#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jhx h MET 66 N 0.00 0.00 -4.78 0.00 0.00 -2.09 -3.47 114.93 104.59 2jhx h MET 66 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 59.70 59.16 2jhx h MET 66 Cb 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 31.60 31.27 2jhx h MET 66 CO 0.00 0.52 -0.83 0.08 0.00 0.00 0.00 176.91 176.68 2jhx s VAL 67 N -3.80 1.29 0.72 -2.22 1.01 -1.26 -5.14 120.40 111.00 2jhx s VAL 67 Ca -0.02 -0.59 -0.16 0.00 0.00 0.00 0.00 61.98 61.22 2jhx s VAL 67 Cb 0.13 -1.15 0.03 0.00 0.00 0.00 0.00 36.38 35.38 2jhx s VAL 67 CO 0.74 0.39 1.20 -2.65 0.00 0.00 0.00 175.10 174.78 2jhx n PRO 68 N 3.63 0.67 -0.24 2.72 -0.02 -1.26 -4.92 135.00 135.58 2jhx n PRO 68 Ca -0.21 0.29 0.01 0.00 -2.02 0.00 0.00 63.50 61.57 2jhx n PRO 68 Cb 0.52 -2.44 0.23 0.00 -0.02 0.00 0.00 33.50 31.80 2jhx n PRO 68 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 2jhx h ASN 69 N -0.12 0.89 -3.33 2.55 -1.24 -1.98 -3.39 115.58 108.97 2jhx h ASN 69 Ca -0.49 -0.02 -0.66 0.00 0.71 0.00 0.00 56.30 55.85 2jhx h ASN 69 Cb 1.32 -0.22 -0.27 0.00 0.73 0.00 0.00 38.32 39.89 2jhx h ASN 69 CO 0.49 0.64 -0.75 -0.69 -1.29 0.00 0.00 177.43 175.83 2jhx s VAL 70 N -5.88 3.16 -0.23 2.57 1.01 -1.26 -0.14 120.40 119.63 2jhx s VAL 70 Ca -0.11 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.28 2jhx s VAL 70 Cb 0.18 -2.37 0.04 0.00 0.00 0.00 0.00 36.38 34.23 2jhx s VAL 70 CO 0.79 0.49 -0.13 -0.69 0.00 0.00 0.00 175.10 175.56 2jhx s VAL 71 N 0.79 2.27 -0.15 2.92 1.01 -0.56 -4.92 120.40 121.76 2jhx s VAL 71 Ca -0.04 -1.27 -0.24 0.00 0.00 0.00 0.00 61.98 60.43 2jhx s VAL 71 Cb -0.15 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 2jhx s VAL 71 CO 0.01 0.21 0.78 -0.69 0.00 0.00 0.00 175.10 175.41 2jhx s VAL 72 N 1.21 4.94 -0.03 2.92 1.01 -1.26 -0.77 120.40 128.41 2jhx s VAL 72 Ca -0.02 1.53 0.10 0.00 0.00 0.00 0.00 61.98 63.59 2jhx s VAL 72 Cb -0.17 -4.09 -0.15 0.00 0.00 0.00 0.00 36.38 31.97 2jhx s VAL 72 CO -0.08 0.09 0.18 0.35 0.00 0.00 0.00 175.10 175.64 2jhx n THR 73 N 4.53 0.16 -3.49 3.92 -2.24 0.13 -4.37 114.28 112.92 2jhx n THR 73 Ca 0.02 -0.28 -0.10 0.00 -2.27 0.00 0.00 64.05 61.42 2jhx n THR 73 Cb 0.49 0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 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 -3.43 -0.49 -0.08 3.38 0.00 -1.11 -1.16 107.32 104.43 2jhx s GLY 74 Ca -0.04 1.03 0.03 0.00 0.00 0.00 0.00 44.72 45.74 2jhx s GLY 74 CO 0.42 0.43 -0.18 -2.27 0.00 0.00 0.00 173.10 171.50 2jhx s LEU 75 N -2.27 1.86 -0.04 0.66 0.20 -0.86 -1.11 118.68 117.11 2jhx s LEU 75 Ca 0.02 -0.42 0.04 0.00 0.69 0.00 0.00 54.13 54.46 2jhx s LEU 75 Cb -0.01 -1.10 -0.00 0.00 -0.43 0.00 0.00 46.19 44.65 2jhx s LEU 75 CO -0.07 0.10 -0.17 -0.89 -0.29 0.00 0.00 176.35 175.02 2jhx s THR 76 N 0.49 1.45 -0.42 3.68 2.01 -0.03 -0.24 115.64 122.58 2jhx s THR 76 Ca -0.16 -0.73 -0.21 0.00 0.31 0.00 0.00 61.69 60.90 2jhx s THR 76 Cb -0.17 -1.25 0.02 0.00 0.01 0.00 0.00 72.50 71.12 2jhx s THR 76 CO 0.06 0.42 0.65 -0.76 -0.69 0.00 0.00 174.62 174.30 2jhx s LEU 77 N 0.02 4.43 -0.37 4.42 1.43 -0.13 -0.52 118.68 127.97 2jhx s LEU 77 Ca -0.04 -0.23 -0.21 0.00 -1.03 0.00 0.00 54.13 52.63 2jhx s LEU 77 Cb -0.11 -2.75 0.01 0.00 0.03 0.00 0.00 46.19 43.36 2jhx s LEU 77 CO 0.02 -0.75 0.67 -0.69 0.23 0.00 0.00 176.35 175.84 2jhx s VAL 78 N 2.82 4.84 -0.26 -1.59 1.01 0.26 -4.55 120.40 122.93 2jhx s VAL 78 Ca 0.23 0.58 -0.01 0.00 0.00 0.00 0.00 61.98 62.79 2jhx s VAL 78 Cb -0.14 -4.13 0.15 0.00 0.00 0.00 0.00 36.38 32.26 2jhx s VAL 78 CO 0.18 -0.39 0.39 0.00 0.00 0.00 0.00 175.10 175.29 2jhx h SER 80 N 8.17 0.26 1.11 0.00 0.02 -1.95 -2.61 113.55 118.55 2jhx h SER 80 Ca -0.15 -0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.75 2jhx h SER 80 Cb 1.14 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.61 2jhx h SER 80 CO 0.27 0.18 -0.22 0.77 -1.14 0.00 0.00 176.83 176.69 2jhx h SER 81 N 0.31 0.00 -3.39 3.07 4.64 -1.96 -3.46 113.55 112.76 2jhx h SER 81 Ca 0.13 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 60.93 2jhx h SER 81 Cb 0.15 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.30 2jhx h SER 81 CO -0.03 0.22 0.76 0.00 -0.87 0.00 0.00 176.83 176.92 2jhx s ALA 82 N -3.52 3.63 -0.79 5.18 0.00 -0.99 -4.91 121.76 120.37 2jhx s ALA 82 Ca 0.02 1.34 0.24 0.00 0.00 0.00 0.00 51.96 53.56 2jhx s ALA 82 Cb 0.09 -3.56 0.93 0.00 0.00 0.00 0.00 23.12 20.58 2jhx s ALA 82 CO 0.65 -0.76 1.74 -0.35 0.00 0.00 0.00 175.76 177.04 2jhx n PRO 83 N 2.30 0.13 -4.25 0.00 -0.04 -1.26 -4.89 135.00 126.99 2jhx n PRO 83 Ca 0.07 0.22 -0.15 0.00 -0.04 0.00 0.00 63.50 63.59 2jhx n PRO 83 Cb 0.40 -1.69 -0.09 0.00 -0.04 0.00 0.00 33.50 32.08 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 -3.32 1.77 0.63 0.55 0.00 -1.26 -5.15 107.32 100.54 2jhx s GLY 84 Ca 0.09 -1.81 -0.17 0.00 0.00 0.00 0.00 44.72 42.84 2jhx s GLY 84 CO 0.47 -1.46 1.14 2.56 0.00 0.00 0.00 173.10 175.81 2jhx s PRO 85 N -3.93 2.86 -0.46 2.90 0.04 -1.26 -5.00 135.00 130.14 2jhx s PRO 85 Ca 0.39 1.56 0.06 0.00 0.04 0.00 0.00 61.00 63.05 2jhx s PRO 85 Cb 0.06 -1.94 0.21 0.00 0.04 0.00 0.00 34.50 32.86 2jhx s PRO 85 CO 0.17 -1.23 0.47 1.28 0.04 0.00 0.00 177.00 177.72 2jhx n LEU 86 N -2.07 0.61 -4.04 -3.56 4.77 -1.26 -5.10 117.00 106.35 2jhx n LEU 86 Ca 0.12 -4.70 -0.21 0.00 -0.03 0.00 0.00 56.01 51.19 2jhx n LEU 86 Cb 0.51 0.30 -0.15 0.00 -2.33 0.00 0.00 43.42 41.75 2jhx n LEU 86 CO 0.46 1.94 -0.45 -1.61 -1.33 0.00 0.00 177.39 176.40 2jhx s GLU 87 N -0.83 0.99 -0.23 3.23 2.02 -1.26 -0.95 118.70 121.65 2jhx s GLU 87 Ca 0.33 -0.37 -0.09 0.00 0.02 0.00 0.00 54.97 54.87 2jhx s GLU 87 Cb 0.09 -0.93 -0.04 0.00 0.10 0.00 0.00 34.13 33.35 2jhx s GLU 87 CO -0.14 0.19 0.11 -0.51 0.02 0.00 0.00 175.26 174.92 2jhx s LEU 88 N -0.05 3.78 -0.67 1.80 1.43 0.67 -5.00 118.68 120.64 2jhx s LEU 88 Ca 0.01 -0.03 -0.23 0.00 -1.03 0.00 0.00 54.13 52.84 2jhx s LEU 88 Cb -0.07 -2.01 0.06 0.00 0.03 0.00 0.00 46.19 44.21 2jhx s LEU 88 CO 0.00 0.04 1.03 -0.62 0.23 0.00 0.00 176.35 177.03 2jhx s ASP 89 N 1.18 6.17 0.00 2.29 -1.08 -1.26 -2.03 116.67 121.94 2jhx s ASP 89 Ca 0.06 -0.87 0.28 0.00 -0.52 0.00 0.00 52.55 51.49 2jhx s ASP 89 Cb -0.14 -2.45 1.54 0.00 -1.46 0.00 0.00 42.92 40.41 2jhx s ASP 89 CO 0.04 -1.52 1.97 0.18 0.52 0.00 0.00 175.17 176.37 2jhx n LEU 90 N 8.04 0.00 0.09 -1.34 4.77 -0.31 -2.10 117.00 126.15 2jhx n LEU 90 Ca -0.02 0.12 0.12 0.00 -0.03 0.00 0.00 56.01 56.20 2jhx n LEU 90 Cb 0.46 -0.12 0.24 0.00 -2.33 0.00 0.00 43.42 41.67 2jhx n LEU 90 CO 0.65 -0.01 0.54 0.71 -1.33 0.00 0.00 177.39 177.95 2jhx h THR 91 N 0.00 0.00 -0.60 -5.08 1.35 -1.76 -3.46 112.91 103.37 2jhx h THR 91 Ca 0.00 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.32 2jhx h THR 91 Cb 0.11 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 2jhx h THR 91 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2jhx n GLY 92 N 1.31 0.84 3.58 5.82 0.00 -0.89 -5.00 105.19 110.84 2jhx n GLY 92 Ca 0.04 -1.63 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 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 6.53 0.36 1.61 -1.08 -1.26 -4.93 116.67 116.90 2jhx s ASP 93 Ca 0.00 0.26 0.12 0.00 -0.52 0.00 0.00 52.55 52.41 2jhx s ASP 93 Cb 0.00 -2.41 0.69 0.00 -1.46 0.00 0.00 42.92 39.74 2jhx s ASP 93 CO 0.00 -0.83 1.81 -0.07 0.52 0.00 0.00 175.17 176.60 2jhx h LEU 94 N 9.97 0.02 -1.70 -1.34 3.38 -1.90 -3.07 115.31 120.67 2jhx h LEU 94 Ca -0.24 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.74 2jhx h LEU 94 Cb 1.09 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.81 2jhx h LEU 94 CO 0.95 0.40 0.24 -0.08 0.09 0.00 0.00 178.44 180.04 2jhx h GLU 95 N 0.01 0.39 -0.81 1.13 4.57 -1.95 -2.56 114.58 115.36 2jhx h GLU 95 Ca -0.00 -0.02 0.17 0.00 -1.18 0.00 0.00 59.36 58.32 2jhx h GLU 95 Cb 0.68 -0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 29.13 2jhx h GLU 95 CO 0.05 0.26 0.54 0.77 -1.18 0.00 0.00 179.01 179.44 2jhx h SER 96 N 0.40 0.39 0.60 1.04 0.02 -1.95 -2.78 113.55 111.26 2jhx h SER 96 Ca 0.15 0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.09 2jhx h SER 96 Cb 0.09 -0.05 -0.00 0.00 0.14 0.00 0.00 62.40 62.58 2jhx h SER 96 CO -0.03 0.18 -0.16 -0.26 -1.14 0.00 0.00 176.83 175.42 2jhx h PHE 97 N 0.40 0.00 0.00 3.45 0.04 -1.67 -2.97 116.94 116.20 2jhx h PHE 97 Ca 0.40 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 61.17 2jhx h PHE 97 Cb 0.97 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.12 2jhx h PHE 97 CO -0.00 0.16 -0.02 0.87 -0.60 0.00 0.00 178.31 178.72 2jhx h LYS 98 N 0.00 0.00 -0.69 1.51 1.57 -1.68 -2.13 116.57 115.15 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 0.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.81 2jhx h LYS 98 CO 0.02 0.02 0.00 1.63 -0.57 0.00 0.00 179.45 180.55 2jhx n LYS 99 N -4.00 3.35 -4.58 3.15 4.76 -1.12 -4.95 118.16 114.76 2jhx n LYS 99 Ca -0.03 -2.81 -0.27 0.00 -2.87 0.00 0.00 58.31 52.33 2jhx n LYS 99 Cb 0.10 -1.77 -0.11 0.00 -1.84 0.00 0.00 35.03 31.41 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 -1.51 1.89 0.02 1.97 -0.21 -0.80 -5.17 119.66 115.85 2jhx s GLN 100 Ca 0.51 -2.06 -0.21 0.00 0.02 0.00 0.00 55.36 53.62 2jhx s GLN 100 Cb 0.30 -1.50 0.04 0.00 1.00 0.00 0.00 33.01 32.85 2jhx s GLN 100 CO 0.28 -0.06 0.47 0.45 -2.12 0.00 0.00 175.29 174.31 2jhx s SER 101 N -3.66 -0.37 0.02 5.90 0.15 -1.26 -4.26 113.70 110.22 2jhx s SER 101 Ca 0.35 0.17 -0.14 0.00 0.70 0.00 0.00 55.95 57.03 2jhx s SER 101 Cb 0.09 0.44 -0.06 0.00 -1.71 0.00 0.00 66.02 64.79 2jhx s SER 101 CO 0.17 -0.64 0.41 -0.36 1.20 0.00 0.00 173.24 174.03 2jhx s PHE 102 N -2.08 3.70 -0.16 3.44 0.08 -0.44 -4.95 117.98 117.56 2jhx s PHE 102 Ca -0.08 0.95 -0.07 0.00 0.12 0.00 0.00 56.93 57.86 2jhx s PHE 102 Cb -0.01 -2.26 -0.04 0.00 -0.57 0.00 0.00 43.02 40.13 2jhx s PHE 102 CO 0.01 0.62 0.06 0.08 -0.10 0.00 0.00 175.22 175.88 2jhx s VAL 103 N -1.15 4.80 -0.03 -0.44 1.01 -1.26 -0.23 120.40 123.10 2jhx s VAL 103 Ca 0.26 -0.04 0.08 0.00 0.00 0.00 0.00 61.98 62.28 2jhx s VAL 103 Cb -0.16 -3.13 -0.02 0.00 0.00 0.00 0.00 36.38 33.07 2jhx s VAL 103 CO 0.14 0.50 -0.26 -0.76 0.00 0.00 0.00 175.10 174.73 2jhx s LEU 104 N 0.04 2.05 0.24 3.92 1.43 -0.47 -4.95 118.68 120.94 2jhx s LEU 104 Ca 0.06 -0.47 -0.30 0.00 -1.03 0.00 0.00 54.13 52.39 2jhx s LEU 104 Cb -0.12 -1.33 -0.09 0.00 0.03 0.00 0.00 46.19 44.68 2jhx s LEU 104 CO 0.01 0.30 1.19 -0.75 0.23 0.00 0.00 176.35 177.33 2jhx s LYS 105 N -0.54 4.51 0.39 1.70 2.20 -1.26 -1.37 119.74 125.38 2jhx s LYS 105 Ca 0.08 1.92 -0.25 0.00 -0.36 0.00 0.00 55.97 57.35 2jhx s LYS 105 Cb -0.10 -3.20 -0.11 0.00 -1.51 0.00 0.00 37.83 32.91 2jhx s LYS 105 CO -0.00 -0.02 1.05 -0.85 -0.36 0.00 0.00 175.35 175.17 2jhx n GLU 106 N 1.87 1.46 0.00 4.03 0.28 0.36 -2.54 120.64 126.09 2jhx n GLU 106 Ca 0.02 0.52 0.00 0.00 -0.16 0.00 0.00 57.16 57.54 2jhx n GLU 106 Cb 0.44 -2.06 0.00 0.00 1.43 0.00 0.00 31.44 31.25 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 1.13 2.45 3.81 -1.84 0.00 -0.40 -4.95 105.19 105.38 2jhx n GLY 107 Ca 0.09 0.00 -0.33 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 -2.29 3.96 0.27 1.61 -7.23 -1.05 -4.48 120.40 111.19 2jhx s VAL 108 Ca 0.00 1.16 -0.24 0.00 -1.81 0.00 0.00 61.98 61.09 2jhx s VAL 108 Cb 0.00 -3.49 -0.09 0.00 0.56 0.00 0.00 36.38 33.36 2jhx s VAL 108 CO 0.00 -0.33 0.85 -1.61 -0.31 0.00 0.00 175.10 173.70 2jhx s GLU 109 N -3.40 4.46 0.09 4.82 2.02 -1.26 -0.69 118.70 124.74 2jhx s GLU 109 Ca 0.65 1.14 -0.19 0.00 0.02 0.00 0.00 54.97 56.59 2jhx s GLU 109 Cb -0.14 -2.87 0.05 0.00 0.10 0.00 0.00 34.13 31.26 2jhx s GLU 109 CO 0.22 0.35 0.47 1.52 0.02 0.00 0.00 175.26 177.84 2jhx s TYR 110 N -1.54 -0.34 0.29 1.61 1.13 0.01 -4.53 117.35 113.98 2jhx s TYR 110 Ca 0.46 0.20 0.09 0.00 -1.41 0.00 0.00 57.07 56.40 2jhx s TYR 110 Cb -0.18 0.32 -0.06 0.00 -1.10 0.00 0.00 41.96 40.95 2jhx s TYR 110 CO 0.23 -0.68 -0.11 1.03 -2.51 0.00 0.00 175.55 173.50 2jhx s ARG 111 N -3.15 1.62 -0.16 -3.49 0.52 -0.43 -1.11 118.95 112.74 2jhx s ARG 111 Ca -0.01 -1.79 -0.03 0.00 -0.52 0.00 0.00 55.73 53.38 2jhx s ARG 111 Cb 0.00 -1.43 -0.02 0.00 0.52 0.00 0.00 34.95 34.02 2jhx s ARG 111 CO -0.07 0.15 -0.06 0.42 0.02 0.00 0.00 175.30 175.76 2jhx s ILE 112 N -2.79 3.56 -0.17 1.52 1.01 -1.26 -0.57 121.20 122.50 2jhx s ILE 112 Ca 0.29 -0.47 -0.01 0.00 0.00 0.00 0.00 60.65 60.46 2jhx s ILE 112 Cb 0.01 -2.56 -0.01 0.00 0.01 0.00 0.00 42.46 39.91 2jhx s ILE 112 CO 0.13 0.49 -0.10 -0.75 0.00 0.00 0.00 174.94 174.70 2jhx s LYS 113 N 0.59 3.36 -0.20 2.79 2.20 0.33 -1.26 119.74 127.54 2jhx s LYS 113 Ca -0.04 -0.67 -0.05 0.00 -0.36 0.00 0.00 55.97 54.84 2jhx s LYS 113 Cb -0.15 -2.77 -0.03 0.00 -1.51 0.00 0.00 37.83 33.37 2jhx s LYS 113 CO 0.03 0.03 0.01 0.42 -0.36 0.00 0.00 175.35 175.48 2jhx s ILE 114 N 0.83 4.12 -0.06 5.43 -1.09 0.45 -0.85 121.20 130.03 2jhx s ILE 114 Ca -0.03 -0.26 0.01 0.00 -2.23 0.00 0.00 60.65 58.14 2jhx s ILE 114 Cb -0.15 -2.86 -0.03 0.00 -1.58 0.00 0.00 42.46 37.84 2jhx s ILE 114 CO 0.01 0.43 -0.08 -0.44 -1.23 0.00 0.00 174.94 173.63 2jhx s SER 115 N 0.86 4.52 0.10 3.58 0.01 -0.27 -0.83 113.70 121.67 2jhx s SER 115 Ca 0.01 -0.06 -0.23 0.00 1.31 0.00 0.00 55.95 56.99 2jhx s SER 115 Cb -0.14 -1.11 0.06 0.00 0.21 0.00 0.00 66.02 65.04 2jhx s SER 115 CO 0.02 0.36 0.56 0.72 0.41 0.00 0.00 173.24 175.31 2jhx s PHE 116 N -0.78 -0.48 0.10 2.43 -0.71 -0.54 -0.69 117.98 117.30 2jhx s PHE 116 Ca 0.12 0.42 0.10 0.00 -1.04 0.00 0.00 56.93 56.52 2jhx s PHE 116 Cb -0.11 0.44 -0.04 0.00 -1.21 0.00 0.00 43.02 42.11 2jhx s PHE 116 CO 0.01 -0.74 -0.24 1.03 -1.34 0.00 0.00 175.22 173.94 2jhx s ARG 117 N -3.07 1.64 -0.18 1.99 0.52 0.05 -0.34 118.95 119.55 2jhx s ARG 117 Ca -0.02 -1.22 -0.03 0.00 -0.52 0.00 0.00 55.73 53.94 2jhx s ARG 117 Cb -0.00 -2.00 -0.01 0.00 0.52 0.00 0.00 34.95 33.46 2jhx s ARG 117 CO -0.07 0.48 -0.07 0.08 0.02 0.00 0.00 175.30 175.74 2jhx s VAL 118 N -1.02 3.38 -0.23 3.52 1.01 -1.26 -1.50 120.40 124.31 2jhx s VAL 118 Ca 0.15 -0.51 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 2jhx s VAL 118 Cb -0.10 -2.50 -0.14 0.00 0.00 0.00 0.00 36.38 33.64 2jhx s VAL 118 CO 0.06 0.46 -0.22 0.59 0.00 0.00 0.00 175.10 176.00 2jhx n ASN 119 N 4.22 2.16 0.00 3.32 3.02 0.80 -1.75 115.26 127.02 2jhx n ASN 119 Ca -0.18 -0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.32 2jhx n ASN 119 Cb 0.52 -0.41 0.00 0.00 -0.61 0.00 0.00 39.78 39.27 2jhx n ASN 119 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2jhx n ARG 120 N -3.31 0.67 -4.07 3.52 1.74 -1.26 -4.63 116.66 109.32 2jhx n ARG 120 Ca -0.41 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 56.56 2jhx n ARG 120 Cb 0.91 -0.73 -0.11 0.00 -1.02 0.00 0.00 32.46 31.51 2jhx n ARG 120 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2jhx s GLU 121 N -1.46 0.56 0.48 5.56 2.02 -1.26 -4.78 118.70 119.83 2jhx s GLU 121 Ca 0.00 -0.92 -0.22 0.00 0.02 0.00 0.00 54.97 53.85 2jhx s GLU 121 Cb 0.00 -0.13 -0.07 0.00 0.10 0.00 0.00 34.13 34.03 2jhx s GLU 121 CO 0.00 -0.00 1.19 0.42 0.02 0.00 0.00 175.26 176.89 2jhx s ILE 122 N -2.21 2.96 0.01 -1.63 1.01 -1.26 -4.44 121.20 115.64 2jhx s ILE 122 Ca -0.04 0.70 0.07 0.00 0.00 0.00 0.00 60.65 61.39 2jhx s ILE 122 Cb -0.04 -3.35 -0.02 0.00 0.01 0.00 0.00 42.46 39.06 2jhx s ILE 122 CO -0.02 -0.02 -0.22 -0.69 0.00 0.00 0.00 174.94 173.98 2jhx s VAL 123 N -1.53 1.78 0.09 2.92 1.01 -0.22 -5.01 120.40 119.44 2jhx s VAL 123 Ca 0.66 -1.09 0.07 0.00 0.00 0.00 0.00 61.98 61.62 2jhx s VAL 123 Cb -0.30 -1.51 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 2jhx s VAL 123 CO 0.36 0.39 -0.17 -0.94 0.00 0.00 0.00 175.10 174.73 2jhx s SER 124 N -0.82 2.09 -1.40 3.32 1.04 -1.26 -1.29 113.70 115.37 2jhx s SER 124 Ca 0.09 -0.66 -0.02 0.00 0.48 0.00 0.00 55.95 55.84 2jhx s SER 124 Cb -0.09 -0.09 0.00 0.00 0.10 0.00 0.00 66.02 65.94 2jhx s SER 124 CO 0.00 -0.02 0.29 0.61 0.98 0.00 0.00 173.24 175.10 2jhx n GLY 125 N 1.16 -0.34 3.66 7.32 0.00 -1.19 -1.76 105.19 114.04 2jhx n GLY 125 Ca -0.20 -0.07 -0.45 0.00 0.00 0.00 0.00 46.02 45.30 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 1.88 -3.79 1.61 2.81 0.26 -3.13 117.12 113.62 2jhx n MET 126 Ca -0.15 0.67 -0.14 0.00 -1.81 0.00 0.00 57.70 56.27 2jhx n MET 126 Cb 0.63 -2.26 -0.15 0.00 -0.71 0.00 0.00 33.22 30.73 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 -0.81 0.04 -0.19 0.03 2.20 0.39 -0.53 119.74 120.86 2jhx s LYS 127 Ca 0.65 0.22 -0.05 0.00 -0.36 0.00 0.00 55.97 56.43 2jhx s LYS 127 Cb -0.66 -0.15 -0.03 0.00 -1.51 0.00 0.00 37.83 35.48 2jhx s LYS 127 CO 0.53 -0.12 0.01 -0.47 -0.36 0.00 0.00 175.35 174.94 2jhx s TYR 128 N 0.81 3.07 -0.08 4.03 5.04 -0.37 -0.70 117.35 129.15 2jhx s TYR 128 Ca -0.06 -0.32 0.04 0.00 -2.44 0.00 0.00 57.07 54.29 2jhx s TYR 128 Cb -0.09 -2.06 -0.00 0.00 0.35 0.00 0.00 41.96 40.16 2jhx s TYR 128 CO -0.03 -0.13 -0.22 0.42 -1.34 0.00 0.00 175.55 174.25 2jhx s ILE 129 N 0.78 1.88 -0.11 3.14 1.01 0.06 -0.07 121.20 127.90 2jhx s ILE 129 Ca 0.01 -0.93 0.02 0.00 0.00 0.00 0.00 60.65 59.74 2jhx s ILE 129 Cb -0.14 -1.63 0.01 0.00 0.01 0.00 0.00 42.46 40.71 2jhx s ILE 129 CO 0.02 0.52 -0.17 -1.10 0.00 0.00 0.00 174.94 174.21 2jhx s GLN 130 N 0.26 2.40 -0.21 2.79 -0.21 -0.10 -0.89 119.66 123.70 2jhx s GLN 130 Ca -0.14 -0.63 -0.06 0.00 0.02 0.00 0.00 55.36 54.55 2jhx s GLN 130 Cb -0.16 -1.99 -0.03 0.00 1.00 0.00 0.00 33.01 31.83 2jhx s GLN 130 CO 0.07 -0.03 0.03 -1.01 -2.12 0.00 0.00 175.29 172.23 2jhx s HIS 131 N 0.88 3.09 -0.11 0.91 3.76 0.45 -1.01 115.29 123.26 2jhx s HIS 131 Ca -0.08 -0.31 -0.01 0.00 -0.15 0.00 0.00 55.06 54.50 2jhx s HIS 131 Cb -0.15 -2.11 -0.03 0.00 1.11 0.00 0.00 32.58 31.40 2jhx s HIS 131 CO -0.00 -0.17 -0.06 0.99 -0.85 0.00 0.00 174.74 174.65 2jhx s THR 132 N 0.97 3.75 0.10 1.30 2.01 0.19 -0.39 115.64 123.58 2jhx s THR 132 Ca 0.02 -0.44 0.05 0.00 0.31 0.00 0.00 61.69 61.64 2jhx s THR 132 Cb -0.14 -2.58 -0.03 0.00 0.01 0.00 0.00 72.50 69.75 2jhx s THR 132 CO 0.02 0.55 -0.14 -0.31 -0.69 0.00 0.00 174.62 174.06 2jhx s TYR 133 N -0.25 1.31 -0.08 4.92 1.51 0.37 -0.40 117.35 124.75 2jhx s TYR 133 Ca 0.04 -0.53 0.01 0.00 -1.01 0.00 0.00 57.07 55.58 2jhx s TYR 133 Cb -0.13 -0.70 0.02 0.00 -0.11 0.00 0.00 41.96 41.04 2jhx s TYR 133 CO 0.02 0.10 -0.10 1.03 -1.11 0.00 0.00 175.55 175.49 2jhx s ARG 134 N -2.37 1.57 -1.52 -0.62 0.52 0.04 -1.16 118.95 115.41 2jhx s ARG 134 Ca 0.05 -0.34 -0.04 0.00 -0.52 0.00 0.00 55.73 54.88 2jhx s ARG 134 Cb -0.06 -1.40 0.03 0.00 0.52 0.00 0.00 34.95 34.04 2jhx s ARG 134 CO 0.02 -0.06 0.33 1.63 0.02 0.00 0.00 175.30 177.24 2jhx n LYS 135 N 4.13 -2.33 -0.93 3.54 4.76 -1.26 -1.38 118.16 124.69 2jhx n LYS 135 Ca -0.20 0.28 0.00 0.00 -2.87 0.00 0.00 58.31 55.51 2jhx n LYS 135 Cb 0.51 -4.29 0.00 0.00 -1.84 0.00 0.00 35.03 29.41 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 -2.07 0.40 3.53 0.72 0.00 -1.26 -5.02 105.19 101.49 2jhx n GLY 136 Ca -0.24 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.00 4.20 -0.08 1.61 1.01 -0.48 -5.07 120.40 119.60 2jhx s VAL 137 Ca 0.00 -0.24 -0.30 0.00 0.00 0.00 0.00 61.98 61.44 2jhx s VAL 137 Cb 0.00 -2.87 -0.03 0.00 0.00 0.00 0.00 36.38 33.47 2jhx s VAL 137 CO 0.00 0.47 1.33 -0.75 0.00 0.00 0.00 175.10 176.14 2jhx s LYS 138 N 0.51 4.27 -0.02 2.72 2.20 -1.26 -0.78 119.74 127.38 2jhx s LYS 138 Ca -0.01 1.81 0.15 0.00 -0.36 0.00 0.00 55.97 57.56 2jhx s LYS 138 Cb -0.14 -3.68 -0.23 0.00 -1.51 0.00 0.00 37.83 32.28 2jhx s LYS 138 CO 0.02 -0.61 0.34 0.44 -0.36 0.00 0.00 175.35 175.18 2jhx n ILE 139 N 4.98 0.00 -3.61 5.43 -5.35 0.47 -4.96 119.36 116.32 2jhx n ILE 139 Ca 0.13 -0.33 -0.16 0.00 -0.27 0.00 0.00 62.75 62.12 2jhx n ILE 139 Cb 0.45 0.20 -0.07 0.00 -1.74 0.00 0.00 39.64 38.48 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 -3.65 -0.52 -0.10 7.28 -1.08 -0.99 -4.99 116.67 112.62 2jhx s ASP 140 Ca -0.05 0.61 0.01 0.00 -0.52 0.00 0.00 52.55 52.61 2jhx s ASP 140 Cb 0.10 0.57 0.02 0.00 -1.46 0.00 0.00 42.92 42.14 2jhx s ASP 140 CO 0.62 -0.51 -0.13 -0.75 0.52 0.00 0.00 175.17 174.92 2jhx s LYS 141 N -1.02 1.92 -0.04 4.34 2.20 -1.26 -0.64 119.74 125.24 2jhx s LYS 141 Ca -0.10 -0.45 0.03 0.00 -0.36 0.00 0.00 55.97 55.08 2jhx s LYS 141 Cb -0.02 -1.69 0.01 0.00 -1.51 0.00 0.00 37.83 34.62 2jhx s LYS 141 CO 0.07 -0.09 -0.11 0.99 -0.36 0.00 0.00 175.35 175.85 2jhx s THR 142 N 1.07 1.00 -0.04 3.43 2.01 -0.18 -5.01 115.64 117.91 2jhx s THR 142 Ca -0.06 -0.44 0.01 0.00 0.31 0.00 0.00 61.69 61.51 2jhx s THR 142 Cb -0.15 -0.90 -0.03 0.00 0.01 0.00 0.00 72.50 71.43 2jhx s THR 142 CO -0.02 0.31 -0.04 -1.81 -0.69 0.00 0.00 174.62 172.37 2jhx s ASP 143 N 0.40 4.85 -0.11 3.53 -0.00 -1.26 -0.92 116.67 123.16 2jhx s ASP 143 Ca -0.08 -0.02 0.01 0.00 -0.00 0.00 0.00 52.55 52.47 2jhx s ASP 143 Cb -0.12 -1.24 0.02 0.00 -0.00 0.00 0.00 42.92 41.58 2jhx s ASP 143 CO 0.02 0.33 -0.14 -0.31 -0.00 0.00 0.00 175.17 175.07 2jhx s TYR 144 N -0.93 1.90 -0.13 4.23 2.02 0.90 -5.00 117.35 120.34 2jhx s TYR 144 Ca 0.15 -0.90 -0.29 0.00 -0.37 0.00 0.00 57.07 55.66 2jhx s TYR 144 Cb -0.11 -1.39 -0.01 0.00 -0.40 0.00 0.00 41.96 40.05 2jhx s TYR 144 CO 0.05 -0.48 0.98 1.41 -1.57 0.00 0.00 175.55 175.94 2jhx s MET 145 N 1.06 4.38 -0.26 -0.62 1.75 -1.26 -1.24 119.30 123.11 2jhx s MET 145 Ca -0.05 1.33 -0.01 0.00 -1.25 0.00 0.00 55.69 55.70 2jhx s MET 145 Cb -0.15 -3.56 -0.15 0.00 2.84 0.00 0.00 34.83 33.81 2jhx s MET 145 CO -0.02 -0.36 -0.25 0.28 -0.65 0.00 0.00 175.02 174.01 2jhx n VAL 146 N 4.69 1.45 0.00 10.11 0.31 0.30 -4.96 118.33 130.24 2jhx n VAL 146 Ca 0.09 -0.51 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 2jhx n VAL 146 Cb 0.48 -1.50 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 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 2.08 0.51 3.61 2.92 0.00 -0.95 -4.92 105.19 108.44 2jhx n GLY 147 Ca -0.46 -2.29 -0.34 0.00 0.00 0.00 0.00 46.02 42.93 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 4.80 -0.03 1.61 0.01 -1.26 -0.57 113.70 114.25 2jhx s SER 148 Ca 0.00 -0.01 -0.04 0.00 1.31 0.00 0.00 55.95 57.21 2jhx s SER 148 Cb 0.00 -1.23 0.01 0.00 0.21 0.00 0.00 66.02 65.01 2jhx s SER 148 CO 0.00 0.34 0.10 -0.31 0.41 0.00 0.00 173.24 173.79 2jhx s TYR 149 N -0.88 -0.06 0.40 2.43 2.02 -0.41 -5.01 117.35 115.84 2jhx s TYR 149 Ca 0.14 0.16 0.08 0.00 -0.37 0.00 0.00 57.07 57.07 2jhx s TYR 149 Cb -0.11 0.01 -0.00 0.00 -0.40 0.00 0.00 41.96 41.45 2jhx s TYR 149 CO 0.03 -0.11 0.49 0.20 -1.57 0.00 0.00 175.55 174.60 2jhx s GLY 150 N -0.32 1.93 0.28 0.71 0.00 -1.26 -1.05 107.32 107.60 2jhx s GLY 150 Ca -0.04 -1.69 -0.29 0.00 0.00 0.00 0.00 44.72 42.70 2jhx s GLY 150 CO 0.00 -1.53 1.19 2.56 0.00 0.00 0.00 173.10 175.33 2jhx s PRO 151 N -4.25 4.52 0.18 2.90 0.04 -1.26 -4.73 135.00 132.39 2jhx s PRO 151 Ca 0.51 1.96 -0.24 0.00 0.04 0.00 0.00 61.00 63.28 2jhx s PRO 151 Cb -0.08 -3.15 0.05 0.00 0.04 0.00 0.00 34.50 31.36 2jhx s PRO 151 CO 0.31 0.02 0.80 -0.98 0.04 0.00 0.00 177.00 177.20 2jhx s ARG 152 N -1.37 1.36 0.01 4.56 1.70 -0.72 -4.98 118.95 119.51 2jhx s ARG 152 Ca 0.47 -0.69 -0.24 0.00 -0.47 0.00 0.00 55.73 54.80 2jhx s ARG 152 Cb -0.35 0.51 -0.17 0.00 -0.57 0.00 0.00 34.95 34.36 2jhx s ARG 152 CO 0.44 -0.62 1.34 0.00 -1.08 0.00 0.00 175.30 175.39 2jhx h ALA 153 N 2.00 0.08 -2.81 7.88 0.00 -1.94 -3.41 119.26 121.06 2jhx h ALA 153 Ca -0.24 -0.24 -0.51 0.00 0.00 0.00 0.00 54.91 53.92 2jhx h ALA 153 Cb 1.25 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 19.05 2jhx h ALA 153 CO 0.27 -0.16 0.53 -1.21 0.00 0.00 0.00 179.25 178.69 2jhx s GLU 154 N -4.48 4.54 0.53 0.00 8.01 -1.26 -4.98 118.70 121.06 2jhx s GLU 154 Ca -0.15 1.93 -0.21 0.00 0.01 0.00 0.00 54.97 56.56 2jhx s GLU 154 Cb 0.03 -3.16 -0.08 0.00 -4.31 0.00 0.00 34.13 26.61 2jhx s GLU 154 CO 0.70 0.06 0.89 0.72 0.01 0.00 0.00 175.26 177.64 2jhx n HIS 155 N 1.26 0.65 -3.99 1.61 8.25 -1.26 -4.84 115.22 116.91 2jhx n HIS 155 Ca -0.00 0.48 -0.23 0.00 -0.26 0.00 0.00 57.72 57.71 2jhx n HIS 155 Cb 0.44 -2.14 -0.03 0.00 1.12 0.00 0.00 29.99 29.38 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 -1.46 3.40 -0.01 4.41 2.02 0.54 -4.96 117.35 121.28 2jhx s TYR 156 Ca 0.70 0.02 0.01 0.00 -0.37 0.00 0.00 57.07 57.43 2jhx s TYR 156 Cb -0.48 -1.58 0.00 0.00 -0.40 0.00 0.00 41.96 39.50 2jhx s TYR 156 CO 0.52 0.48 -0.05 -1.01 -1.57 0.00 0.00 175.55 173.93 2jhx s HIS 157 N -1.89 0.48 -0.12 2.71 3.76 -1.26 -1.47 115.29 117.50 2jhx s HIS 157 Ca 0.34 -0.09 0.03 0.00 -0.15 0.00 0.00 55.06 55.18 2jhx s HIS 157 Cb -0.10 -0.34 -0.00 0.00 1.11 0.00 0.00 32.58 33.25 2jhx s HIS 157 CO 0.28 -0.03 -0.21 0.12 -0.85 0.00 0.00 174.74 174.05 2jhx s PHE 158 N 0.06 2.64 -0.09 1.40 5.36 -0.01 -4.97 117.98 122.37 2jhx s PHE 158 Ca -0.00 -1.02 0.04 0.00 -0.96 0.00 0.00 56.93 54.98 2jhx s PHE 158 Cb -0.04 -1.77 -0.01 0.00 -0.34 0.00 0.00 43.02 40.86 2jhx s PHE 158 CO -0.00 -0.42 -0.21 -0.51 -1.46 0.00 0.00 175.22 172.62 2jhx s LEU 159 N 0.46 2.30 0.84 6.12 1.02 -1.26 -0.41 118.68 127.75 2jhx s LEU 159 Ca -0.14 -0.45 -0.11 0.00 0.02 0.00 0.00 54.13 53.44 2jhx s LEU 159 Cb -0.17 -1.46 0.09 0.00 0.02 0.00 0.00 46.19 44.67 2jhx s LEU 159 CO 0.06 0.21 1.09 0.42 0.02 0.00 0.00 176.35 178.15 2jhx s THR 160 N 0.08 2.96 0.87 5.49 -4.23 -0.39 -4.98 115.64 115.43 2jhx s THR 160 Ca -0.09 0.31 -0.11 0.00 -1.18 0.00 0.00 61.69 60.62 2jhx s THR 160 Cb -0.15 -2.86 0.12 0.00 1.34 0.00 0.00 72.50 70.95 2jhx s THR 160 CO 0.06 -0.41 1.17 -2.84 -0.54 0.00 0.00 174.62 172.06 2jhx s PRO 161 N -4.98 1.26 0.11 3.99 0.02 -1.26 -4.56 135.00 129.59 2jhx s PRO 161 Ca 0.62 1.63 -0.31 0.00 0.02 0.00 0.00 61.00 62.96 2jhx s PRO 161 Cb -0.17 -1.75 -0.09 0.00 0.02 0.00 0.00 34.50 32.52 2jhx s PRO 161 CO 0.56 -2.47 1.55 0.08 -0.33 0.00 0.00 177.00 176.40 2jhx s VAL 162 N -2.45 2.99 0.34 3.83 1.01 -1.26 -4.64 120.40 120.22 2jhx s VAL 162 Ca 0.69 0.60 0.04 0.00 0.00 0.00 0.00 61.98 63.32 2jhx s VAL 162 Cb -0.25 -3.39 -0.06 0.00 0.00 0.00 0.00 36.38 32.68 2jhx s VAL 162 CO 0.55 0.02 0.05 -1.61 0.00 0.00 0.00 175.10 174.12 2jhx s GLU 163 N 1.79 1.72 -0.03 2.72 0.41 -0.27 -4.97 118.70 120.07 2jhx s GLU 163 Ca 0.70 -1.97 0.06 0.00 -0.41 0.00 0.00 54.97 53.36 2jhx s GLU 163 Cb -0.40 -0.97 -0.01 0.00 -1.78 0.00 0.00 34.13 30.97 2jhx s GLU 163 CO 0.31 -0.19 -0.23 -1.21 -0.49 0.00 0.00 175.26 173.45 2jhx s GLU 164 N -3.86 2.07 0.39 1.61 2.02 -1.26 -0.81 118.70 118.86 2jhx s GLU 164 Ca 0.35 -0.82 -0.27 0.00 0.02 0.00 0.00 54.97 54.26 2jhx s GLU 164 Cb 0.08 -1.88 -0.09 0.00 0.10 0.00 0.00 34.13 32.34 2jhx s GLU 164 CO 0.16 0.42 1.34 0.00 0.02 0.00 0.00 175.26 177.20 2jhx s ALA 165 N -0.33 3.35 0.86 5.21 0.00 0.13 -4.92 121.76 126.06 2jhx s ALA 165 Ca 0.03 1.30 -0.12 0.00 0.00 0.00 0.00 51.96 53.18 2jhx s ALA 165 Cb -0.11 -3.51 0.11 0.00 0.00 0.00 0.00 23.12 19.61 2jhx s ALA 165 CO 0.01 -0.85 1.11 -1.25 0.00 0.00 0.00 175.76 174.78 2jhx s PRO 166 N -2.15 1.56 0.18 0.00 0.04 -1.26 -1.28 135.00 132.09 2jhx s PRO 166 Ca 0.55 0.53 0.08 0.00 0.04 0.00 0.00 61.00 62.20 2jhx s PRO 166 Cb -0.40 -1.87 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 2jhx s PRO 166 CO 0.52 -1.96 -0.16 0.15 0.04 0.00 0.00 177.00 175.59 2jhx s LYS 167 N -5.16 1.29 0.00 4.56 1.02 -1.26 -3.40 119.74 116.78 2jhx s LYS 167 Ca 0.62 -1.49 0.00 0.00 0.02 0.00 0.00 55.97 55.13 2jhx s LYS 167 Cb -0.15 -1.20 0.00 0.00 -0.52 0.00 0.00 37.83 35.96 2jhx s LYS 167 CO 0.54 0.22 0.00 0.41 -0.92 0.00 0.00 175.35 175.60 2jhx n GLY 168 N -0.03 1.88 0.34 -3.33 0.00 -1.26 -4.54 105.19 98.24 2jhx n GLY 168 Ca -0.11 -1.95 -0.03 0.00 0.00 0.00 0.00 46.02 43.92 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 1.16 -0.34 1.61 4.05 -1.99 -0.68 114.93 118.74 2jhx h MET 169 Ca 0.00 -0.08 -0.02 0.00 -0.28 0.00 0.00 59.70 59.32 2jhx h MET 169 Cb 0.00 -0.26 -0.02 0.00 -0.80 0.00 0.00 31.60 30.53 2jhx h MET 169 CO 0.00 0.78 0.14 -0.07 0.23 0.00 0.00 176.91 178.00 2jhx h LEU 170 N 1.19 0.46 0.00 3.39 -0.00 -2.03 -3.09 115.31 115.24 2jhx h LEU 170 Ca 0.32 -0.16 0.00 0.00 -0.00 0.00 0.00 57.88 58.04 2jhx h LEU 170 Cb -0.11 -0.12 0.00 0.00 -0.00 0.00 0.00 40.66 40.43 2jhx h LEU 170 CO -0.07 0.49 -0.36 0.00 -0.00 0.00 0.00 178.44 178.51 2jhx h ALA 171 N 0.99 0.79 -2.37 1.53 0.00 -1.73 -3.46 119.26 115.01 2jhx h ALA 171 Ca 0.11 0.00 -0.52 0.00 0.00 0.00 0.00 54.91 54.50 2jhx h ALA 171 Cb 0.17 0.00 0.16 0.00 0.00 0.00 0.00 17.79 18.12 2jhx h ALA 171 CO -0.01 0.00 0.30 1.03 0.00 0.00 0.00 179.25 180.57 2jhx s ARG 172 N -3.19 1.81 0.00 0.00 0.52 -0.29 -4.78 118.95 113.03 2jhx s ARG 172 Ca 0.07 1.43 0.00 0.00 -0.52 0.00 0.00 55.73 56.71 2jhx s ARG 172 Cb 0.11 -1.83 0.00 0.00 0.52 0.00 0.00 34.95 33.75 2jhx s ARG 172 CO 0.68 -2.02 0.00 0.41 0.02 0.00 0.00 175.30 174.39 2jhx n GLY 173 N -0.34 -0.85 3.84 -3.53 0.00 -0.16 -4.91 105.19 99.23 2jhx n GLY 173 Ca 0.11 -2.14 -0.35 0.00 0.00 0.00 0.00 46.02 43.64 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 6.90 0.02 1.61 0.01 -1.26 -0.90 113.70 116.08 2jhx s SER 174 Ca 0.00 1.22 0.01 0.00 1.31 0.00 0.00 55.95 58.49 2jhx s SER 174 Cb 0.00 -2.34 -0.02 0.00 0.21 0.00 0.00 66.02 63.87 2jhx s SER 174 CO 0.00 0.04 -0.05 -0.31 0.41 0.00 0.00 173.24 173.33 2jhx s TYR 175 N -1.56 0.42 0.12 2.43 1.51 0.40 -4.72 117.35 115.96 2jhx s TYR 175 Ca 0.42 -0.36 0.10 0.00 -1.01 0.00 0.00 57.07 56.21 2jhx s TYR 175 Cb -0.15 -0.27 -0.04 0.00 -0.11 0.00 0.00 41.96 41.39 2jhx s TYR 175 CO 0.20 -0.09 -0.21 -1.54 -1.11 0.00 0.00 175.55 172.80 2jhx s SER 176 N -1.06 3.68 -0.06 2.29 1.04 -0.31 -1.23 113.70 118.06 2jhx s SER 176 Ca -0.08 -0.62 0.01 0.00 0.48 0.00 0.00 55.95 55.74 2jhx s SER 176 Cb -0.07 -0.43 0.02 0.00 0.10 0.00 0.00 66.02 65.63 2jhx s SER 176 CO -0.00 0.18 -0.07 -0.63 0.98 0.00 0.00 173.24 173.70 2jhx s ILE 177 N -1.10 0.77 -0.26 -1.02 1.09 0.50 -0.48 121.20 120.70 2jhx s ILE 177 Ca 0.16 -0.25 -0.07 0.00 -1.10 0.00 0.00 60.65 59.40 2jhx s ILE 177 Cb -0.10 -0.76 -0.02 0.00 -1.06 0.00 0.00 42.46 40.52 2jhx s ILE 177 CO 0.08 0.28 0.06 -0.54 -0.10 0.00 0.00 174.94 174.73 2jhx s LYS 178 N 0.92 3.50 -0.09 2.79 1.02 0.48 -1.07 119.74 127.29 2jhx s LYS 178 Ca -0.11 -0.58 -0.02 0.00 0.02 0.00 0.00 55.97 55.29 2jhx s LYS 178 Cb -0.15 -3.30 -0.03 0.00 -0.52 0.00 0.00 37.83 33.83 2jhx s LYS 178 CO 0.01 -0.25 -0.01 -1.12 -0.92 0.00 0.00 175.35 173.06 2jhx s SER 179 N 1.57 5.12 -0.01 2.83 0.01 0.51 -0.41 113.70 123.32 2jhx s SER 179 Ca 0.06 0.09 0.01 0.00 1.31 0.00 0.00 55.95 57.41 2jhx s SER 179 Cb -0.15 -1.49 0.01 0.00 0.21 0.00 0.00 66.02 64.60 2jhx s SER 179 CO 0.02 0.34 -0.01 -0.13 0.41 0.00 0.00 173.24 173.87 2jhx s ARG 180 N -0.68 0.26 -0.21 12.44 3.00 -0.07 -1.53 118.95 132.15 2jhx s ARG 180 Ca 0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 55.73 55.79 2jhx s ARG 180 Cb -0.12 -0.33 0.00 0.00 0.00 0.00 0.00 34.95 34.50 2jhx s ARG 180 CO 0.02 -0.03 -0.08 0.12 0.00 0.00 0.00 175.30 175.34 2jhx s PHE 181 N 0.42 2.93 0.00 -0.53 2.19 -0.10 -0.76 117.98 122.13 2jhx s PHE 181 Ca -0.04 -1.14 0.00 0.00 0.33 0.00 0.00 56.93 56.08 2jhx s PHE 181 Cb -0.07 -2.06 0.00 0.00 -1.31 0.00 0.00 43.02 39.58 2jhx s PHE 181 CO -0.01 -0.62 0.00 -2.37 1.83 0.00 0.00 175.22 174.05 2jhx n THR 182 N 4.75 0.00 -3.13 0.12 5.66 0.12 -1.42 114.28 120.38 2jhx n THR 182 Ca -0.19 0.00 -0.00 0.00 -3.05 0.00 0.00 64.05 60.81 2jhx n THR 182 Cb 0.50 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.28 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 -1.85 -0.02 0.00 1.09 5.68 -1.26 -0.46 116.55 119.74 2jhx n ASP 183 Ca 0.00 -1.02 0.09 0.00 -0.50 0.00 0.00 54.79 53.36 2jhx n ASP 183 Cb 0.00 0.04 0.40 0.00 -1.14 0.00 0.00 41.12 40.42 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 -1.26 0.00 -0.72 -1.12 5.68 -0.72 -1.33 116.55 117.09 2jhx n ASP 184 Ca -0.00 0.48 0.12 0.00 -0.50 0.00 0.00 54.79 54.89 2jhx n ASP 184 Cb 0.01 -0.49 0.34 0.00 -1.14 0.00 0.00 41.12 39.83 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 -1.49 2.18 -2.43 -1.12 8.00 -1.26 -4.96 116.55 115.47 2jhx n ASP 185 Ca 0.05 -1.76 -0.21 0.00 0.71 0.00 0.00 54.79 53.58 2jhx n ASP 185 Cb 0.21 -0.10 -0.00 0.00 -0.02 0.00 0.00 41.12 41.21 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 0.67 -2.20 -2.31 -1.24 5.02 -0.44 -4.96 118.16 112.70 2jhx n LYS 186 Ca 0.17 0.97 -0.41 0.00 -2.02 0.00 0.00 58.31 57.02 2jhx n LYS 186 Cb 0.43 -5.63 -0.03 0.00 -0.02 0.00 0.00 35.03 29.77 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 -3.04 3.36 -1.23 -0.18 2.01 -1.26 -4.86 115.64 110.44 2jhx s THR 187 Ca 0.05 1.18 -0.18 0.00 0.31 0.00 0.00 61.69 63.06 2jhx s THR 187 Cb -0.02 -3.75 0.09 0.00 0.01 0.00 0.00 72.50 68.82 2jhx s THR 187 CO 0.07 0.21 1.61 -0.62 -0.69 0.00 0.00 174.62 175.19 2jhx s ASP 188 N -0.02 6.84 0.15 3.53 2.15 -1.26 -4.04 116.67 124.02 2jhx s ASP 188 Ca 0.52 -2.42 -0.15 0.00 0.43 0.00 0.00 52.55 50.93 2jhx s ASP 188 Cb -0.34 -2.53 0.03 0.00 -0.30 0.00 0.00 42.92 39.77 2jhx s ASP 188 CO 0.40 -1.11 1.74 0.45 -0.17 0.00 0.00 175.17 176.47 2jhx h HIS 189 N 7.82 0.67 -1.77 -5.34 3.86 -1.60 -3.44 115.15 115.35 2jhx h HIS 189 Ca 0.37 -0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.57 2jhx h HIS 189 Cb 0.90 -0.21 -0.24 0.00 1.06 0.00 0.00 27.41 28.92 2jhx h HIS 189 CO 1.32 0.52 0.32 -1.17 0.86 0.00 0.00 177.93 179.79 2jhx s LEU 190 N -9.91 -0.57 -0.05 2.43 2.96 -1.16 -4.68 118.68 107.70 2jhx s LEU 190 Ca -0.13 1.04 0.06 0.00 -0.22 0.00 0.00 54.13 54.87 2jhx s LEU 190 Cb 0.11 2.14 -0.01 0.00 0.50 0.00 0.00 46.19 48.93 2jhx s LEU 190 CO 0.75 -0.23 -0.23 -0.44 -1.32 0.00 0.00 176.35 174.88 2jhx s SER 191 N 0.09 2.83 0.19 3.68 0.01 -1.26 -0.92 113.70 118.31 2jhx s SER 191 Ca 0.01 -0.47 -0.16 0.00 1.31 0.00 0.00 55.95 56.64 2jhx s SER 191 Cb -0.04 -0.73 0.02 0.00 0.21 0.00 0.00 66.02 65.48 2jhx s SER 191 CO -0.02 0.23 0.49 -1.66 0.41 0.00 0.00 173.24 172.69 2jhx s TRP 192 N -0.16 -0.06 -0.01 2.43 -2.14 -0.58 -5.02 118.94 113.41 2jhx s TRP 192 Ca -0.02 -0.29 0.04 0.00 2.66 0.00 0.00 56.10 58.48 2jhx s TRP 192 Cb -0.13 0.33 -0.01 0.00 -3.10 0.00 0.00 33.47 30.56 2jhx s TRP 192 CO 0.03 -0.89 -0.12 -2.00 -2.66 0.00 0.00 176.95 171.32 2jhx s GLU 193 N -3.88 0.93 0.26 3.25 2.12 -1.26 -0.36 118.70 119.76 2jhx s GLU 193 Ca 0.10 -0.42 -0.12 0.00 0.36 0.00 0.00 54.97 54.89 2jhx s GLU 193 Cb -0.00 -0.90 -0.00 0.00 0.26 0.00 0.00 34.13 33.48 2jhx s GLU 193 CO -0.03 0.25 0.49 1.67 -0.54 0.00 0.00 175.26 177.10 2jhx s TRP 194 N -0.29 0.43 0.08 5.30 1.48 -0.23 -4.32 118.94 121.39 2jhx s TRP 194 Ca 0.04 -0.79 0.06 0.00 -1.06 0.00 0.00 56.10 54.35 2jhx s TRP 194 Cb -0.05 0.19 -0.03 0.00 -1.16 0.00 0.00 33.47 32.42 2jhx s TRP 194 CO -0.00 -1.04 -0.15 -0.80 -4.06 0.00 0.00 176.95 170.90 2jhx s ASN 195 N -3.05 1.85 -0.02 -2.66 0.01 -1.26 -0.37 114.94 109.44 2jhx s ASN 195 Ca 0.23 -0.66 0.01 0.00 -0.71 0.00 0.00 52.86 51.73 2jhx s ASN 195 Cb -0.01 -0.06 0.01 0.00 0.41 0.00 0.00 41.25 41.60 2jhx s ASN 195 CO 0.10 -0.07 -0.03 -0.22 -1.51 0.00 0.00 177.10 175.37 2jhx s LEU 196 N -1.89 1.58 -0.09 0.60 2.96 -0.36 -1.33 118.68 120.15 2jhx s LEU 196 Ca 0.01 -0.07 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 2jhx s LEU 196 Cb -0.09 -0.28 0.01 0.00 0.50 0.00 0.00 46.19 46.33 2jhx s LEU 196 CO 0.03 -0.02 -0.14 -0.89 -1.32 0.00 0.00 176.35 174.00 2jhx s THR 197 N 0.49 1.35 -0.25 3.68 2.01 0.68 -0.45 115.64 123.15 2jhx s THR 197 Ca -0.05 -0.58 -0.11 0.00 0.31 0.00 0.00 61.69 61.26 2jhx s THR 197 Cb -0.09 -1.23 -0.05 0.00 0.01 0.00 0.00 72.50 71.14 2jhx s THR 197 CO -0.01 0.41 0.19 -0.63 -0.69 0.00 0.00 174.62 173.89 2jhx s ILE 198 N 0.81 5.33 0.31 1.82 -1.09 -0.08 -1.37 121.20 126.93 2jhx s ILE 198 Ca -0.11 0.22 0.05 0.00 -2.23 0.00 0.00 60.65 58.58 2jhx s ILE 198 Cb -0.16 -3.53 -0.06 0.00 -1.58 0.00 0.00 42.46 37.13 2jhx s ILE 198 CO 0.02 0.30 -0.00 -0.54 -1.23 0.00 0.00 174.94 173.49 2jhx s LYS 199 N 1.35 1.63 0.31 2.79 1.02 -0.47 -0.99 119.74 125.37 2jhx s LYS 199 Ca 0.08 -1.87 0.10 0.00 0.02 0.00 0.00 55.97 54.30 2jhx s LYS 199 Cb -0.14 -1.07 0.49 0.00 -0.52 0.00 0.00 37.83 36.59 2jhx s LYS 199 CO 0.07 -0.07 1.70 0.87 -0.92 0.00 0.00 175.35 177.01 2jhx h LYS 200 N 2.17 0.08 -4.31 1.68 1.57 -1.96 0.10 116.57 115.90 2jhx h LYS 200 Ca -0.41 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.17 2jhx h LYS 200 Cb 1.24 0.00 -0.15 0.00 0.08 0.00 0.00 32.23 33.40 2jhx h LYS 200 CO 0.70 0.55 -0.61 -0.51 -0.57 0.00 0.00 179.45 179.00 2jhx s ASP 201 N -6.89 0.31 0.00 0.86 -0.00 -1.26 -4.57 116.67 105.12 2jhx s ASP 201 Ca -0.03 -1.11 0.09 0.00 -0.00 0.00 0.00 52.55 51.50 2jhx s ASP 201 Cb 0.13 0.29 0.52 0.00 -0.00 0.00 0.00 42.92 43.86 2jhx s ASP 201 CO 0.76 -0.72 0.97 0.79 -0.00 0.00 0.00 175.17 176.97