.36 54.30 3b8p s GLN 128 Cb 0.00 -1.90 -0.11 0.00 1.10 0.00 0.00 33.01 32.10 3b8p s GLN 128 CO 0.00 0.52 1.51 0.00 -0.55 0.00 0.00 175.29 176.76 3b8p h ALA 129 N 5.41 0.23 -3.01 1.58 0.00 -1.96 -3.43 119.26 118.08 3b8p h ALA 129 Ca -0.42 -0.19 -0.27 0.00 0.00 0.00 0.00 54.91 54.02 3b8p h ALA 129 Cb 1.13 -0.06 -0.20 0.00 0.00 0.00 0.00 17.79 18.65 3b8p h ALA 129 CO 0.47 -0.07 -0.73 -0.51 0.00 0.00 0.00 179.25 178.41 3b8p s LEU 130 N -9.54 2.30 0.73 0.00 1.43 -1.26 -4.73 118.68 107.61 3b8p s LEU 130 Ca -0.14 -0.63 -0.12 0.00 -1.03 0.00 0.00 54.13 52.21 3b8p s LEU 130 Cb 0.06 -0.16 0.03 0.00 0.03 0.00 0.00 46.19 46.15 3b8p s LEU 130 CO 0.72 -0.25 1.11 -2.16 0.23 0.00 0.00 176.35 176.00 3b8p s PRO 131 N -1.99 2.68 0.03 1.29 0.04 -1.26 -4.89 135.00 130.89 3b8p s PRO 131 Ca -0.06 0.43 0.01 0.00 0.04 0.00 0.00 61.00 61.42 3b8p s PRO 131 Cb -0.07 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.43 3b8p s PRO 131 CO -0.00 -1.16 0.10 -0.51 0.04 0.00 0.00 177.00 175.47 3b8p s LEU 132 N -5.43 3.94 -0.27 -3.56 2.01 -0.22 -0.73 118.68 114.43 3b8p s LEU 132 Ca 0.59 0.12 -0.04 0.00 0.01 0.00 0.00 54.13 54.81 3b8p s LEU 132 Cb -0.11 -2.43 0.01 0.00 0.01 0.00 0.00 46.19 43.67 3b8p s LEU 132 CO 0.52 0.23 0.01 -0.44 1.01 0.00 0.00 176.35 177.68 3b8p s SER 133 N -2.03 4.73 -0.04 2.29 0.01 0.59 -1.11 113.70 118.13 3b8p s SER 133 Ca 0.26 -0.72 -0.02 0.00 1.31 0.00 0.00 55.95 56.78 3b8p s SER 133 Cb -0.12 -1.78 -0.04 0.00 0.21 0.00 0.00 66.02 64.29 3b8p s SER 133 CO 0.18 -0.14 0.07 0.68 0.41 0.00 0.00 173.24 174.43 3b8p s VAL 134 N 1.43 4.71 0.03 3.43 -7.23 0.12 -1.57 120.40 121.32 3b8p s VAL 134 Ca 0.02 -0.28 -0.13 0.00 -1.81 0.00 0.00 61.98 59.78 3b8p s VAL 134 Cb -0.17 -3.09 0.02 0.00 0.56 0.00 0.00 36.38 33.70 3b8p s VAL 134 CO -0.01 0.46 0.27 -0.94 -0.31 0.00 0.00 175.10 174.58 3b8p s SER 135 N -1.40 -0.10 -0.04 4.85 1.04 -0.28 -0.41 113.70 117.35 3b8p s SER 135 Ca 0.19 -0.17 -0.03 0.00 0.48 0.00 0.00 55.95 56.42 3b8p s SER 135 Cb -0.12 0.33 0.02 0.00 0.10 0.00 0.00 66.02 66.35 3b8p s SER 135 CO 0.09 -0.55 0.11 -0.47 0.98 0.00 0.00 173.24 173.39 3b8p s TYR 136 N -2.22 -0.11 -0.14 5.02 5.04 -0.42 -0.37 117.35 124.15 3b8p s TYR 136 Ca -0.07 0.31 -0.07 0.00 -2.44 0.00 0.00 57.07 54.80 3b8p s TYR 136 Cb -0.02 -0.02 -0.04 0.00 0.35 0.00 0.00 41.96 42.23 3b8p s TYR 136 CO -0.01 -0.08 0.11 0.54 -1.34 0.00 0.00 175.55 174.76 3b8p s VAL 137 N 0.42 5.28 -0.10 3.14 0.11 -1.06 -0.40 120.40 127.79 3b8p s VAL 137 Ca -0.03 0.13 -0.30 0.00 -2.93 0.00 0.00 61.98 58.85 3b8p s VAL 137 Cb -0.04 -3.32 0.07 0.00 -1.53 0.00 0.00 36.38 31.56 3b8p s VAL 137 CO -0.02 0.57 0.69 -0.55 -3.33 0.00 0.00 175.10 172.46 3b8p s SER 138 N -0.61 -0.68 0.06 3.54 0.15 -0.63 -4.55 113.70 110.98 3b8p s SER 138 Ca 0.12 0.87 -0.01 0.00 0.70 0.00 0.00 55.95 57.64 3b8p s SER 138 Cb -0.12 0.73 0.12 0.00 -1.71 0.00 0.00 66.02 65.05 3b8p s SER 138 CO 0.02 -0.53 0.31 0.41 1.20 0.00 0.00 173.24 174.65 3b8p n THR 139 N 1.28 -0.08 -4.37 6.45 -1.04 -1.26 -1.41 114.28 113.85 3b8p n THR 139 Ca -0.18 0.45 -0.26 0.00 -2.04 0.00 0.00 64.05 62.02 3b8p n THR 139 Cb 0.57 -0.63 -0.10 0.00 -1.82 0.00 0.00 70.33 68.34 3b8p n THR 139 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3b8p s THR 140 N -5.10 2.83 0.00 12.58 -1.32 -1.26 -3.58 115.64 119.79 3b8p s THR 140 Ca -0.03 -1.95 0.00 0.00 -1.21 0.00 0.00 61.69 58.50 3b8p s THR 140 Cb 0.06 -2.42 0.00 0.00 -1.51 0.00 0.00 72.50 68.63 3b8p s THR 140 CO 0.16 -0.20 0.67 0.00 -2.21 0.00 0.00 174.62 173.04 3b8p n ALA 141 N -0.13 -0.15 -0.34 11.08 0.00 -1.26 -2.42 120.51 127.29 3b8p n ALA 141 Ca -0.10 0.00 0.28 0.00 0.00 0.00 0.00 53.44 53.63 3b8p n ALA 141 Cb 0.57 0.04 0.60 0.00 0.00 0.00 0.00 19.45 20.66 3b8p n ALA 141 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 3b8p h GLU 142 N 0.00 0.23 -0.41 0.00 4.81 -1.95 -0.29 114.58 116.97 3b8p h GLU 142 Ca 0.00 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.15 3b8p h GLU 142 Cb 0.00 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 3b8p h GLU 142 CO 0.00 0.15 -0.01 0.78 -0.73 0.00 0.00 179.01 179.20 3b8p h GLY 143 N 0.23 0.72 1.69 1.92 0.00 -1.94 -0.81 103.07 104.89 3b8p h GLY 143 Ca 0.61 -0.46 -0.17 0.00 0.00 0.00 0.00 47.33 47.32 3b8p h GLY 143 CO -0.22 0.43 -0.68 0.00 0.00 0.00 0.00 176.54 176.07 3b8p h ALA 144 N 1.36 0.71 0.62 3.60 0.00 -0.70 -1.89 119.26 122.97 3b8p h ALA 144 Ca 0.13 -0.59 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 3b8p h ALA 144 Cb 0.41 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.13 3b8p h ALA 144 CO 0.02 0.76 -0.30 0.37 0.00 0.00 0.00 179.25 180.10 3b8p h GLN 145 N 0.21 -0.81 -0.02 0.00 4.15 -1.19 -2.79 115.11 114.66 3b8p h GLN 145 Ca -0.02 0.05 0.03 0.00 0.77 0.00 0.00 58.65 59.49 3b8p h GLN 145 Cb 1.23 0.18 -0.04 0.00 0.21 0.00 0.00 27.48 29.06 3b8p h GLN 145 CO 0.11 -0.54 -0.22 0.00 -1.93 0.00 0.00 178.83 176.26 3b8p h ARG 146 N -1.04 -0.32 0.00 1.69 3.08 -1.22 -2.28 114.38 114.30 3b8p h ARG 146 Ca -0.09 0.02 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 3b8p h ARG 146 Cb 0.64 0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.76 3b8p h ARG 146 CO 0.14 -0.21 -0.01 0.07 -1.07 0.00 0.00 179.97 178.88 3b8p h ARG 147 N -0.33 0.00 0.00 0.04 -0.00 -1.42 0.61 114.38 113.27 3b8p h ARG 147 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.05 3b8p h ARG 147 Cb 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.39 3b8p h ARG 147 CO -0.21 0.01 0.00 -0.11 -0.00 0.00 0.00 179.97 179.66 3b8p n LEU 148 N -3.41 0.59 -0.20 0.08 7.94 -0.88 -1.51 117.00 119.61 3b8p n LEU 148 Ca -0.03 0.55 0.14 0.00 -1.11 0.00 0.00 56.01 55.56 3b8p n LEU 148 Cb 0.11 -0.22 0.27 0.00 0.53 0.00 0.00 43.42 44.11 3b8p n LEU 148 CO 0.24 -0.22 0.56 0.00 -1.11 0.00 0.00 177.39 176.86 3b8p n ALA 149 N -1.16 0.47 0.17 1.96 0.00 -0.94 0.80 120.51 121.81 3b8p n ALA 149 Ca 0.00 0.62 -0.07 0.00 0.00 0.00 0.00 53.44 54.00 3b8p n ALA 149 Cb 0.00 -0.55 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 3b8p n ALA 149 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3b8p h GLU 150 N 0.00 -0.41 -0.57 0.00 -0.00 -0.88 -1.36 114.58 111.36 3b8p h GLU 150 Ca 0.44 0.03 0.16 0.00 -0.00 0.00 0.00 59.36 59.99 3b8p h GLU 150 Cb 1.07 0.09 -0.02 0.00 -0.00 0.00 0.00 28.75 29.89 3b8p h GLU 150 CO -0.51 -0.27 0.52 1.88 -0.00 0.00 0.00 179.01 180.63 3b8p h TYR 151 N -0.43 0.00 0.53 2.06 -1.99 0.15 0.19 116.97 117.48 3b8p h TYR 151 Ca -0.04 0.00 -0.03 0.00 2.00 0.00 0.00 58.73 60.66 3b8p h TYR 151 Cb 0.33 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.06 3b8p h TYR 151 CO 0.16 0.00 -0.26 0.82 -0.00 0.00 0.00 178.16 178.88 3b8p h ILE 152 N 0.00 0.00 0.00 -2.88 2.04 -1.17 -3.07 117.51 112.43 3b8p h ILE 152 Ca 0.27 -0.35 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 3b8p h ILE 152 Cb 1.31 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.39 3b8p h ILE 152 CO -0.00 0.00 -0.06 1.56 0.00 0.00 0.00 178.15 179.65 3b8p h GLN 153 N -1.06 0.00 0.00 2.37 4.20 0.21 -1.17 115.11 119.66 3b8p h GLN 153 Ca -0.07 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.64 3b8p h GLN 153 Cb 0.55 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.33 3b8p h GLN 153 CO 0.12 0.06 0.00 0.94 -0.67 0.00 0.00 178.83 179.28 3b8p n GLN 154 N -3.94 0.02 -0.08 1.46 7.27 0.45 -2.11 117.38 120.44 3b8p n GLN 154 Ca -0.03 0.41 -0.16 0.00 0.07 0.00 0.00 57.00 57.29 3b8p n GLN 154 Cb 0.15 -1.54 -0.06 0.00 2.41 0.00 0.00 30.24 31.21 3b8p n GLN 154 CO 0.00 0.00 0.00 0.28 0.07 0.00 0.00 177.06 177.41 3b8p n VAL 155 N -1.57 0.84 -0.27 1.69 0.31 -0.49 -3.90 118.33 114.94 3b8p n VAL 155 Ca 0.01 -0.22 0.08 0.00 -0.01 0.00 0.00 64.34 64.21 3b8p n VAL 155 Cb 0.08 -1.67 0.23 0.00 -0.91 0.00 0.00 33.84 31.56 3b8p n VAL 155 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 3b8p h ASP 156 N -0.52 0.09 0.57 4.52 3.58 -1.32 -0.55 116.42 122.79 3b8p h ASP 156 Ca -0.39 0.16 -0.03 0.00 0.42 0.00 0.00 57.03 57.19 3b8p h ASP 156 Cb 1.35 0.19 0.01 0.00 1.72 0.00 0.00 39.33 42.60 3b8p h ASP 156 CO -0.23 -0.04 -0.27 -0.33 -2.88 0.00 0.00 179.24 175.49 3b8p h GLU 157 N 0.30 -0.74 -1.39 0.28 5.08 -1.66 -1.73 114.58 114.72 3b8p h GLU 157 Ca 0.47 0.05 0.44 0.00 -1.00 0.00 0.00 59.36 59.32 3b8p h GLU 157 Cb 0.85 0.17 -0.11 0.00 0.50 0.00 0.00 28.75 30.15 3b8p h GLU 157 CO -0.54 -0.49 0.92 1.49 -1.00 0.00 0.00 179.01 179.40 3b8p h GLU 158 N -0.91 0.08 0.00 2.33 4.81 -1.45 0.00 114.58 119.44 3b8p h GLU 158 Ca -0.08 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 3b8p h GLU 158 Cb 0.58 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.95 3b8p h GLU 158 CO 0.13 0.05 -0.08 0.28 -0.73 0.00 0.00 179.01 178.66 3b8p h VAL 159 N 0.08 0.84 -0.91 0.32 2.07 -1.15 -3.21 116.25 114.29 3b8p h VAL 159 Ca 0.81 -1.65 0.25 0.00 0.82 0.00 0.00 66.70 66.93 3b8p h VAL 159 Cb 2.67 1.61 -0.14 0.00 -1.52 0.00 0.00 31.29 33.92 3b8p h VAL 159 CO -0.33 0.29 0.36 0.00 0.02 0.00 0.00 177.57 177.90 3b8p h ALA 160 N -0.53 1.48 0.00 1.67 0.00 -0.08 0.43 119.26 122.24 3b8p h ALA 160 Ca -0.02 0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 3b8p h ALA 160 Cb 0.53 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3b8p h ALA 160 CO -0.01 -0.45 -0.13 0.87 0.00 0.00 0.00 179.25 179.52 3b8p h LYS 161 N 0.29 0.00 0.00 0.00 1.57 -1.40 0.39 116.57 117.42 3b8p h LYS 161 Ca 0.60 0.00 -0.15 0.00 -1.87 0.00 0.00 60.65 59.23 3b8p h LYS 161 Cb 1.23 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.51 3b8p h LYS 161 CO -0.61 0.13 -1.25 0.93 -0.57 0.00 0.00 179.45 178.09 3b8p h GLU 162 N 0.00 0.00 0.00 3.15 5.08 -0.23 -2.48 114.58 120.10 3b8p h GLU 162 Ca -0.00 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.17 3b8p h GLU 162 Cb 0.43 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.65 3b8p h GLU 162 CO 0.02 0.31 -0.91 -0.07 -1.00 0.00 0.00 179.01 177.36 3b8p h LEU 163 N 0.00 0.00 0.02 1.33 3.38 -0.20 -1.67 115.31 118.17 3b8p h LEU 163 Ca -0.13 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.84 3b8p h LEU 163 Cb 1.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.28 3b8p h LEU 163 CO 0.05 0.91 -0.01 -0.33 0.09 0.00 0.00 178.44 179.15 3b8p h GLU 164 N 0.00 -0.03 -0.95 1.13 5.08 -0.25 -2.07 114.58 117.48 3b8p h GLU 164 Ca -0.01 0.00 0.22 0.00 -1.00 0.00 0.00 59.36 58.57 3b8p h GLU 164 Cb 1.63 0.01 -0.12 0.00 0.50 0.00 0.00 28.75 30.77 3b8p h GLU 164 CO 0.12 0.40 0.52 0.28 -1.00 0.00 0.00 179.01 179.33 3b8p h VAL 165 N -0.46 0.58 -0.09 3.13 2.07 -1.42 -1.40 116.25 118.65 3b8p h VAL 165 Ca -0.00 -0.20 -0.22 0.00 0.82 0.00 0.00 66.70 67.10 3b8p h VAL 165 Cb 0.44 -0.05 0.01 0.00 -1.52 0.00 0.00 31.29 30.17 3b8p h VAL 165 CO 0.01 0.10 -0.82 0.44 0.02 0.00 0.00 177.57 177.32 3b8p h ASP 166 N 0.57 0.75 -0.47 0.57 5.19 -1.13 -2.24 116.42 119.67 3b8p h ASP 166 Ca 0.59 -0.52 -0.09 0.00 -0.62 0.00 0.00 57.03 56.39 3b8p h ASP 166 Cb 1.04 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 40.31 3b8p h ASP 166 CO -0.46 1.30 -0.05 0.25 -3.12 0.00 0.00 179.24 177.16 3b8p h LEU 167 N 0.41 0.86 -0.16 1.55 6.46 -0.79 -0.93 115.31 122.69 3b8p h LEU 167 Ca -0.06 -0.33 0.05 0.00 -0.12 0.00 0.00 57.88 57.42 3b8p h LEU 167 Cb 1.43 -0.23 -0.06 0.00 -0.73 0.00 0.00 40.66 41.07 3b8p h LEU 167 CO 0.16 0.99 -0.19 0.11 -0.62 0.00 0.00 178.44 178.88 3b8p h LYS 168 N 0.71 -0.22 -0.96 1.25 1.79 -1.31 0.24 116.57 118.07 3b8p h LYS 168 Ca 0.13 0.02 0.05 0.00 -2.18 0.00 0.00 60.65 58.66 3b8p h LYS 168 Cb 0.58 0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 31.22 3b8p h LYS 168 CO 0.03 -0.15 0.62 -0.44 -1.08 0.00 0.00 179.45 178.44 3b8p h ASP 169 N -0.23 1.02 -0.40 0.86 5.19 -1.17 -1.51 116.42 120.18 3b8p h ASP 169 Ca 0.11 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.41 3b8p h ASP 169 Cb 0.39 -0.22 -0.01 0.00 0.18 0.00 0.00 39.33 39.67 3b8p h ASP 169 CO -0.30 0.68 -0.17 0.78 -3.12 0.00 0.00 179.24 177.11 3b8p h ASN 170 N 1.17 0.85 -0.02 6.45 2.35 -0.49 -1.65 115.58 124.24 3b8p h ASN 170 Ca 0.40 -0.40 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 3b8p h ASN 170 Cb 0.08 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.19 3b8p h ASN 170 CO -0.15 1.05 -0.11 0.40 -1.65 0.00 0.00 177.43 176.98 3b8p h ILE 171 N 0.64 0.72 -0.35 2.81 2.04 -0.15 -0.11 117.51 123.09 3b8p h ILE 171 Ca 0.09 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.02 3b8p h ILE 171 Cb 0.72 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.50 3b8p h ILE 171 CO 0.05 0.00 0.24 0.74 0.00 0.00 0.00 178.15 179.19 3b8p h THR 172 N -0.18 0.92 0.07 -0.27 2.02 -1.22 -0.54 112.91 113.71 3b8p h THR 172 Ca 0.05 -0.07 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 3b8p h THR 172 Cb 0.24 0.71 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 3b8p h THR 172 CO -0.13 0.03 -0.04 0.25 0.37 0.00 0.00 175.52 176.01 3b8p h LEU 173 N 0.19 -0.08 -1.22 2.58 6.46 -0.57 -3.09 115.31 119.58 3b8p h LEU 173 Ca 0.16 -0.52 0.08 0.00 -0.12 0.00 0.00 57.88 57.48 3b8p h LEU 173 Cb 0.39 0.02 -0.06 0.00 -0.73 0.00 0.00 40.66 40.29 3b8p h LEU 173 CO -0.03 0.60 0.56 1.56 -0.62 0.00 0.00 178.44 180.51 3b8p h GLN 174 N -0.89 0.87 0.40 1.25 1.08 -0.82 0.71 115.11 117.71 3b8p h GLN 174 Ca -0.01 -0.05 -0.02 0.00 -1.45 0.00 0.00 58.65 57.12 3b8p h GLN 174 Cb 0.59 -0.20 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 3b8p h GLN 174 CO 0.02 0.58 -0.19 1.15 -0.95 0.00 0.00 178.83 179.43 3b8p h THR 175 N 0.90 0.61 0.00 -0.54 2.02 -1.25 -0.79 112.91 113.86 3b8p h THR 175 Ca 0.39 -0.17 -0.04 0.00 0.77 0.00 0.00 66.41 67.36 3b8p h THR 175 Cb 0.32 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 3b8p h THR 175 CO -0.15 0.03 -0.17 0.50 0.37 0.00 0.00 175.52 176.10 3b8p h LYS 176 N -0.63 0.00 0.00 6.66 1.63 -1.33 0.22 116.57 123.13 3b8p h LYS 176 Ca -0.05 0.00 -0.17 0.00 -0.85 0.00 0.00 60.65 59.58 3b8p h LYS 176 Cb 0.47 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.07 3b8p h LYS 176 CO 0.09 0.17 -0.86 0.00 -3.45 0.00 0.00 179.45 175.41 3b8p h THR 177 N 0.00 1.21 -0.02 1.00 1.03 0.49 -2.54 112.91 114.07 3b8p h THR 177 Ca -0.00 -2.76 0.00 0.00 -0.01 0.00 0.00 66.41 63.64 3b8p h THR 177 Cb 0.58 2.58 0.00 0.00 -1.07 0.00 0.00 68.15 70.24 3b8p h THR 177 CO 0.02 0.69 -0.29 0.18 -0.01 0.00 0.00 175.52 176.11 3b8p n LEU 178 N -3.24 1.89 -0.06 0.00 4.77 -0.31 -3.00 117.00 117.04 3b8p n LEU 178 Ca -0.01 -0.65 -0.07 0.00 -0.03 0.00 0.00 56.01 55.26 3b8p n LEU 178 Cb 0.85 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.85 3b8p n LEU 178 CO 0.44 0.34 0.12 1.56 -1.33 0.00 0.00 177.39 178.52 3b8p h GLN 179 N 2.50 0.00 -0.01 3.23 1.08 -0.59 -2.96 115.11 118.37 3b8p h GLN 179 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3b8p h GLN 179 Cb 0.71 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.14 3b8p h GLN 179 CO 0.00 0.45 0.19 1.05 -0.95 0.00 0.00 178.83 179.57 3b8p h GLU 180 N -1.00 0.00 0.07 1.46 9.09 -1.57 -0.60 114.58 122.03 3b8p h GLU 180 Ca -0.01 0.00 -0.21 0.00 0.05 0.00 0.00 59.36 59.19 3b8p h GLU 180 Cb 0.49 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.58 3b8p h GLU 180 CO -0.01 0.00 -1.07 0.66 0.05 0.00 0.00 179.01 178.64 3b8p h SER 181 N 0.00 0.23 0.87 3.06 4.64 -1.65 -3.34 113.55 117.35 3b8p h SER 181 Ca 0.00 -0.81 0.00 0.00 -0.47 0.00 0.00 61.79 60.51 3b8p h SER 181 Cb 0.39 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 3b8p h SER 181 CO -0.00 1.46 0.00 0.18 -0.87 0.00 0.00 176.83 177.60 3b8p n LEU 182 N -4.18 0.47 0.18 5.97 4.77 -0.60 -0.67 117.00 122.94 3b8p n LEU 182 Ca -0.23 0.59 0.08 0.00 -0.03 0.00 0.00 56.01 56.42 3b8p n LEU 182 Cb 0.77 -0.49 0.10 0.00 -2.33 0.00 0.00 43.42 41.46 3b8p n LEU 182 CO 0.35 -0.34 0.60 -0.33 -1.33 0.00 0.00 177.39 176.34 3b8p h GLU 183 N 0.00 0.00 0.00 3.23 4.39 -1.31 -1.40 114.58 119.49 3b8p h GLU 183 Ca 0.00 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.43 3b8p h GLU 183 Cb 0.44 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.04 3b8p h GLU 183 CO 0.00 0.18 -1.94 2.41 -1.16 0.00 0.00 179.01 178.50 3b8p n THR 184 N -3.10 1.31 0.21 1.13 -1.04 -0.92 -3.84 114.28 108.02 3b8p n THR 184 Ca 0.03 -0.78 0.09 0.00 -2.04 0.00 0.00 64.05 61.35 3b8p n THR 184 Cb 0.61 -0.67 0.36 0.00 -1.82 0.00 0.00 70.33 68.81 3b8p n THR 184 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 3b8p h GLN 185 N 0.00 0.00 -0.13 -2.82 4.20 -0.90 -2.43 115.11 113.03 3b8p h GLN 185 Ca -0.34 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.37 3b8p h GLN 185 Cb 1.94 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.72 3b8p h GLN 185 CO 0.05 0.23 0.00 -0.85 -0.67 0.00 0.00 178.83 177.58 3b8p n GLU 186 N -3.29 1.73 -0.00 1.46 0.00 -0.53 -0.23 120.64 119.78 3b8p n GLU 186 Ca 0.01 -1.09 0.09 0.00 0.00 0.00 0.00 57.16 56.16 3b8p n GLU 186 Cb 0.49 -1.42 -0.11 0.00 0.00 0.00 0.00 31.44 30.40 3b8p n GLU 186 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 3b8p n VAL 187 N 0.32 0.00 -0.02 3.84 0.31 -0.96 -3.99 118.33 117.83 3b8p n VAL 187 Ca 0.17 -0.16 0.01 0.00 -0.01 0.00 0.00 64.34 64.36 3b8p n VAL 187 Cb 0.34 0.79 -0.07 0.00 -0.91 0.00 0.00 33.84 33.99 3b8p n VAL 187 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3b8p n VAL 188 N -1.58 0.24 0.10 2.52 0.31 -0.97 -3.78 118.33 115.17 3b8p n VAL 188 Ca 0.02 -0.29 -0.05 0.00 -0.01 0.00 0.00 64.34 64.01 3b8p n VAL 188 Cb 0.32 -0.12 0.07 0.00 -0.91 0.00 0.00 33.84 33.21 3b8p n VAL 188 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3b8p h ALA 189 N 0.73 0.74 -0.15 3.52 0.00 -0.81 -2.05 119.26 121.23 3b8p h ALA 189 Ca -0.09 -0.65 -0.06 0.00 0.00 0.00 0.00 54.91 54.11 3b8p h ALA 189 Cb 0.87 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3b8p h ALA 189 CO 0.01 0.87 -0.13 0.37 0.00 0.00 0.00 179.25 180.36 3b8p h GLN 190 N 0.06 0.35 0.00 0.00 4.15 -1.80 -3.27 115.11 114.61 3b8p h GLN 190 Ca -0.02 -0.18 -0.00 0.00 0.77 0.00 0.00 58.65 59.22 3b8p h GLN 190 Cb 1.30 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 29.00 3b8p h GLN 190 CO 0.10 0.72 -0.01 1.49 -1.93 0.00 0.00 178.83 179.21 3b8p h GLU 191 N -0.02 0.00 -0.43 1.69 4.57 -1.59 -3.19 114.58 115.61 3b8p h GLU 191 Ca 0.02 0.00 0.02 0.00 -1.18 0.00 0.00 59.36 58.23 3b8p h GLU 191 Cb 0.66 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.22 3b8p h GLU 191 CO 0.03 0.01 0.25 0.37 -1.18 0.00 0.00 179.01 178.49 3b8p h GLN 192 N 0.00 0.49 -2.09 1.92 -0.00 -1.42 -3.15 115.11 110.86 3b8p h GLN 192 Ca -0.00 -0.03 -0.57 0.00 -0.00 0.00 0.00 58.65 58.05 3b8p h GLN 192 Cb 0.19 -0.11 -0.42 0.00 0.00 0.00 0.00 27.48 27.14 3b8p h GLN 192 CO 0.00 0.32 -0.74 1.63 0.00 0.00 0.00 178.83 180.04 3b8p n LYS 193 N -4.86 2.92 0.00 1.69 4.76 -1.21 -4.61 118.16 116.86 3b8p n LYS 193 Ca 0.02 -4.57 0.00 0.00 -2.87 0.00 0.00 58.31 50.89 3b8p n LYS 193 Cb 0.07 -2.14 0.00 0.00 -1.84 0.00 0.00 35.03 31.12 3b8p n LYS 193 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3b8p n ASP 194 N -0.21 2.95 -0.09 4.39 2.03 -1.19 -4.70 116.55 119.73 3b8p n ASP 194 Ca 0.31 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.69 3b8p n ASP 194 Cb 0.48 0.54 -0.07 0.00 -0.72 0.00 0.00 41.12 41.35 3b8p n ASP 194 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 3b8p n LEU 195 N -0.97 0.92 0.00 -2.67 4.32 -1.26 -5.08 117.00 112.27 3b8p n LEU 195 Ca 0.00 -0.56 0.00 0.00 -0.02 0.00 0.00 56.01 55.43 3b8p n LEU 195 Cb 0.05 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.85 3b8p n LEU 195 CO 0.00 0.21 0.00 -2.11 -1.22 0.00 0.00 177.39 174.27 3b8p n ARG 196 N -1.06 0.00 -4.29 3.23 1.85 -1.26 -5.21 116.66 109.92 3b8p n ARG 196 Ca 0.04 0.00 -0.18 0.00 -1.00 0.00 0.00 57.85 56.71 3b8p n ARG 196 Cb 0.26 -0.01 -0.14 0.00 -1.05 0.00 0.00 32.46 31.52 3b8p n ARG 196 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 3b8p s SER 251 N -1.00 1.12 0.00 2.89 1.04 -1.26 -5.01 113.70 111.48 3b8p s SER 251 Ca 0.00 -0.29 0.26 0.00 0.48 0.00 0.00 55.95 56.40 3b8p s SER 251 Cb 0.00 -0.08 1.35 0.00 0.10 0.00 0.00 66.02 67.38 3b8p s SER 251 CO 0.00 0.04 1.88 -0.81 0.98 0.00 0.00 173.24 175.33 3b8p n PRO 252 N 2.42 0.44 -0.02 4.02 -0.04 -1.26 -3.62 135.00 136.93 3b8p n PRO 252 Ca -0.16 0.04 -0.13 0.00 -0.04 0.00 0.00 63.50 63.21 3b8p n PRO 252 Cb 0.56 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.42 3b8p n PRO 252 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3b8p h ALA 253 N 3.29 -0.04 0.00 0.55 0.00 -2.08 -3.29 119.26 117.69 3b8p h ALA 253 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 3b8p h ALA 253 Cb 0.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.01 3b8p h ALA 253 CO 0.00 -0.18 0.00 2.48 0.00 0.00 0.00 179.25 181.55 3b8p n TYR 254 N -4.79 0.00 0.05 0.00 -0.00 -1.24 -2.37 117.16 108.82 3b8p n TYR 254 Ca -0.09 0.00 0.11 0.00 -0.00 0.00 0.00 57.90 57.92 3b8p n TYR 254 Cb 0.33 0.00 0.24 0.00 -0.00 0.00 0.00 39.34 39.90 3b8p n TYR 254 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 176.86 179.34 3b8p n TYR 255 N -0.62 0.63 -0.04 -3.48 4.11 -1.24 -3.88 117.16 112.63 3b8p n TYR 255 Ca 0.05 -0.34 -0.00 0.00 -0.00 0.00 0.00 57.90 57.61 3b8p n TYR 255 Cb 0.02 -0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 39.24 3b8p n TYR 255 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 3b8p n GLN 256 N 1.42 1.05 -0.10 -3.48 3.00 -1.00 -3.72 117.38 114.56 3b8p n GLN 256 Ca 0.20 -0.07 -0.12 0.00 -0.01 0.00 0.00 57.00 57.00 3b8p n GLN 256 Cb 0.58 -1.38 -0.04 0.00 0.00 0.00 0.00 30.24 29.40 3b8p n GLN 256 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.06 178.21 3b8p h THR 257 N 0.00 1.29 0.00 5.09 2.02 -1.68 -0.33 112.91 119.30 3b8p h THR 257 Ca -0.21 -1.17 -0.16 0.00 0.77 0.00 0.00 66.41 65.63 3b8p h THR 257 Cb 1.36 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 69.18 3b8p h THR 257 CO 0.01 0.37 -0.79 0.11 0.37 0.00 0.00 175.52 175.60 3b8p h LYS 258 N 0.35 0.00 -0.33 6.66 1.57 -1.79 -2.46 116.57 120.56 3b8p h LYS 258 Ca 0.07 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.72 3b8p h LYS 258 Cb 0.61 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 3b8p h LYS 258 CO 0.04 0.79 -0.32 -0.56 -0.57 0.00 0.00 179.45 178.82 3b8p h GLN 259 N 0.00 0.72 0.05 3.15 3.07 -1.60 -3.25 115.11 117.25 3b8p h GLN 259 Ca -0.01 -0.33 -0.00 0.00 0.09 0.00 0.00 58.65 58.40 3b8p h GLN 259 Cb 1.50 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 29.05 3b8p h GLN 259 CO 0.10 0.94 -0.03 1.79 0.09 0.00 0.00 178.83 181.73 3b8p h THR 260 N 0.61 1.24 0.00 1.86 1.35 -1.10 -3.34 112.91 113.53 3b8p h THR 260 Ca 0.07 -1.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.36 3b8p h THR 260 Cb 0.84 2.19 0.00 0.00 -1.73 0.00 0.00 68.15 69.45 3b8p h THR 260 CO 0.07 0.36 0.00 0.18 -0.25 0.00 0.00 175.52 175.88 3b8p n LEU 261 N -4.78 0.00 0.00 3.87 4.77 -0.93 0.17 117.00 120.10 3b8p n LEU 261 Ca -0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 3b8p n LEU 261 Cb 0.32 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.41 3b8p n LEU 261 CO 0.28 0.00 -0.47 0.00 -1.33 0.00 0.00 177.39 175.87 3b8p n LEU 262 N 0.28 2.28 -0.12 2.23 -0.00 -1.25 -3.88 117.00 116.55 3b8p n LEU 262 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 56.01 55.91 3b8p n LEU 262 Cb 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 43.42 43.40 3b8p n LEU 262 CO 0.00 0.38 0.83 0.44 -0.00 0.00 0.00 177.39 179.04 3b8p h ASP 263 N 0.00 0.53 -0.21 1.45 3.32 0.15 0.72 116.42 122.38 3b8p h ASP 263 Ca 0.00 -0.25 0.04 0.00 0.02 0.00 0.00 57.03 56.85 3b8p h ASP 263 Cb 0.95 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 40.31 3b8p h ASP 263 CO 0.00 0.64 -0.06 0.40 -1.72 0.00 0.00 179.24 178.51 3b8p h ILE 264 N 0.40 0.78 -0.28 0.35 2.04 -1.74 -1.49 117.51 117.57 3b8p h ILE 264 Ca 0.11 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.97 3b8p h ILE 264 Cb 0.33 0.78 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 3b8p h ILE 264 CO 0.00 0.00 0.19 0.11 0.00 0.00 0.00 178.15 178.45 3b8p h LYS 265 N -0.01 0.36 0.00 2.37 1.57 -1.61 -3.34 116.57 115.92 3b8p h LYS 265 Ca 0.10 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 3b8p h LYS 265 Cb 0.16 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.39 3b8p h LYS 265 CO -0.22 0.24 0.00 -1.71 -0.57 0.00 0.00 179.45 177.19 3b8p n ASN 266 N -4.50 0.00 -2.57 0.86 5.15 0.22 -5.03 115.26 109.40 3b8p n ASN 266 Ca 0.01 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.99 3b8p n ASN 266 Cb 0.07 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.32 3b8p n ASN 266 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3b8p n LEU 267 N 0.00 -3.29 -4.65 1.20 4.77 -0.60 -4.97 117.00 109.46 3b8p n LEU 267 Ca 0.00 0.54 -0.39 0.00 -0.03 0.00 0.00 56.01 56.13 3b8p n LEU 267 Cb 0.00 -1.25 -0.07 0.00 -2.33 0.00 0.00 43.42 39.77 3b8p n LEU 267 CO 0.00 -1.68 0.16 -1.59 -1.33 0.00 0.00 177.39 172.96 3b8p s LYS 268 N -0.42 4.15 -0.39 3.23 0.00 -1.26 -5.00 119.74 120.04 3b8p s LYS 268 Ca 0.00 0.27 0.03 0.00 0.00 0.00 0.00 55.97 56.27 3b8p s LYS 268 Cb 0.00 -3.58 0.16 0.00 0.00 0.00 0.00 37.83 34.41 3b8p s LYS 268 CO 0.00 -0.15 0.38 0.54 0.00 0.00 0.00 175.35 176.12 3b8p s VAL 269 N 1.65 -0.18 0.01 1.79 0.11 -1.26 -5.08 120.40 117.44 3b8p s VAL 269 Ca 0.21 -1.47 -0.27 0.00 -2.93 0.00 0.00 61.98 57.51 3b8p s VAL 269 Cb -0.15 -0.79 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 3b8p s VAL 269 CO 0.09 -0.73 0.83 0.42 -3.33 0.00 0.00 175.10 172.38 3b8p s THR 270 N 1.00 4.84 -0.94 5.04 -4.23 -1.26 -4.94 115.64 115.15 3b8p s THR 270 Ca 0.22 1.76 0.00 0.00 -1.18 0.00 0.00 61.69 62.49 3b8p s THR 270 Cb -0.11 -4.18 0.00 0.00 1.34 0.00 0.00 72.50 69.55 3b8p s THR 270 CO -0.06 0.26 0.94 0.00 -0.54 0.00 0.00 174.62 175.23 3b8p n ALA 271 N 3.42 0.93 1.58 3.99 0.00 -1.26 -0.90 120.51 128.26 3b8p n ALA 271 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.59 3b8p n ALA 271 Cb 0.51 -0.91 0.63 0.00 0.00 0.00 0.00 19.45 19.68 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 -1.44 0.89 -0.63 0.00 5.75 -1.26 -3.57 116.55 116.29 3b8p n ASP 272 Ca 0.00 -1.14 0.06 0.00 -0.01 0.00 0.00 54.79 53.69 3b8p n ASP 272 Cb 0.04 -0.00 0.16 0.00 -1.03 0.00 0.00 41.12 40.29 3b8p n ASP 272 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 3b8p n THR 273 N -0.41 1.16 -3.88 2.12 -2.24 -0.08 -4.92 114.28 106.03 3b8p n THR 273 Ca 0.19 -1.11 -0.35 0.00 -2.27 0.00 0.00 64.05 60.50 3b8p n THR 273 Cb 0.28 0.41 -0.14 0.00 -2.10 0.00 0.00 70.33 68.78 3b8p n THR 273 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3b8p s VAL 274 N -1.22 3.34 -0.13 2.28 1.01 -1.23 -4.78 120.40 119.66 3b8p s VAL 274 Ca 0.24 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.44 3b8p s VAL 274 Cb 0.14 -2.66 0.02 0.00 0.00 0.00 0.00 36.38 33.88 3b8p s VAL 274 CO 0.14 0.21 -0.15 -1.00 0.00 0.00 0.00 175.10 174.30 3b8p s HIS 275 N 1.42 2.10 -2.25 5.22 3.76 -1.25 -4.76 115.29 119.54 3b8p s HIS 275 Ca 0.02 -1.09 0.22 0.00 -0.15 0.00 0.00 55.06 54.06 3b8p s HIS 275 Cb -0.16 -1.53 0.53 0.00 1.11 0.00 0.00 32.58 32.53 3b8p s HIS 275 CO -0.02 -0.58 1.46 1.33 -0.85 0.00 0.00 174.74 176.08 3b8p n VAL 276 N 4.49 0.69 -3.71 -0.90 0.24 -1.26 -4.72 118.33 113.16 3b8p n VAL 276 Ca -0.18 -0.82 -0.10 0.00 -2.04 0.00 0.00 64.34 61.20 3b8p n VAL 276 Cb 0.51 0.71 -0.05 0.00 -1.47 0.00 0.00 33.84 33.54 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 -1.31 -0.11 0.08 6.34 -0.85 -1.26 -3.27 117.35 116.98 3b8p s TYR 277 Ca 0.42 -0.23 0.07 0.00 -0.52 0.00 0.00 57.07 56.81 3b8p s TYR 277 Cb 0.23 0.27 -0.03 0.00 0.38 0.00 0.00 41.96 42.81 3b8p s TYR 277 CO 0.32 -0.78 -0.17 0.50 -1.52 0.00 0.00 175.55 173.90 3b8p s ARG 278 N -3.85 1.00 0.48 -3.49 3.52 -1.12 -4.57 118.95 110.93 3b8p s ARG 278 Ca 0.07 -1.01 -0.16 0.00 -0.13 0.00 0.00 55.73 54.49 3b8p s ARG 278 Cb 0.01 -1.13 -0.08 0.00 -1.56 0.00 0.00 34.95 32.19 3b8p s ARG 278 CO -0.08 0.26 0.94 0.71 -0.81 0.00 0.00 175.30 176.32 3b8p s TYR 279 N -1.14 3.44 -0.41 5.12 4.12 -1.26 -1.50 117.35 125.72 3b8p s TYR 279 Ca 0.03 1.40 0.03 0.00 0.02 0.00 0.00 57.07 58.55 3b8p s TYR 279 Cb -0.10 -2.73 0.04 0.00 -1.52 0.00 0.00 41.96 37.65 3b8p s TYR 279 CO 0.03 -0.29 0.67 0.28 0.02 0.00 0.00 175.55 176.26 3b8p n VAL 280 N -1.43 0.13 -4.37 0.71 0.31 0.78 -4.80 118.33 109.66 3b8p n VAL 280 Ca 0.06 -0.57 -0.25 0.00 -0.01 0.00 0.00 64.34 63.58 3b8p n VAL 280 Cb 0.54 1.00 -0.13 0.00 -0.91 0.00 0.00 33.84 34.34 3b8p n VAL 280 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 3b8p s LYS 282 N -0.38 1.20 0.10 5.55 1.02 -1.26 -4.98 119.74 120.99 3b8p s LYS 282 Ca 0.04 -1.14 -0.35 0.00 0.02 0.00 0.00 55.97 54.55 3b8p s LYS 282 Cb 0.03 -1.46 -0.18 0.00 -0.52 0.00 0.00 37.83 35.70 3b8p s LYS 282 CO 0.04 0.35 0.93 -2.30 -0.92 0.00 0.00 175.35 173.45 3b8p n PRO 283 N 1.22 0.27 -2.63 -1.68 -0.02 -1.26 -4.69 135.00 126.21 3b8p n PRO 283 Ca -0.19 0.10 -0.30 0.00 -2.02 0.00 0.00 63.50 61.09 3b8p n PRO 283 Cb 0.53 -1.45 -0.02 0.00 -0.02 0.00 0.00 33.50 32.55 3b8p n PRO 283 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 3b8p s THR 284 N -0.33 4.78 -0.51 3.45 -4.23 -0.42 -4.90 115.64 113.49 3b8p s THR 284 Ca 0.79 0.61 -0.16 0.00 -1.18 0.00 0.00 61.69 61.75 3b8p s THR 284 Cb -1.07 -3.78 0.09 0.00 1.34 0.00 0.00 72.50 69.07 3b8p s THR 284 CO 0.55 -0.70 0.49 -0.22 -0.54 0.00 0.00 174.62 174.20 3b8p s LEU 285 N -4.26 5.65 -0.19 4.79 1.98 -1.26 -4.42 118.68 120.97 3b8p s LEU 285 Ca 0.52 -1.40 -0.29 0.00 -2.89 0.00 0.00 54.13 50.07 3b8p s LEU 285 Cb -0.10 -2.24 -0.06 0.00 0.66 0.00 0.00 46.19 44.45 3b8p s LEU 285 CO 0.37 -0.78 2.19 -2.65 -1.89 0.00 0.00 176.35 173.59 3b8p n PRO 286 N 5.47 2.04 0.06 0.98 -0.02 -1.26 -4.92 135.00 137.35 3b8p n PRO 286 Ca -0.12 0.59 -0.03 0.00 -2.02 0.00 0.00 63.50 61.93 3b8p n PRO 286 Cb 0.43 -3.19 -0.01 0.00 -0.02 0.00 0.00 33.50 30.71 3b8p n PRO 286 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3b8p h VAL 287 N 6.96 0.00 -4.45 -1.45 2.07 -1.95 -3.46 116.25 113.97 3b8p h VAL 287 Ca -0.42 0.00 -0.47 0.00 0.82 0.00 0.00 66.70 66.63 3b8p h VAL 287 Cb 1.24 0.00 0.09 0.00 -1.52 0.00 0.00 31.29 31.10 3b8p h VAL 287 CO 0.96 0.00 0.38 -0.13 0.02 0.00 0.00 177.57 178.80 3b8p s ARG 288 N -3.39 2.26 0.34 1.57 0.52 -1.26 -5.11 118.95 113.88 3b8p s ARG 288 Ca -0.03 0.16 0.01 0.00 -0.52 0.00 0.00 55.73 55.35 3b8p s ARG 288 Cb 0.00 -2.01 0.06 0.00 0.52 0.00 0.00 34.95 33.53 3b8p s ARG 288 CO 0.08 -1.38 0.46 2.89 0.02 0.00 0.00 175.30 177.37 3b8p n ARG 289 N -3.17 0.40 0.00 3.54 -4.01 -1.26 -4.73 116.66 107.43 3b8p n ARG 289 Ca 0.08 -1.36 0.00 0.00 -1.04 0.00 0.00 57.85 55.52 3b8p n ARG 289 Cb 0.60 -0.27 0.00 0.00 -3.04 0.00 0.00 32.46 29.75 3b8p n ARG 289 CO 0.00 0.00 0.00 -0.25 -3.04 0.00 0.00 177.63 174.34 3b8p n ASP 290 N -2.89 0.00 0.00 2.89 10.43 -0.42 -4.93 116.55 121.63 3b8p n ASP 290 Ca 0.08 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.44 3b8p n ASP 290 Cb 0.29 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.25 3b8p n ASP 290 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 3b8p n SER 291 N 0.00 0.00 0.00 -2.24 3.41 -1.26 -5.10 113.62 108.43 3b8p n SER 291 Ca 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 58.87 58.76 3b8p n SER 291 Cb 0.00 0.00 0.87 0.00 -0.26 0.00 0.00 64.21 64.82 3b8p n SER 291 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07