#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jhx s MET 66 N 0.00 2.21 -0.31 0.00 1.00 -1.26 -5.18 119.30 115.76 2jhx s MET 66 Ca 0.00 -2.28 -0.01 0.00 0.00 0.00 0.00 55.69 53.40 2jhx s MET 66 Cb 0.00 -1.70 0.06 0.00 0.00 0.00 0.00 34.83 33.19 2jhx s MET 66 CO 0.00 -0.43 0.01 0.08 0.00 0.00 0.00 175.02 174.69 2jhx s VAL 67 N -2.84 2.83 0.84 -6.03 1.01 -1.26 -5.13 120.40 109.81 2jhx s VAL 67 Ca 0.14 -1.60 -0.12 0.00 0.00 0.00 0.00 61.98 60.41 2jhx s VAL 67 Cb 0.01 -2.71 0.10 0.00 0.00 0.00 0.00 36.38 33.77 2jhx s VAL 67 CO 0.08 -0.21 1.16 -2.84 0.00 0.00 0.00 175.10 173.30 2jhx s PRO 68 N 1.18 1.54 0.16 2.72 0.02 -1.26 -4.95 135.00 134.42 2jhx s PRO 68 Ca -0.03 1.59 -0.14 0.00 0.02 0.00 0.00 61.00 62.44 2jhx s PRO 68 Cb -0.20 -1.78 0.05 0.00 0.02 0.00 0.00 34.50 32.59 2jhx s PRO 68 CO -0.03 -2.26 1.78 -0.97 -0.33 0.00 0.00 177.00 175.20 2jhx h ASN 69 N -1.25 0.63 -3.41 2.53 -1.24 -1.96 -3.42 115.58 107.45 2jhx h ASN 69 Ca -0.45 -0.08 -0.67 0.00 0.71 0.00 0.00 56.30 55.82 2jhx h ASN 69 Cb 1.27 -0.16 -0.28 0.00 0.73 0.00 0.00 38.32 39.88 2jhx h ASN 69 CO 0.45 0.52 -0.80 -0.69 -1.29 0.00 0.00 177.43 175.63 2jhx s VAL 70 N -5.91 2.79 -0.10 2.57 1.01 -1.26 -0.21 120.40 119.29 2jhx s VAL 70 Ca -0.13 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.08 2jhx s VAL 70 Cb 0.12 -2.14 0.03 0.00 0.00 0.00 0.00 36.38 34.39 2jhx s VAL 70 CO 0.75 0.54 -0.04 -0.69 0.00 0.00 0.00 175.10 175.66 2jhx s VAL 71 N 0.24 0.73 -0.21 2.92 1.01 -0.70 -4.99 120.40 119.41 2jhx s VAL 71 Ca -0.11 -0.14 -0.21 0.00 0.00 0.00 0.00 61.98 61.53 2jhx s VAL 71 Cb -0.16 -0.84 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 2jhx s VAL 71 CO 0.06 0.29 0.65 -0.69 0.00 0.00 0.00 175.10 175.41 2jhx s VAL 72 N 1.82 5.00 -0.03 2.92 1.01 -1.26 -0.23 120.40 129.63 2jhx s VAL 72 Ca 0.05 1.21 0.09 0.00 0.00 0.00 0.00 61.98 63.33 2jhx s VAL 72 Cb -0.13 -3.96 -0.14 0.00 0.00 0.00 0.00 36.38 32.15 2jhx s VAL 72 CO -0.07 0.09 0.17 0.35 0.00 0.00 0.00 175.10 175.64 2jhx n THR 73 N 4.80 0.16 -3.55 3.92 -2.24 0.10 -4.50 114.28 112.97 2jhx n THR 73 Ca -0.01 -0.27 -0.17 0.00 -2.27 0.00 0.00 64.05 61.33 2jhx n THR 73 Cb 0.49 0.02 -0.06 0.00 -2.10 0.00 0.00 70.33 68.68 2jhx n THR 73 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jhx s GLY 74 N -3.39 -0.53 -0.05 3.38 0.00 -0.99 -0.80 107.32 104.96 2jhx s GLY 74 Ca -0.04 1.16 0.05 0.00 0.00 0.00 0.00 44.72 45.89 2jhx s GLY 74 CO 0.40 0.82 -0.20 -2.27 0.00 0.00 0.00 173.10 171.85 2jhx s LEU 75 N -1.28 1.98 -0.03 0.66 0.20 -0.71 -0.71 118.68 118.80 2jhx s LEU 75 Ca -0.11 -0.41 0.02 0.00 0.69 0.00 0.00 54.13 54.32 2jhx s LEU 75 Cb -0.01 -1.12 0.01 0.00 -0.43 0.00 0.00 46.19 44.64 2jhx s LEU 75 CO 0.08 0.19 -0.08 -0.89 -0.29 0.00 0.00 176.35 175.37 2jhx s THR 76 N -0.06 0.68 -0.26 3.68 2.01 -0.00 0.07 115.64 121.75 2jhx s THR 76 Ca -0.03 -0.29 -0.17 0.00 0.31 0.00 0.00 61.69 61.50 2jhx s THR 76 Cb -0.12 -0.62 -0.03 0.00 0.01 0.00 0.00 72.50 71.74 2jhx s THR 76 CO 0.03 0.22 0.49 -0.76 -0.69 0.00 0.00 174.62 173.91 2jhx s LEU 77 N 0.29 4.06 -0.43 4.42 1.43 0.12 -0.52 118.68 128.05 2jhx s LEU 77 Ca -0.04 0.47 -0.17 0.00 -1.03 0.00 0.00 54.13 53.36 2jhx s LEU 77 Cb -0.09 -2.62 0.03 0.00 0.03 0.00 0.00 46.19 43.54 2jhx s LEU 77 CO 0.00 -0.28 0.44 -0.69 0.23 0.00 0.00 176.35 176.06 2jhx s VAL 78 N 2.27 5.09 -0.20 -1.59 1.01 0.28 -4.51 120.40 122.75 2jhx s VAL 78 Ca 0.20 -0.40 -0.04 0.00 0.00 0.00 0.00 61.98 61.74 2jhx s VAL 78 Cb -0.16 -4.06 0.09 0.00 0.00 0.00 0.00 36.38 32.25 2jhx s VAL 78 CO 0.09 -0.45 0.20 0.00 0.00 0.00 0.00 175.10 174.94 2jhx h SER 80 N 8.33 0.55 0.37 0.00 0.02 -1.95 -2.56 113.55 118.30 2jhx h SER 80 Ca -0.17 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 2jhx h SER 80 Cb 1.15 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.57 2jhx h SER 80 CO 0.28 0.37 -0.28 -1.54 -1.14 0.00 0.00 176.83 174.52 2jhx n SER 81 N -4.47 0.72 -4.75 3.07 3.41 -1.26 -4.88 113.62 105.46 2jhx n SER 81 Ca 0.08 -0.58 -0.41 0.00 -0.26 0.00 0.00 58.87 57.69 2jhx n SER 81 Cb 0.19 0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.22 2jhx n SER 81 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jhx s ALA 82 N -2.65 3.66 -0.60 7.33 0.00 -0.97 -4.91 121.76 123.61 2jhx s ALA 82 Ca 0.21 1.43 0.25 0.00 0.00 0.00 0.00 51.96 53.85 2jhx s ALA 82 Cb 0.19 -3.59 0.90 0.00 0.00 0.00 0.00 23.12 20.62 2jhx s ALA 82 CO 0.56 -0.84 1.75 -0.35 0.00 0.00 0.00 175.76 176.88 2jhx n PRO 83 N 2.06 0.23 -4.10 0.00 -0.04 -1.26 -4.90 135.00 127.00 2jhx n PRO 83 Ca 0.06 0.32 -0.11 0.00 -0.04 0.00 0.00 63.50 63.73 2jhx n PRO 83 Cb 0.39 -1.84 -0.07 0.00 -0.04 0.00 0.00 33.50 31.93 2jhx n PRO 83 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2jhx s GLY 84 N -3.57 1.07 0.62 0.55 0.00 -1.26 -5.15 107.32 99.57 2jhx s GLY 84 Ca 0.07 -1.33 -0.18 0.00 0.00 0.00 0.00 44.72 43.29 2jhx s GLY 84 CO 0.50 -1.03 1.19 2.56 0.00 0.00 0.00 173.10 176.32 2jhx s PRO 85 N -3.99 2.82 -0.48 2.90 0.05 -1.26 -5.01 135.00 130.03 2jhx s PRO 85 Ca 0.31 1.73 0.03 0.00 0.05 0.00 0.00 61.00 63.13 2jhx s PRO 85 Cb 0.03 -1.92 0.16 0.00 0.05 0.00 0.00 34.50 32.82 2jhx s PRO 85 CO 0.12 -1.30 0.34 -0.51 0.05 0.00 0.00 177.00 175.69 2jhx s LEU 86 N -4.37 2.41 -0.01 -3.56 1.43 -1.26 -5.10 118.68 108.22 2jhx s LEU 86 Ca 0.75 -3.06 0.01 0.00 -1.03 0.00 0.00 54.13 50.80 2jhx s LEU 86 Cb -0.28 -0.83 0.00 0.00 0.03 0.00 0.00 46.19 45.11 2jhx s LEU 86 CO 0.36 -0.19 -0.02 -1.61 0.23 0.00 0.00 176.35 175.13 2jhx s GLU 87 N -0.11 0.19 -0.17 1.70 2.02 -1.26 -0.70 118.70 120.37 2jhx s GLU 87 Ca 0.26 -0.04 -0.05 0.00 0.02 0.00 0.00 54.97 55.16 2jhx s GLU 87 Cb -0.07 -0.23 -0.03 0.00 0.10 0.00 0.00 34.13 33.90 2jhx s GLU 87 CO -0.13 0.01 -0.01 -0.51 0.02 0.00 0.00 175.26 174.65 2jhx s LEU 88 N 0.17 3.36 -0.50 1.80 1.43 0.11 -5.00 118.68 120.05 2jhx s LEU 88 Ca -0.01 -0.10 -0.22 0.00 -1.03 0.00 0.00 54.13 52.76 2jhx s LEU 88 Cb -0.04 -1.83 0.04 0.00 0.03 0.00 0.00 46.19 44.40 2jhx s LEU 88 CO -0.00 0.15 0.77 -0.62 0.23 0.00 0.00 176.35 176.87 2jhx s ASP 89 N 0.52 6.31 0.00 2.29 -1.08 -1.26 -1.73 116.67 121.71 2jhx s ASP 89 Ca -0.01 -0.49 0.20 0.00 -0.52 0.00 0.00 52.55 51.73 2jhx s ASP 89 Cb -0.14 -2.37 1.05 0.00 -1.46 0.00 0.00 42.92 40.01 2jhx s ASP 89 CO 0.02 -1.01 1.69 0.18 0.52 0.00 0.00 175.17 176.58 2jhx n LEU 90 N 6.77 0.39 0.02 -1.34 4.77 0.02 -3.19 117.00 124.43 2jhx n LEU 90 Ca -0.01 -0.16 0.12 0.00 -0.03 0.00 0.00 56.01 55.93 2jhx n LEU 90 Cb 0.47 -0.02 0.21 0.00 -2.33 0.00 0.00 43.42 41.75 2jhx n LEU 90 CO 0.58 0.08 0.39 0.35 -1.33 0.00 0.00 177.39 177.46 2jhx n THR 91 N -0.54 0.12 -1.17 -5.08 -2.24 -1.25 -4.82 114.28 99.30 2jhx n THR 91 Ca 0.15 -0.10 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 2jhx n THR 91 Cb 0.13 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 2jhx n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jhx n GLY 92 N 1.44 1.51 3.56 3.38 0.00 -1.19 -5.01 105.19 108.88 2jhx n GLY 92 Ca 0.04 -1.88 -0.41 0.00 0.00 0.00 0.00 46.02 43.77 2jhx n GLY 92 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jhx s ASP 93 N -1.00 6.27 0.49 1.61 -1.08 -1.26 -4.87 116.67 116.83 2jhx s ASP 93 Ca 0.00 -0.22 0.26 0.00 -0.52 0.00 0.00 52.55 52.07 2jhx s ASP 93 Cb 0.00 -2.56 1.24 0.00 -1.46 0.00 0.00 42.92 40.14 2jhx s ASP 93 CO 0.00 -1.70 1.97 -0.07 0.52 0.00 0.00 175.17 175.89 2jhx h LEU 94 N 12.62 0.00 -1.83 -1.34 3.38 -1.92 -2.76 115.31 123.46 2jhx h LEU 94 Ca -0.27 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 2jhx h LEU 94 Cb 1.05 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.80 2jhx h LEU 94 CO 1.24 0.17 -0.08 -0.08 0.09 0.00 0.00 178.44 179.78 2jhx h GLU 95 N 0.00 0.00 0.00 1.13 4.57 -1.94 -2.68 114.58 115.66 2jhx h GLU 95 Ca -0.00 -0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2jhx h GLU 95 Cb 0.51 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 29.09 2jhx h GLU 95 CO 0.02 0.09 -0.02 0.77 -1.18 0.00 0.00 179.01 178.68 2jhx h SER 96 N 0.00 0.00 0.43 1.04 0.02 -1.89 -2.22 113.55 110.94 2jhx h SER 96 Ca -0.00 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 2jhx h SER 96 Cb 0.15 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 2jhx h SER 96 CO 0.01 0.02 -0.12 -0.26 -1.14 0.00 0.00 176.83 175.34 2jhx h PHE 97 N 0.00 0.00 0.00 3.45 0.04 -1.67 -3.03 116.94 115.73 2jhx h PHE 97 Ca -0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 2jhx h PHE 97 Cb 0.06 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.20 2jhx h PHE 97 CO 0.00 0.12 -0.12 0.87 -0.60 0.00 0.00 178.31 178.58 2jhx h LYS 98 N 0.00 0.00 -0.12 1.51 1.57 -1.58 -1.89 116.57 116.07 2jhx h LYS 98 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2jhx h LYS 98 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 2jhx h LYS 98 CO 0.02 0.12 0.00 1.63 -0.57 0.00 0.00 179.45 180.65 2jhx n LYS 99 N -3.55 2.34 -3.49 3.15 4.76 -1.15 -4.95 118.16 115.27 2jhx n LYS 99 Ca -0.01 -1.96 -0.20 0.00 -2.87 0.00 0.00 58.31 53.26 2jhx n LYS 99 Cb 0.26 -1.47 -0.02 0.00 -1.84 0.00 0.00 35.03 31.95 2jhx n LYS 99 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2jhx s GLN 100 N -1.88 2.55 -0.02 1.97 -0.21 -0.71 -5.15 119.66 116.22 2jhx s GLN 100 Ca 0.31 -1.52 -0.28 0.00 0.02 0.00 0.00 55.36 53.89 2jhx s GLN 100 Cb 0.21 -2.42 0.06 0.00 1.00 0.00 0.00 33.01 31.86 2jhx s GLN 100 CO 0.31 -0.24 0.62 0.45 -2.12 0.00 0.00 175.29 174.30 2jhx s SER 101 N -4.18 -0.58 -0.11 5.90 0.15 -1.26 -4.26 113.70 109.35 2jhx s SER 101 Ca 0.49 0.53 -0.15 0.00 0.70 0.00 0.00 55.95 57.52 2jhx s SER 101 Cb -0.04 0.52 -0.05 0.00 -1.71 0.00 0.00 66.02 64.74 2jhx s SER 101 CO 0.29 -0.64 0.36 -0.36 1.20 0.00 0.00 173.24 174.09 2jhx s PHE 102 N -1.57 3.54 -0.10 3.44 0.08 -0.62 -4.95 117.98 117.80 2jhx s PHE 102 Ca -0.10 0.76 -0.16 0.00 0.12 0.00 0.00 56.93 57.56 2jhx s PHE 102 Cb -0.01 -2.37 -0.05 0.00 -0.57 0.00 0.00 43.02 40.03 2jhx s PHE 102 CO 0.06 0.33 0.41 0.08 -0.10 0.00 0.00 175.22 176.01 2jhx s VAL 103 N 0.09 5.18 -0.02 -0.44 1.01 -1.26 -0.33 120.40 124.63 2jhx s VAL 103 Ca 0.21 0.82 0.07 0.00 0.00 0.00 0.00 61.98 63.08 2jhx s VAL 103 Cb -0.14 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 2jhx s VAL 103 CO 0.08 0.40 -0.22 -0.76 0.00 0.00 0.00 175.10 174.60 2jhx s LEU 104 N 0.18 2.04 0.24 3.92 1.43 -0.56 -4.95 118.68 120.98 2jhx s LEU 104 Ca 0.23 -0.41 -0.30 0.00 -1.03 0.00 0.00 54.13 52.62 2jhx s LEU 104 Cb -0.15 -1.15 -0.10 0.00 0.03 0.00 0.00 46.19 44.82 2jhx s LEU 104 CO 0.09 0.27 1.39 -0.75 0.23 0.00 0.00 176.35 177.58 2jhx s LYS 105 N -0.49 4.31 0.33 1.70 2.20 -1.26 -1.74 119.74 124.80 2jhx s LYS 105 Ca 0.08 2.22 -0.27 0.00 -0.36 0.00 0.00 55.97 57.63 2jhx s LYS 105 Cb -0.09 -3.13 -0.13 0.00 -1.51 0.00 0.00 37.83 32.97 2jhx s LYS 105 CO -0.01 -0.35 1.05 -0.85 -0.36 0.00 0.00 175.35 174.84 2jhx n GLU 106 N 2.28 1.47 -0.55 4.03 0.28 0.43 -2.50 120.64 126.09 2jhx n GLU 106 Ca 0.06 0.52 0.00 0.00 -0.16 0.00 0.00 57.16 57.58 2jhx n GLU 106 Cb 0.41 -1.97 0.00 0.00 1.43 0.00 0.00 31.44 31.32 2jhx n GLU 106 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2jhx n GLY 107 N 1.14 1.37 3.79 -1.84 0.00 -0.56 -4.93 105.19 104.17 2jhx n GLY 107 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2jhx n GLY 107 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jhx s VAL 108 N -3.05 3.53 0.20 1.61 -7.23 -1.04 -4.37 120.40 110.06 2jhx s VAL 108 Ca 0.00 0.89 -0.27 0.00 -1.81 0.00 0.00 61.98 60.79 2jhx s VAL 108 Cb 0.00 -3.35 -0.08 0.00 0.56 0.00 0.00 36.38 33.50 2jhx s VAL 108 CO 0.00 -0.27 0.85 -1.61 -0.31 0.00 0.00 175.10 173.76 2jhx s GLU 109 N -3.47 4.70 0.14 4.82 2.02 -1.26 -0.42 118.70 125.23 2jhx s GLU 109 Ca 0.68 1.31 -0.17 0.00 0.02 0.00 0.00 54.97 56.81 2jhx s GLU 109 Cb -0.19 -3.27 0.04 0.00 0.10 0.00 0.00 34.13 30.81 2jhx s GLU 109 CO 0.27 0.55 0.45 1.52 0.02 0.00 0.00 175.26 178.07 2jhx s TYR 110 N -1.17 -0.25 0.23 1.61 1.13 -0.05 -4.52 117.35 114.33 2jhx s TYR 110 Ca 0.38 -0.06 0.11 0.00 -1.41 0.00 0.00 57.07 56.10 2jhx s TYR 110 Cb -0.24 0.32 -0.05 0.00 -1.10 0.00 0.00 41.96 40.89 2jhx s TYR 110 CO 0.29 -0.75 -0.21 1.03 -2.51 0.00 0.00 175.55 173.40 2jhx s ARG 111 N -3.80 1.64 -0.19 -3.49 0.52 -0.71 -1.14 118.95 111.77 2jhx s ARG 111 Ca 0.04 -1.61 -0.08 0.00 -0.52 0.00 0.00 55.73 53.56 2jhx s ARG 111 Cb 0.01 -1.84 -0.04 0.00 0.52 0.00 0.00 34.95 33.60 2jhx s ARG 111 CO -0.11 0.37 0.08 0.42 0.02 0.00 0.00 175.30 176.08 2jhx s ILE 112 N -2.04 4.86 -0.22 1.52 1.01 -1.26 -0.56 121.20 124.51 2jhx s ILE 112 Ca 0.25 -0.01 -0.04 0.00 0.00 0.00 0.00 60.65 60.86 2jhx s ILE 112 Cb -0.07 -3.20 -0.01 0.00 0.01 0.00 0.00 42.46 39.19 2jhx s ILE 112 CO 0.13 0.44 -0.04 -0.75 0.00 0.00 0.00 174.94 174.72 2jhx s LYS 113 N 0.48 3.39 -0.21 2.79 2.20 0.32 -1.24 119.74 127.47 2jhx s LYS 113 Ca 0.04 -0.62 -0.07 0.00 -0.36 0.00 0.00 55.97 54.96 2jhx s LYS 113 Cb -0.12 -3.02 -0.03 0.00 -1.51 0.00 0.00 37.83 33.15 2jhx s LYS 113 CO 0.00 -0.18 0.06 0.42 -0.36 0.00 0.00 175.35 175.29 2jhx s ILE 114 N 1.45 4.46 -0.10 5.43 -1.09 0.68 -0.82 121.20 131.21 2jhx s ILE 114 Ca 0.05 -0.13 -0.02 0.00 -2.23 0.00 0.00 60.65 58.32 2jhx s ILE 114 Cb -0.14 -3.05 -0.03 0.00 -1.58 0.00 0.00 42.46 37.66 2jhx s ILE 114 CO -0.03 0.40 -0.00 -0.44 -1.23 0.00 0.00 174.94 173.64 2jhx s SER 115 N 1.02 5.17 0.21 3.58 0.01 0.11 -0.58 113.70 123.21 2jhx s SER 115 Ca 0.04 0.10 -0.18 0.00 1.31 0.00 0.00 55.95 57.21 2jhx s SER 115 Cb -0.14 -1.52 0.03 0.00 0.21 0.00 0.00 66.02 64.60 2jhx s SER 115 CO 0.03 0.34 0.56 0.72 0.41 0.00 0.00 173.24 175.30 2jhx s PHE 116 N -0.65 -0.14 0.04 2.43 -0.71 -0.32 -0.72 117.98 117.91 2jhx s PHE 116 Ca 0.10 -0.22 0.06 0.00 -1.04 0.00 0.00 56.93 55.84 2jhx s PHE 116 Cb -0.12 0.45 -0.02 0.00 -1.21 0.00 0.00 43.02 42.12 2jhx s PHE 116 CO 0.02 -0.97 -0.16 1.03 -1.34 0.00 0.00 175.22 173.80 2jhx s ARG 117 N -3.88 1.07 -0.14 1.99 0.52 0.68 0.05 118.95 119.24 2jhx s ARG 117 Ca 0.10 -0.82 0.02 0.00 -0.52 0.00 0.00 55.73 54.51 2jhx s ARG 117 Cb -0.02 -1.12 0.01 0.00 0.52 0.00 0.00 34.95 34.35 2jhx s ARG 117 CO -0.01 0.28 -0.20 0.08 0.02 0.00 0.00 175.30 175.46 2jhx s VAL 118 N -0.84 1.95 -0.04 3.52 1.01 -1.26 -1.71 120.40 123.04 2jhx s VAL 118 Ca 0.03 -0.90 0.10 0.00 0.00 0.00 0.00 61.98 61.21 2jhx s VAL 118 Cb -0.08 -1.74 -0.15 0.00 0.00 0.00 0.00 36.38 34.41 2jhx s VAL 118 CO 0.01 0.53 0.17 0.59 0.00 0.00 0.00 175.10 176.40 2jhx n ASN 119 N 4.22 2.62 0.00 3.32 3.02 0.71 -2.02 115.26 127.13 2jhx n ASN 119 Ca -0.20 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.35 2jhx n ASN 119 Cb 0.51 1.27 0.00 0.00 -0.61 0.00 0.00 39.78 40.95 2jhx n ASN 119 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 2jhx n ARG 120 N -2.00 0.00 -3.98 3.52 0.63 -1.26 -4.82 116.66 108.75 2jhx n ARG 120 Ca -0.06 0.00 -0.08 0.00 -0.92 0.00 0.00 57.85 56.79 2jhx n ARG 120 Cb 0.42 -0.42 -0.09 0.00 0.45 0.00 0.00 32.46 32.82 2jhx n ARG 120 CO 0.00 0.00 0.00 -1.83 -2.51 0.00 0.00 177.63 173.29 2jhx s GLU 121 N -1.58 0.62 0.47 -0.14 -1.05 -1.26 -4.74 118.70 111.02 2jhx s GLU 121 Ca 0.00 -0.94 -0.25 0.00 -0.15 0.00 0.00 54.97 53.63 2jhx s GLU 121 Cb 0.00 0.23 -0.08 0.00 -0.44 0.00 0.00 34.13 33.85 2jhx s GLU 121 CO 0.00 -0.15 1.42 0.42 0.95 0.00 0.00 175.26 177.90 2jhx s ILE 122 N -3.20 2.05 -0.10 1.83 1.01 -1.26 -4.50 121.20 117.02 2jhx s ILE 122 Ca 0.00 0.04 0.01 0.00 0.00 0.00 0.00 60.65 60.71 2jhx s ILE 122 Cb 0.02 -3.02 0.02 0.00 0.01 0.00 0.00 42.46 39.49 2jhx s ILE 122 CO -0.07 0.00 -0.13 -0.69 0.00 0.00 0.00 174.94 174.05 2jhx s VAL 123 N -1.22 1.32 0.04 2.92 1.01 -0.34 -5.00 120.40 119.13 2jhx s VAL 123 Ca 0.63 -0.53 -0.00 0.00 0.00 0.00 0.00 61.98 62.08 2jhx s VAL 123 Cb -0.43 -1.23 -0.04 0.00 0.00 0.00 0.00 36.38 34.68 2jhx s VAL 123 CO 0.55 0.41 0.16 -0.94 0.00 0.00 0.00 175.10 175.28 2jhx s SER 124 N 1.09 6.10 -1.15 3.32 1.04 -1.26 -1.32 113.70 121.51 2jhx s SER 124 Ca -0.05 0.21 -0.03 0.00 0.48 0.00 0.00 55.95 56.56 2jhx s SER 124 Cb -0.14 -1.83 0.00 0.00 0.10 0.00 0.00 66.02 64.15 2jhx s SER 124 CO -0.02 0.21 0.44 0.61 0.98 0.00 0.00 173.24 175.45 2jhx n GLY 125 N 0.62 -0.20 3.73 7.32 0.00 -1.21 -2.17 105.19 113.28 2jhx n GLY 125 Ca -0.08 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 2jhx n GLY 125 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2jhx n MET 126 N -3.14 2.16 -3.80 1.61 2.81 0.14 -2.84 117.12 114.05 2jhx n MET 126 Ca -0.09 0.77 -0.13 0.00 -1.81 0.00 0.00 57.70 56.44 2jhx n MET 126 Cb 0.59 -2.50 -0.12 0.00 -0.71 0.00 0.00 33.22 30.47 2jhx n MET 126 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 2jhx s LYS 127 N -2.25 0.21 -0.14 0.03 2.20 -0.11 -0.76 119.74 118.92 2jhx s LYS 127 Ca 0.60 0.28 -0.00 0.00 -0.36 0.00 0.00 55.97 56.48 2jhx s LYS 127 Cb -0.49 0.08 -0.01 0.00 -1.51 0.00 0.00 37.83 35.90 2jhx s LYS 127 CO 0.59 -0.04 -0.13 -0.47 -0.36 0.00 0.00 175.35 174.94 2jhx s TYR 128 N 0.22 2.81 -0.06 4.03 5.04 -0.27 -0.69 117.35 128.44 2jhx s TYR 128 Ca -0.01 -0.71 0.04 0.00 -2.44 0.00 0.00 57.07 53.95 2jhx s TYR 128 Cb -0.02 -1.86 -0.00 0.00 0.35 0.00 0.00 41.96 40.42 2jhx s TYR 128 CO -0.01 -0.27 -0.20 0.42 -1.34 0.00 0.00 175.55 174.16 2jhx s ILE 129 N 0.47 1.64 -0.09 3.14 1.01 0.04 -0.24 121.20 127.17 2jhx s ILE 129 Ca -0.09 -0.82 0.02 0.00 0.00 0.00 0.00 60.65 59.76 2jhx s ILE 129 Cb -0.16 -1.41 0.01 0.00 0.01 0.00 0.00 42.46 40.91 2jhx s ILE 129 CO 0.04 0.47 -0.14 -1.10 0.00 0.00 0.00 174.94 174.22 2jhx s GLN 130 N 0.11 1.96 -0.21 2.79 -0.21 -0.07 -1.03 119.66 122.99 2jhx s GLN 130 Ca -0.07 -0.48 -0.06 0.00 0.02 0.00 0.00 55.36 54.77 2jhx s GLN 130 Cb -0.14 -1.66 -0.02 0.00 1.00 0.00 0.00 33.01 32.19 2jhx s GLN 130 CO 0.04 -0.03 0.02 -1.01 -2.12 0.00 0.00 175.29 172.19 2jhx s HIS 131 N 0.88 3.05 -0.16 0.91 3.76 -0.13 -1.16 115.29 122.44 2jhx s HIS 131 Ca -0.10 -0.47 -0.07 0.00 -0.15 0.00 0.00 55.06 54.27 2jhx s HIS 131 Cb -0.15 -2.13 -0.04 0.00 1.11 0.00 0.00 32.58 31.37 2jhx s HIS 131 CO 0.01 -0.28 0.09 0.99 -0.85 0.00 0.00 174.74 174.70 2jhx s THR 132 N 1.18 5.09 0.15 1.30 2.01 -0.12 -0.98 115.64 124.25 2jhx s THR 132 Ca 0.03 0.06 0.10 0.00 0.31 0.00 0.00 61.69 62.20 2jhx s THR 132 Cb -0.14 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.06 2jhx s THR 132 CO 0.02 0.51 -0.24 -0.31 -0.69 0.00 0.00 174.62 173.91 2jhx s TYR 133 N -0.13 2.14 -0.15 4.92 1.51 0.51 -0.90 117.35 125.24 2jhx s TYR 133 Ca 0.09 -0.39 -0.00 0.00 -1.01 0.00 0.00 57.07 55.75 2jhx s TYR 133 Cb -0.12 -1.12 0.04 0.00 -0.11 0.00 0.00 41.96 40.65 2jhx s TYR 133 CO 0.01 0.35 -0.06 0.50 -1.11 0.00 0.00 175.55 175.24 2jhx s ARG 134 N -2.28 1.47 -1.54 -0.62 3.52 0.32 -1.13 118.95 118.69 2jhx s ARG 134 Ca 0.14 -0.43 -0.12 0.00 -0.13 0.00 0.00 55.73 55.19 2jhx s ARG 134 Cb -0.09 -1.88 0.08 0.00 -1.56 0.00 0.00 34.95 31.51 2jhx s ARG 134 CO 0.07 -0.38 0.83 1.63 -0.81 0.00 0.00 175.30 176.64 2jhx n LYS 135 N 4.90 -4.57 -0.94 5.12 4.76 -1.26 -1.64 118.16 124.53 2jhx n LYS 135 Ca -0.12 0.52 0.00 0.00 -2.87 0.00 0.00 58.31 55.84 2jhx n LYS 135 Cb 0.48 -5.23 0.00 0.00 -1.84 0.00 0.00 35.03 28.44 2jhx n LYS 135 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jhx n GLY 136 N -1.64 1.13 3.58 0.72 0.00 -1.26 -5.02 105.19 102.70 2jhx n GLY 136 Ca -0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 2jhx n GLY 136 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jhx s VAL 137 N -3.93 4.91 0.09 1.61 1.01 -0.65 -5.05 120.40 118.39 2jhx s VAL 137 Ca 0.00 0.02 -0.31 0.00 0.00 0.00 0.00 61.98 61.70 2jhx s VAL 137 Cb 0.00 -3.28 -0.08 0.00 0.00 0.00 0.00 36.38 33.02 2jhx s VAL 137 CO 0.00 0.36 1.55 -0.75 0.00 0.00 0.00 175.10 176.26 2jhx s LYS 138 N 1.16 4.23 -0.01 2.72 2.20 -1.26 -0.52 119.74 128.27 2jhx s LYS 138 Ca 0.06 2.24 0.05 0.00 -0.36 0.00 0.00 55.97 57.96 2jhx s LYS 138 Cb -0.14 -3.44 -0.07 0.00 -1.51 0.00 0.00 37.83 32.66 2jhx s LYS 138 CO 0.04 -0.64 0.12 0.44 -0.36 0.00 0.00 175.35 174.96 2jhx n ILE 139 N 4.43 0.00 -3.51 5.43 -5.35 -0.08 -4.93 119.36 115.36 2jhx n ILE 139 Ca 0.14 -0.14 -0.16 0.00 -0.27 0.00 0.00 62.75 62.33 2jhx n ILE 139 Cb 0.41 0.44 -0.05 0.00 -1.74 0.00 0.00 39.64 38.70 2jhx n ILE 139 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2jhx s ASP 140 N -2.47 -0.59 -0.02 7.28 3.68 -1.08 -5.00 116.67 118.47 2jhx s ASP 140 Ca -0.01 0.44 0.00 0.00 2.13 0.00 0.00 52.55 55.10 2jhx s ASP 140 Cb 0.03 0.54 0.02 0.00 -1.45 0.00 0.00 42.92 42.07 2jhx s ASP 140 CO 0.21 -0.71 0.01 -0.75 0.13 0.00 0.00 175.17 174.06 2jhx s LYS 141 N -2.03 0.10 -0.04 4.34 2.20 -1.26 -0.95 119.74 122.10 2jhx s LYS 141 Ca -0.07 0.11 0.01 0.00 -0.36 0.00 0.00 55.97 55.66 2jhx s LYS 141 Cb -0.00 -0.30 0.02 0.00 -1.51 0.00 0.00 37.83 36.04 2jhx s LYS 141 CO 0.02 -0.12 -0.05 0.99 -0.36 0.00 0.00 175.35 175.83 2jhx s THR 142 N 0.86 0.59 -0.13 3.43 2.01 -0.31 -5.02 115.64 117.08 2jhx s THR 142 Ca -0.08 -0.17 -0.04 0.00 0.31 0.00 0.00 61.69 61.72 2jhx s THR 142 Cb -0.11 -0.60 -0.03 0.00 0.01 0.00 0.00 72.50 71.76 2jhx s THR 142 CO -0.02 0.23 0.01 -1.81 -0.69 0.00 0.00 174.62 172.34 2jhx s ASP 143 N 0.83 5.26 -0.13 3.53 -0.00 -1.26 -0.90 116.67 124.01 2jhx s ASP 143 Ca -0.12 0.07 0.02 0.00 -0.00 0.00 0.00 52.55 52.52 2jhx s ASP 143 Cb -0.14 -1.70 0.01 0.00 -0.00 0.00 0.00 42.92 41.09 2jhx s ASP 143 CO 0.01 0.28 -0.17 -0.31 -0.00 0.00 0.00 175.17 174.97 2jhx s TYR 144 N -0.26 2.25 -0.14 4.23 2.02 0.67 -5.00 117.35 121.13 2jhx s TYR 144 Ca 0.06 -1.13 -0.27 0.00 -0.37 0.00 0.00 57.07 55.37 2jhx s TYR 144 Cb -0.12 -1.59 -0.02 0.00 -0.40 0.00 0.00 41.96 39.83 2jhx s TYR 144 CO 0.02 -0.56 0.88 1.41 -1.57 0.00 0.00 175.55 175.73 2jhx s MET 145 N 1.01 4.35 -0.23 -0.62 1.75 -1.26 -1.12 119.30 123.18 2jhx s MET 145 Ca -0.05 1.14 -0.11 0.00 -1.25 0.00 0.00 55.69 55.42 2jhx s MET 145 Cb -0.15 -3.55 -0.18 0.00 2.84 0.00 0.00 34.83 33.79 2jhx s MET 145 CO -0.03 -0.30 -0.04 0.28 -0.65 0.00 0.00 175.02 174.28 2jhx n VAL 146 N 4.60 1.57 0.00 10.11 0.31 0.06 -4.95 118.33 130.03 2jhx n VAL 146 Ca 0.06 -0.38 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 2jhx n VAL 146 Cb 0.49 -1.80 0.00 0.00 -0.91 0.00 0.00 33.84 31.62 2jhx n VAL 146 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jhx n GLY 147 N 1.65 0.12 3.68 2.92 0.00 -0.81 -4.93 105.19 107.82 2jhx n GLY 147 Ca -0.43 -2.27 -0.35 0.00 0.00 0.00 0.00 46.02 42.98 2jhx n GLY 147 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jhx s SER 148 N -4.00 5.87 -0.03 1.61 0.01 -1.26 -0.69 113.70 115.21 2jhx s SER 148 Ca 0.00 0.15 0.03 0.00 1.31 0.00 0.00 55.95 57.44 2jhx s SER 148 Cb 0.00 -2.01 0.00 0.00 0.21 0.00 0.00 66.02 64.22 2jhx s SER 148 CO 0.00 0.19 -0.11 -0.31 0.41 0.00 0.00 173.24 173.41 2jhx s TYR 149 N 0.31 1.15 0.52 2.43 2.02 -0.44 -4.98 117.35 118.37 2jhx s TYR 149 Ca 0.05 -0.30 0.09 0.00 -0.37 0.00 0.00 57.07 56.54 2jhx s TYR 149 Cb -0.12 -0.80 0.06 0.00 -0.40 0.00 0.00 41.96 40.70 2jhx s TYR 149 CO -0.01 -0.11 0.69 0.20 -1.57 0.00 0.00 175.55 174.75 2jhx s GLY 150 N 0.13 1.84 0.50 0.71 0.00 -1.26 -1.20 107.32 108.05 2jhx s GLY 150 Ca -0.03 -1.95 -0.20 0.00 0.00 0.00 0.00 44.72 42.54 2jhx s GLY 150 CO 0.01 -1.64 1.08 2.56 0.00 0.00 0.00 173.10 175.11 2jhx s PRO 151 N -4.53 3.65 0.21 2.90 0.04 -1.26 -4.71 135.00 131.30 2jhx s PRO 151 Ca 0.58 1.49 -0.23 0.00 0.04 0.00 0.00 61.00 62.88 2jhx s PRO 151 Cb -0.07 -2.11 0.05 0.00 0.04 0.00 0.00 34.50 32.41 2jhx s PRO 151 CO 0.36 -0.58 0.81 -0.98 0.04 0.00 0.00 177.00 176.64 2jhx s ARG 152 N -3.17 1.47 0.12 4.56 1.70 -0.86 -4.98 118.95 117.79 2jhx s ARG 152 Ca 0.69 -0.78 -0.12 0.00 -0.47 0.00 0.00 55.73 55.04 2jhx s ARG 152 Cb -0.20 0.52 -0.08 0.00 -0.57 0.00 0.00 34.95 34.62 2jhx s ARG 152 CO 0.24 -0.67 1.43 0.00 -1.08 0.00 0.00 175.30 175.22 2jhx h ALA 153 N 2.00 0.48 -2.45 7.88 0.00 -1.97 -3.43 119.26 121.78 2jhx h ALA 153 Ca -0.22 -0.47 -0.52 0.00 0.00 0.00 0.00 54.91 53.70 2jhx h ALA 153 Cb 1.25 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2jhx h ALA 153 CO 0.26 0.62 0.04 -1.21 0.00 0.00 0.00 179.25 178.96 2jhx s GLU 154 N -4.26 4.05 0.51 0.00 8.01 -1.26 -5.04 118.70 120.71 2jhx s GLU 154 Ca -0.11 0.65 -0.22 0.00 0.01 0.00 0.00 54.97 55.29 2jhx s GLU 154 Cb 0.10 -2.68 -0.08 0.00 -4.31 0.00 0.00 34.13 27.17 2jhx s GLU 154 CO 0.88 0.30 1.06 0.72 0.01 0.00 0.00 175.26 178.23 2jhx n HIS 155 N 0.18 1.27 -3.55 1.61 8.25 -1.26 -4.85 115.22 116.87 2jhx n HIS 155 Ca -0.00 0.49 -0.31 0.00 -0.26 0.00 0.00 57.72 57.64 2jhx n HIS 155 Cb 0.52 -2.23 -0.04 0.00 1.12 0.00 0.00 29.99 29.36 2jhx n HIS 155 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2jhx s TYR 156 N -1.37 3.46 -0.05 4.41 2.02 0.11 -4.94 117.35 120.99 2jhx s TYR 156 Ca 0.69 0.64 0.01 0.00 -0.37 0.00 0.00 57.07 58.04 2jhx s TYR 156 Cb -0.48 -2.08 0.02 0.00 -0.40 0.00 0.00 41.96 39.02 2jhx s TYR 156 CO 0.52 0.34 -0.07 -1.01 -1.57 0.00 0.00 175.55 173.76 2jhx s HIS 157 N -1.79 1.01 -0.19 2.71 3.76 -1.26 -1.17 115.29 118.36 2jhx s HIS 157 Ca 0.43 -0.34 -0.04 0.00 -0.15 0.00 0.00 55.06 54.97 2jhx s HIS 157 Cb -0.12 -0.82 -0.02 0.00 1.11 0.00 0.00 32.58 32.73 2jhx s HIS 157 CO 0.25 -0.23 -0.04 0.12 -0.85 0.00 0.00 174.74 173.98 2jhx s PHE 158 N 0.89 2.98 -0.12 1.40 5.36 0.25 -4.96 117.98 123.77 2jhx s PHE 158 Ca -0.11 -0.58 0.00 0.00 -0.96 0.00 0.00 56.93 55.28 2jhx s PHE 158 Cb -0.15 -2.03 -0.02 0.00 -0.34 0.00 0.00 43.02 40.49 2jhx s PHE 158 CO 0.01 -0.27 -0.12 -0.51 -1.46 0.00 0.00 175.22 172.86 2jhx s LEU 159 N 0.89 2.79 0.83 6.12 1.02 -1.26 -0.23 118.68 128.84 2jhx s LEU 159 Ca -0.00 -0.28 -0.11 0.00 0.02 0.00 0.00 54.13 53.75 2jhx s LEU 159 Cb -0.15 -1.62 0.09 0.00 0.02 0.00 0.00 46.19 44.53 2jhx s LEU 159 CO 0.01 0.20 1.10 0.42 0.02 0.00 0.00 176.35 178.10 2jhx s THR 160 N 0.14 2.91 0.93 5.49 -4.23 -0.37 -4.98 115.64 115.52 2jhx s THR 160 Ca -0.06 0.30 -0.11 0.00 -1.18 0.00 0.00 61.69 60.64 2jhx s THR 160 Cb -0.15 -2.94 0.15 0.00 1.34 0.00 0.00 72.50 70.90 2jhx s THR 160 CO 0.05 -0.39 1.12 -2.84 -0.54 0.00 0.00 174.62 172.01 2jhx s PRO 161 N -5.07 0.94 0.20 3.99 0.02 -1.26 -4.57 135.00 129.24 2jhx s PRO 161 Ca 0.62 1.33 -0.31 0.00 0.02 0.00 0.00 61.00 62.65 2jhx s PRO 161 Cb -0.16 -1.73 -0.10 0.00 0.02 0.00 0.00 34.50 32.53 2jhx s PRO 161 CO 0.55 -2.61 1.55 0.08 -0.33 0.00 0.00 177.00 176.24 2jhx s VAL 162 N -2.68 2.54 0.25 3.83 1.01 -1.26 -4.67 120.40 119.42 2jhx s VAL 162 Ca 0.66 0.41 0.07 0.00 0.00 0.00 0.00 61.98 63.12 2jhx s VAL 162 Cb -0.22 -3.26 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 2jhx s VAL 162 CO 0.59 0.04 -0.09 -1.83 0.00 0.00 0.00 175.10 173.81 2jhx s GLU 163 N 0.66 1.48 -0.13 2.72 -1.05 -0.29 -4.96 118.70 117.12 2jhx s GLU 163 Ca 0.67 -1.72 -0.05 0.00 -0.15 0.00 0.00 54.97 53.72 2jhx s GLU 163 Cb -0.44 -1.16 -0.04 0.00 -0.44 0.00 0.00 34.13 32.06 2jhx s GLU 163 CO 0.35 0.09 0.05 -1.21 0.95 0.00 0.00 175.26 175.50 2jhx s GLU 164 N -3.69 3.48 0.72 -4.83 2.02 -1.26 -0.87 118.70 114.27 2jhx s GLU 164 Ca 0.27 -0.33 -0.16 0.00 0.02 0.00 0.00 54.97 54.78 2jhx s GLU 164 Cb 0.02 -3.04 0.03 0.00 0.10 0.00 0.00 34.13 31.25 2jhx s GLU 164 CO 0.10 0.54 1.23 0.00 0.02 0.00 0.00 175.26 177.15 2jhx s ALA 165 N -0.39 2.13 0.83 5.21 0.00 0.44 -4.91 121.76 125.07 2jhx s ALA 165 Ca 0.09 0.97 -0.14 0.00 0.00 0.00 0.00 51.96 52.89 2jhx s ALA 165 Cb -0.12 -3.50 0.04 0.00 0.00 0.00 0.00 23.12 19.54 2jhx s ALA 165 CO 0.02 -1.89 0.79 -2.30 0.00 0.00 0.00 175.76 172.38 2jhx n PRO 166 N -2.60 0.04 -3.81 0.00 -0.02 -1.26 -2.43 135.00 124.91 2jhx n PRO 166 Ca 0.14 0.07 -0.12 0.00 -2.02 0.00 0.00 63.50 61.57 2jhx n PRO 166 Cb 0.50 -2.10 -0.11 0.00 -0.02 0.00 0.00 33.50 31.77 2jhx n PRO 166 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2jhx s LYS 167 N -3.64 0.41 0.00 -0.52 2.20 -1.26 -1.49 119.74 115.44 2jhx s LYS 167 Ca 0.66 -0.01 0.00 0.00 -0.36 0.00 0.00 55.97 56.26 2jhx s LYS 167 Cb -0.28 0.18 0.00 0.00 -1.51 0.00 0.00 37.83 36.22 2jhx s LYS 167 CO 0.58 -0.09 0.00 0.41 -0.36 0.00 0.00 175.35 175.89 2jhx n GLY 168 N 2.15 2.65 0.29 5.54 0.00 -1.26 -4.64 105.19 109.92 2jhx n GLY 168 Ca -0.18 -1.61 0.09 0.00 0.00 0.00 0.00 46.02 44.32 2jhx n GLY 168 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2jhx h MET 169 N 0.00 0.33 0.00 1.61 4.05 -1.99 0.29 114.93 119.23 2jhx h MET 169 Ca 0.00 -0.02 -0.03 0.00 -0.28 0.00 0.00 59.70 59.37 2jhx h MET 169 Cb 0.00 -0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 30.72 2jhx h MET 169 CO 0.00 0.22 -0.12 -0.07 0.23 0.00 0.00 176.91 177.17 2jhx h LEU 170 N 0.34 0.00 -0.65 3.39 3.38 -2.04 -2.26 115.31 117.48 2jhx h LEU 170 Ca 0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.45 2jhx h LEU 170 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2jhx h LEU 170 CO -0.51 0.12 -0.42 0.00 0.09 0.00 0.00 178.44 177.72 2jhx n ALA 171 N -2.33 3.44 -1.48 1.53 0.00 0.06 -4.95 120.51 116.78 2jhx n ALA 171 Ca -0.02 -0.52 -0.30 0.00 0.00 0.00 0.00 53.44 52.60 2jhx n ALA 171 Cb 0.22 -0.96 0.11 0.00 0.00 0.00 0.00 19.45 18.82 2jhx n ALA 171 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2jhx s ARG 172 N -2.55 1.77 0.00 0.00 0.52 -0.85 -4.76 118.95 113.08 2jhx s ARG 172 Ca 0.20 0.62 0.00 0.00 -0.52 0.00 0.00 55.73 56.03 2jhx s ARG 172 Cb 0.18 -1.88 0.00 0.00 0.52 0.00 0.00 34.95 33.77 2jhx s ARG 172 CO 0.58 -1.84 0.00 0.41 0.02 0.00 0.00 175.30 174.47 2jhx n GLY 173 N -1.92 0.25 3.83 -3.53 0.00 -0.25 -4.94 105.19 98.63 2jhx n GLY 173 Ca 0.07 -2.28 -0.38 0.00 0.00 0.00 0.00 46.02 43.43 2jhx n GLY 173 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jhx s SER 174 N -4.00 6.92 0.05 1.61 0.01 -1.26 -0.63 113.70 116.40 2jhx s SER 174 Ca 0.00 1.10 0.03 0.00 1.31 0.00 0.00 55.95 58.39 2jhx s SER 174 Cb 0.00 -2.30 -0.03 0.00 0.21 0.00 0.00 66.02 63.90 2jhx s SER 174 CO 0.00 0.28 -0.10 -0.31 0.41 0.00 0.00 173.24 173.51 2jhx s TYR 175 N -1.14 0.89 0.16 2.43 1.51 0.50 -4.48 117.35 117.21 2jhx s TYR 175 Ca 0.28 -0.48 0.10 0.00 -1.01 0.00 0.00 57.07 55.95 2jhx s TYR 175 Cb -0.18 -0.51 -0.04 0.00 -0.11 0.00 0.00 41.96 41.12 2jhx s TYR 175 CO 0.17 -0.03 -0.17 -1.54 -1.11 0.00 0.00 175.55 172.87 2jhx s SER 176 N -1.64 3.86 -0.06 2.29 1.04 -0.28 -1.08 113.70 117.83 2jhx s SER 176 Ca -0.07 -0.66 0.02 0.00 0.48 0.00 0.00 55.95 55.72 2jhx s SER 176 Cb -0.10 -0.51 0.01 0.00 0.10 0.00 0.00 66.02 65.53 2jhx s SER 176 CO 0.01 0.14 -0.10 -0.63 0.98 0.00 0.00 173.24 173.64 2jhx s ILE 177 N -1.49 0.97 -0.30 -1.02 1.01 0.81 -0.36 121.20 120.82 2jhx s ILE 177 Ca 0.21 -0.38 -0.08 0.00 0.00 0.00 0.00 60.65 60.39 2jhx s ILE 177 Cb -0.09 -0.90 -0.00 0.00 0.01 0.00 0.00 42.46 41.47 2jhx s ILE 177 CO 0.12 0.32 0.12 -0.54 0.00 0.00 0.00 174.94 174.95 2jhx s LYS 178 N 0.70 3.29 -0.07 2.79 1.02 -0.16 -1.14 119.74 126.17 2jhx s LYS 178 Ca -0.13 -0.74 -0.02 0.00 0.02 0.00 0.00 55.97 55.10 2jhx s LYS 178 Cb -0.15 -3.47 -0.03 0.00 -0.52 0.00 0.00 37.83 33.66 2jhx s LYS 178 CO 0.03 -0.40 0.02 -1.12 -0.92 0.00 0.00 175.35 172.96 2jhx s SER 179 N 1.57 5.38 -0.01 2.83 0.01 0.73 -0.96 113.70 123.26 2jhx s SER 179 Ca 0.04 0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.46 2jhx s SER 179 Cb -0.17 -1.53 0.01 0.00 0.21 0.00 0.00 66.02 64.54 2jhx s SER 179 CO 0.05 0.36 0.01 -0.13 0.41 0.00 0.00 173.24 173.93 2jhx s ARG 180 N -1.07 -0.00 -0.18 12.44 3.00 -0.19 -1.44 118.95 131.51 2jhx s ARG 180 Ca 0.15 0.04 -0.01 0.00 0.00 0.00 0.00 55.73 55.92 2jhx s ARG 180 Cb -0.11 -0.07 0.00 0.00 0.00 0.00 0.00 34.95 34.77 2jhx s ARG 180 CO 0.05 -0.04 -0.14 0.12 0.00 0.00 0.00 175.30 175.29 2jhx s PHE 181 N 0.27 2.83 0.00 -0.53 2.19 -0.17 -0.78 117.98 121.78 2jhx s PHE 181 Ca -0.02 -1.15 0.00 0.00 0.33 0.00 0.00 56.93 56.09 2jhx s PHE 181 Cb -0.03 -1.95 0.00 0.00 -1.31 0.00 0.00 43.02 39.73 2jhx s PHE 181 CO -0.01 -0.56 0.00 -2.37 1.83 0.00 0.00 175.22 174.11 2jhx n THR 182 N 4.36 0.00 -3.58 0.12 5.66 0.14 -1.79 114.28 119.19 2jhx n THR 182 Ca -0.19 0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 60.78 2jhx n THR 182 Cb 0.51 0.00 -0.00 0.00 -1.55 0.00 0.00 70.33 69.29 2jhx n THR 182 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 2jhx n ASP 183 N -2.45 -0.33 0.11 1.09 5.68 -1.25 -0.93 116.55 118.47 2jhx n ASP 183 Ca 0.00 -1.40 0.12 0.00 -0.50 0.00 0.00 54.79 53.01 2jhx n ASP 183 Cb 0.00 0.60 0.46 0.00 -1.14 0.00 0.00 41.12 41.04 2jhx n ASP 183 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2jhx n ASP 184 N -1.86 0.67 -0.11 -1.12 5.68 -0.92 -1.32 116.55 117.58 2jhx n ASP 184 Ca -0.00 0.62 0.14 0.00 -0.50 0.00 0.00 54.79 55.05 2jhx n ASP 184 Cb 0.13 -0.78 0.77 0.00 -1.14 0.00 0.00 41.12 40.10 2jhx n ASP 184 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2jhx n ASP 185 N -2.19 0.33 -2.78 -1.12 8.00 -1.26 -4.93 116.55 112.59 2jhx n ASP 185 Ca 0.04 -1.20 -0.22 0.00 0.71 0.00 0.00 54.79 54.12 2jhx n ASP 185 Cb 0.31 -0.01 0.02 0.00 -0.02 0.00 0.00 41.12 41.42 2jhx n ASP 185 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2jhx n LYS 186 N -0.70 -3.78 -2.21 -1.24 5.02 -0.43 -4.97 118.16 109.85 2jhx n LYS 186 Ca 0.21 0.95 -0.41 0.00 -2.02 0.00 0.00 58.31 57.03 2jhx n LYS 186 Cb 0.15 -5.73 -0.03 0.00 -0.02 0.00 0.00 35.03 29.40 2jhx n LYS 186 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2jhx s THR 187 N -3.13 3.19 -1.17 -0.18 2.01 -1.26 -4.85 115.64 110.24 2jhx s THR 187 Ca 0.20 0.98 -0.16 0.00 0.31 0.00 0.00 61.69 63.02 2jhx s THR 187 Cb -0.09 -3.63 0.14 0.00 0.01 0.00 0.00 72.50 68.94 2jhx s THR 187 CO 0.24 0.15 1.44 -0.62 -0.69 0.00 0.00 174.62 175.14 2jhx s ASP 188 N 0.33 6.93 0.15 3.53 2.15 -1.26 -3.93 116.67 124.57 2jhx s ASP 188 Ca 0.57 -2.66 -0.15 0.00 0.43 0.00 0.00 52.55 50.74 2jhx s ASP 188 Cb -0.37 -2.44 0.03 0.00 -0.30 0.00 0.00 42.92 39.84 2jhx s ASP 188 CO 0.38 -0.91 1.74 0.45 -0.17 0.00 0.00 175.17 176.66 2jhx h HIS 189 N 7.64 0.68 -1.79 -5.34 3.86 -1.71 -3.45 115.15 115.04 2jhx h HIS 189 Ca 0.31 -0.03 0.01 0.00 -1.16 0.00 0.00 60.37 59.50 2jhx h HIS 189 Cb 0.90 -0.21 -0.23 0.00 1.06 0.00 0.00 27.41 28.94 2jhx h HIS 189 CO 1.18 0.54 0.33 -1.17 0.86 0.00 0.00 177.93 179.67 2jhx s LEU 190 N -9.89 -0.56 -0.04 2.43 2.96 -1.18 -4.69 118.68 107.70 2jhx s LEU 190 Ca -0.13 0.91 0.04 0.00 -0.22 0.00 0.00 54.13 54.72 2jhx s LEU 190 Cb 0.11 2.18 -0.00 0.00 0.50 0.00 0.00 46.19 48.98 2jhx s LEU 190 CO 0.76 -0.31 -0.14 -0.44 -1.32 0.00 0.00 176.35 174.89 2jhx s SER 191 N -0.29 1.81 0.16 3.68 0.01 -1.26 -1.00 113.70 116.80 2jhx s SER 191 Ca -0.02 -0.29 -0.15 0.00 1.31 0.00 0.00 55.95 56.80 2jhx s SER 191 Cb -0.03 -0.52 0.02 0.00 0.21 0.00 0.00 66.02 65.71 2jhx s SER 191 CO 0.01 0.12 0.42 -1.66 0.41 0.00 0.00 173.24 172.53 2jhx s TRP 192 N 0.13 -0.06 -0.02 2.43 -2.14 -0.52 -5.02 118.94 113.73 2jhx s TRP 192 Ca -0.04 -0.28 0.05 0.00 2.66 0.00 0.00 56.10 58.49 2jhx s TRP 192 Cb -0.11 0.24 -0.01 0.00 -3.10 0.00 0.00 33.47 30.50 2jhx s TRP 192 CO 0.02 -0.78 -0.18 -2.00 -2.66 0.00 0.00 176.95 171.35 2jhx s GLU 193 N -3.86 1.61 0.26 3.25 2.12 -1.26 -0.19 118.70 120.63 2jhx s GLU 193 Ca 0.08 -0.65 -0.09 0.00 0.36 0.00 0.00 54.97 54.67 2jhx s GLU 193 Cb 0.01 -1.49 -0.01 0.00 0.26 0.00 0.00 34.13 32.90 2jhx s GLU 193 CO -0.07 0.35 0.42 1.67 -0.54 0.00 0.00 175.26 177.09 2jhx s TRP 194 N -0.27 0.63 0.08 5.30 1.48 -0.29 -4.30 118.94 121.56 2jhx s TRP 194 Ca 0.03 -0.94 0.05 0.00 -1.06 0.00 0.00 56.10 54.18 2jhx s TRP 194 Cb -0.09 0.02 -0.03 0.00 -1.16 0.00 0.00 33.47 32.21 2jhx s TRP 194 CO 0.00 -0.97 -0.15 -0.80 -4.06 0.00 0.00 176.95 170.98 2jhx s ASN 195 N -3.08 1.77 -0.04 -2.66 0.01 -1.26 -0.13 114.94 109.54 2jhx s ASN 195 Ca 0.27 -0.63 0.05 0.00 -0.71 0.00 0.00 52.86 51.83 2jhx s ASN 195 Cb 0.01 -0.06 -0.00 0.00 0.41 0.00 0.00 41.25 41.60 2jhx s ASN 195 CO 0.12 -0.07 -0.18 -0.22 -1.51 0.00 0.00 177.10 175.24 2jhx s LEU 196 N -1.79 1.94 -0.16 0.60 2.96 -0.24 -1.59 118.68 120.40 2jhx s LEU 196 Ca -0.01 -0.36 0.01 0.00 -0.22 0.00 0.00 54.13 53.55 2jhx s LEU 196 Cb -0.10 -0.99 0.02 0.00 0.50 0.00 0.00 46.19 45.62 2jhx s LEU 196 CO 0.02 0.17 -0.16 -0.89 -1.32 0.00 0.00 176.35 174.17 2jhx s THR 197 N -0.02 1.73 -0.27 3.68 2.01 0.55 -0.37 115.64 122.95 2jhx s THR 197 Ca -0.03 -0.74 -0.13 0.00 0.31 0.00 0.00 61.69 61.10 2jhx s THR 197 Cb -0.11 -1.60 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 2jhx s THR 197 CO 0.02 0.49 0.30 -0.63 -0.69 0.00 0.00 174.62 174.10 2jhx s ILE 198 N 1.38 5.23 0.26 1.82 -1.09 0.20 -1.50 121.20 127.50 2jhx s ILE 198 Ca 0.04 0.41 0.09 0.00 -2.23 0.00 0.00 60.65 58.96 2jhx s ILE 198 Cb -0.13 -3.63 -0.05 0.00 -1.58 0.00 0.00 42.46 37.07 2jhx s ILE 198 CO -0.11 0.20 -0.14 -0.54 -1.23 0.00 0.00 174.94 173.12 2jhx s LYS 199 N 1.91 1.55 0.34 2.79 1.02 -0.71 -1.09 119.74 125.55 2jhx s LYS 199 Ca 0.12 -1.73 0.02 0.00 0.02 0.00 0.00 55.97 54.40 2jhx s LYS 199 Cb -0.16 -1.43 0.60 0.00 -0.52 0.00 0.00 37.83 36.32 2jhx s LYS 199 CO 0.10 0.20 1.97 -0.22 -0.92 0.00 0.00 175.35 176.48 2jhx h LYS 200 N 2.34 0.79 -4.33 1.68 3.64 -1.96 0.12 116.57 118.85 2jhx h LYS 200 Ca -0.40 -0.08 -0.15 0.00 -1.27 0.00 0.00 60.65 58.75 2jhx h LYS 200 Cb 1.24 -0.16 -0.15 0.00 -0.41 0.00 0.00 32.23 32.75 2jhx h LYS 200 CO 0.63 0.58 -0.66 -0.51 -2.27 0.00 0.00 179.45 177.22 2jhx s ASP 201 N -6.53 0.39 0.00 4.20 1.11 -1.26 -4.49 116.67 110.09 2jhx s ASP 201 Ca -0.10 -1.11 0.09 0.00 0.18 0.00 0.00 52.55 51.62 2jhx s ASP 201 Cb 0.17 0.25 0.54 0.00 1.07 0.00 0.00 42.92 44.96 2jhx s ASP 201 CO 0.77 -0.67 0.99 0.79 1.18 0.00 0.00 175.17 178.23