#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jhu n MET 66 N 0.00 0.67 -4.62 0.00 0.00 -1.26 -4.66 117.12 107.24 2jhu n MET 66 Ca 0.00 0.22 -0.24 0.00 0.00 0.00 0.00 57.70 57.68 2jhu n MET 66 Cb 0.00 -1.71 -0.16 0.00 0.00 0.00 0.00 33.22 31.35 2jhu n MET 66 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 2jhu s VAL 67 N -2.56 1.16 0.60 2.03 1.01 -1.26 -5.13 120.40 116.25 2jhu s VAL 67 Ca -0.10 -0.53 -0.19 0.00 0.00 0.00 0.00 61.98 61.16 2jhu s VAL 67 Cb 0.07 -1.04 -0.04 0.00 0.00 0.00 0.00 36.38 35.38 2jhu s VAL 67 CO 0.80 0.35 1.15 -2.65 0.00 0.00 0.00 175.10 174.76 2jhu n PRO 68 N 3.54 1.13 -0.35 2.72 -0.02 -1.26 -4.91 135.00 135.86 2jhu n PRO 68 Ca -0.21 0.43 0.02 0.00 -2.02 0.00 0.00 63.50 61.72 2jhu n PRO 68 Cb 0.52 -2.36 0.16 0.00 -0.02 0.00 0.00 33.50 31.80 2jhu n PRO 68 CO 0.00 0.00 0.00 -0.97 1.98 0.00 0.00 175.50 176.51 2jhu h ASN 69 N 0.71 0.97 -3.34 2.55 -1.24 -1.97 -3.39 115.58 109.87 2jhu h ASN 69 Ca -0.50 0.01 -0.65 0.00 0.71 0.00 0.00 56.30 55.87 2jhu h ASN 69 Cb 1.34 -0.20 -0.26 0.00 0.73 0.00 0.00 38.32 39.93 2jhu h ASN 69 CO 0.53 0.62 -0.74 -0.69 -1.29 0.00 0.00 177.43 175.87 2jhu s VAL 70 N -6.05 3.28 -0.21 2.57 1.01 -1.26 -0.09 120.40 119.65 2jhu s VAL 70 Ca -0.13 -0.56 0.00 0.00 0.00 0.00 0.00 61.98 61.30 2jhu s VAL 70 Cb 0.19 -2.43 0.02 0.00 0.00 0.00 0.00 36.38 34.17 2jhu s VAL 70 CO 0.80 0.48 -0.15 -0.69 0.00 0.00 0.00 175.10 175.55 2jhu s VAL 71 N 0.77 2.36 -0.17 2.92 1.01 -0.20 -4.94 120.40 122.15 2jhu s VAL 71 Ca -0.03 -1.00 -0.25 0.00 0.00 0.00 0.00 61.98 60.70 2jhu s VAL 71 Cb -0.15 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 2jhu s VAL 71 CO 0.01 0.39 0.81 -0.69 0.00 0.00 0.00 175.10 175.63 2jhu s VAL 72 N 1.29 4.89 -0.16 2.92 1.01 -1.26 -0.16 120.40 128.93 2jhu s VAL 72 Ca 0.02 1.59 0.16 0.00 0.00 0.00 0.00 61.98 63.75 2jhu s VAL 72 Cb -0.15 -4.12 -0.22 0.00 0.00 0.00 0.00 36.38 31.89 2jhu s VAL 72 CO -0.09 0.03 0.10 0.35 0.00 0.00 0.00 175.10 175.49 2jhu n THR 73 N 4.73 1.06 -3.49 3.92 -2.24 0.04 -4.30 114.28 113.99 2jhu n THR 73 Ca 0.04 -0.70 -0.10 0.00 -2.27 0.00 0.00 64.05 61.02 2jhu n THR 73 Cb 0.49 -0.48 -0.02 0.00 -2.10 0.00 0.00 70.33 68.22 2jhu n THR 73 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 2jhu s GLY 74 N -5.02 -0.52 -0.04 3.38 0.00 -1.14 -1.23 107.32 102.75 2jhu s GLY 74 Ca -0.08 0.55 0.04 0.00 0.00 0.00 0.00 44.72 45.23 2jhu s GLY 74 CO 0.71 0.18 -0.17 -2.27 0.00 0.00 0.00 173.10 171.55 2jhu s LEU 75 N -2.70 1.93 -0.02 0.66 0.20 -0.84 -1.52 118.68 116.39 2jhu s LEU 75 Ca 0.03 -0.34 0.04 0.00 0.69 0.00 0.00 54.13 54.55 2jhu s LEU 75 Cb -0.01 -0.95 -0.01 0.00 -0.43 0.00 0.00 46.19 44.79 2jhu s LEU 75 CO -0.10 0.16 -0.14 -0.89 -0.29 0.00 0.00 176.35 175.09 2jhu s THR 76 N -0.02 1.16 -0.37 3.68 2.01 -0.07 -0.40 115.64 121.63 2jhu s THR 76 Ca -0.02 -0.60 -0.19 0.00 0.31 0.00 0.00 61.69 61.18 2jhu s THR 76 Cb -0.11 -0.98 0.00 0.00 0.01 0.00 0.00 72.50 71.43 2jhu s THR 76 CO 0.02 0.33 0.56 -0.76 -0.69 0.00 0.00 174.62 174.08 2jhu s LEU 77 N -0.18 4.39 -0.38 4.42 1.43 -0.07 -0.68 118.68 127.62 2jhu s LEU 77 Ca 0.02 -0.08 -0.22 0.00 -1.03 0.00 0.00 54.13 52.81 2jhu s LEU 77 Cb -0.07 -2.64 0.01 0.00 0.03 0.00 0.00 46.19 43.52 2jhu s LEU 77 CO 0.00 -0.56 0.75 -0.69 0.23 0.00 0.00 176.35 176.08 2jhu s VAL 78 N 2.51 4.76 -0.24 -1.59 1.01 0.47 -4.57 120.40 122.75 2jhu s VAL 78 Ca 0.20 0.73 -0.02 0.00 0.00 0.00 0.00 61.98 62.89 2jhu s VAL 78 Cb -0.15 -4.20 0.12 0.00 0.00 0.00 0.00 36.38 32.15 2jhu s VAL 78 CO 0.15 -0.45 0.30 0.00 0.00 0.00 0.00 175.10 175.09 2jhu h SER 80 N 8.25 0.88 1.80 0.00 0.02 -1.95 -2.63 113.55 119.93 2jhu h SER 80 Ca -0.16 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.84 2jhu h SER 80 Cb 1.13 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.55 2jhu h SER 80 CO 0.29 0.46 0.00 0.77 -1.14 0.00 0.00 176.83 177.21 2jhu h SER 81 N 0.95 0.00 -3.37 3.07 4.64 -1.96 -3.46 113.55 113.43 2jhu h SER 81 Ca 0.49 0.00 -0.53 0.00 -0.47 0.00 0.00 61.79 61.28 2jhu h SER 81 Cb 0.50 0.00 0.07 0.00 -0.31 0.00 0.00 62.40 62.66 2jhu h SER 81 CO -0.27 0.00 0.82 0.00 -0.87 0.00 0.00 176.83 176.51 2jhu s ALA 82 N -3.30 3.69 -0.75 5.18 0.00 -0.99 -4.91 121.76 120.67 2jhu s ALA 82 Ca 0.06 1.46 0.26 0.00 0.00 0.00 0.00 51.96 53.74 2jhu s ALA 82 Cb 0.06 -3.60 0.89 0.00 0.00 0.00 0.00 23.12 20.47 2jhu s ALA 82 CO 0.64 -0.87 1.79 -0.35 0.00 0.00 0.00 175.76 176.97 2jhu n PRO 83 N 2.21 0.21 -4.28 0.00 -0.04 -1.26 -4.90 135.00 126.94 2jhu n PRO 83 Ca 0.07 0.20 -0.16 0.00 -0.04 0.00 0.00 63.50 63.58 2jhu n PRO 83 Cb 0.39 -1.76 -0.10 0.00 -0.04 0.00 0.00 33.50 31.99 2jhu n PRO 83 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2jhu s GLY 84 N -3.47 1.75 0.66 0.55 0.00 -1.26 -5.15 107.32 100.40 2jhu s GLY 84 Ca 0.10 -1.79 -0.15 0.00 0.00 0.00 0.00 44.72 42.88 2jhu s GLY 84 CO 0.56 -1.52 1.11 2.56 0.00 0.00 0.00 173.10 175.81 2jhu s PRO 85 N -3.99 2.81 -0.46 2.90 0.04 -1.26 -5.01 135.00 130.03 2jhu s PRO 85 Ca 0.38 1.39 0.05 0.00 0.04 0.00 0.00 61.00 62.86 2jhu s PRO 85 Cb 0.06 -1.95 0.20 0.00 0.04 0.00 0.00 34.50 32.85 2jhu s PRO 85 CO 0.15 -1.24 0.44 1.28 0.04 0.00 0.00 177.00 177.67 2jhu n LEU 86 N -2.41 0.50 -4.06 -3.56 4.77 -1.26 -5.10 117.00 105.90 2jhu n LEU 86 Ca 0.10 -4.66 -0.21 0.00 -0.03 0.00 0.00 56.01 51.21 2jhu n LEU 86 Cb 0.52 0.30 -0.15 0.00 -2.33 0.00 0.00 43.42 41.76 2jhu n LEU 86 CO 0.48 1.92 -0.46 -0.70 -1.33 0.00 0.00 177.39 177.30 2jhu s GLU 87 N -0.69 1.08 -0.20 3.23 2.56 -1.26 -0.89 118.70 122.52 2jhu s GLU 87 Ca 0.33 -0.41 -0.06 0.00 0.00 0.00 0.00 54.97 54.83 2jhu s GLU 87 Cb 0.07 -1.01 -0.03 0.00 2.00 0.00 0.00 34.13 35.16 2jhu s GLU 87 CO -0.16 0.20 0.04 -0.51 -0.56 0.00 0.00 175.26 174.28 2jhu s LEU 88 N -0.06 3.54 -0.56 2.70 1.43 0.47 -5.01 118.68 121.19 2jhu s LEU 88 Ca 0.01 -0.07 -0.22 0.00 -1.03 0.00 0.00 54.13 52.81 2jhu s LEU 88 Cb -0.07 -1.90 0.05 0.00 0.03 0.00 0.00 46.19 44.30 2jhu s LEU 88 CO 0.00 0.10 0.84 -0.62 0.23 0.00 0.00 176.35 176.90 2jhu s ASP 89 N 0.80 6.27 0.00 2.29 -1.08 -1.26 -1.99 116.67 121.70 2jhu s ASP 89 Ca 0.02 -0.68 0.30 0.00 -0.52 0.00 0.00 52.55 51.67 2jhu s ASP 89 Cb -0.14 -2.38 1.42 0.00 -1.46 0.00 0.00 42.92 40.36 2jhu s ASP 89 CO 0.02 -1.16 1.96 0.18 0.52 0.00 0.00 175.17 176.70 2jhu n LEU 90 N 7.06 0.43 0.09 -1.34 4.77 -0.37 -2.55 117.00 125.10 2jhu n LEU 90 Ca -0.02 -0.03 0.12 0.00 -0.03 0.00 0.00 56.01 56.05 2jhu n LEU 90 Cb 0.46 -0.12 0.23 0.00 -2.33 0.00 0.00 43.42 41.65 2jhu n LEU 90 CO 0.61 0.08 0.53 0.71 -1.33 0.00 0.00 177.39 177.98 2jhu h THR 91 N 0.59 0.00 -0.59 -5.08 1.35 -1.74 -3.46 112.91 103.97 2jhu h THR 91 Ca 0.00 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 2jhu h THR 91 Cb 0.27 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.02 2jhu h THR 91 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2jhu n GLY 92 N 1.29 0.63 3.61 5.82 0.00 -1.06 -5.01 105.19 110.49 2jhu n GLY 92 Ca 0.04 -1.61 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 2jhu n GLY 92 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2jhu s ASP 93 N -1.00 6.62 0.35 1.61 -1.08 -1.26 -4.93 116.67 116.97 2jhu s ASP 93 Ca 0.00 0.64 0.18 0.00 -0.52 0.00 0.00 52.55 52.85 2jhu s ASP 93 Cb 0.00 -2.38 0.49 0.00 -1.46 0.00 0.00 42.92 39.57 2jhu s ASP 93 CO 0.00 -0.52 1.64 -0.07 0.52 0.00 0.00 175.17 176.73 2jhu h LEU 94 N 9.25 0.00 -1.95 -1.34 3.38 -1.91 -3.19 115.31 119.56 2jhu h LEU 94 Ca -0.25 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 2jhu h LEU 94 Cb 1.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 2jhu h LEU 94 CO 0.84 0.40 -0.09 -0.33 0.09 0.00 0.00 178.44 179.35 2jhu h GLU 95 N 0.00 0.00 -0.79 1.13 4.39 -1.96 -2.46 114.58 114.90 2jhu h GLU 95 Ca -0.00 0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.79 2jhu h GLU 95 Cb 1.06 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.64 2jhu h GLU 95 CO 0.05 0.09 0.43 0.77 -1.16 0.00 0.00 179.01 179.20 2jhu h SER 96 N 0.00 0.60 -0.11 1.42 0.02 -1.97 -2.70 113.55 110.81 2jhu h SER 96 Ca -0.00 0.05 0.03 0.00 -0.84 0.00 0.00 61.79 61.03 2jhu h SER 96 Cb 0.19 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 62.67 2jhu h SER 96 CO 0.01 0.34 0.11 -0.26 -1.14 0.00 0.00 176.83 175.89 2jhu h PHE 97 N 0.72 0.00 -0.16 3.45 0.04 -1.66 -2.87 116.94 116.46 2jhu h PHE 97 Ca 0.38 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.13 2jhu h PHE 97 Cb 0.37 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.51 2jhu h PHE 97 CO -0.08 0.00 -0.01 0.87 -0.60 0.00 0.00 178.31 178.49 2jhu h LYS 98 N 0.00 0.23 -0.00 1.51 1.57 -1.65 -2.36 116.57 115.88 2jhu h LYS 98 Ca 0.05 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2jhu h LYS 98 Cb 0.27 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.54 2jhu h LYS 98 CO -0.00 0.27 -0.52 0.36 -0.57 0.00 0.00 179.45 178.99 2jhu n LYS 99 N -4.39 0.05 -3.32 3.15 2.85 -1.08 -4.94 118.16 110.49 2jhu n LYS 99 Ca -0.01 -0.03 -0.19 0.00 -1.05 0.00 0.00 58.31 57.03 2jhu n LYS 99 Cb 0.18 -1.50 -0.01 0.00 -0.65 0.00 0.00 35.03 33.05 2jhu n LYS 99 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 2jhu s GLN 100 N -2.97 2.73 -0.01 -1.58 -0.21 -0.89 -5.14 119.66 111.59 2jhu s GLN 100 Ca 0.12 -1.34 -0.11 0.00 0.02 0.00 0.00 55.36 54.04 2jhu s GLN 100 Cb 0.18 -2.59 0.01 0.00 1.00 0.00 0.00 33.01 31.60 2jhu s GLN 100 CO 0.70 -0.19 0.23 0.45 -2.12 0.00 0.00 175.29 174.36 2jhu s SER 101 N -4.22 -0.09 -0.09 5.90 0.15 -1.26 -4.16 113.70 109.92 2jhu s SER 101 Ca 0.50 -0.04 -0.16 0.00 0.70 0.00 0.00 55.95 56.96 2jhu s SER 101 Cb -0.07 0.27 -0.05 0.00 -1.71 0.00 0.00 66.02 64.46 2jhu s SER 101 CO 0.30 -0.40 0.41 -0.36 1.20 0.00 0.00 173.24 174.40 2jhu s PHE 102 N -1.32 3.56 -0.14 3.44 0.08 -0.60 -4.96 117.98 118.04 2jhu s PHE 102 Ca -0.14 0.85 -0.13 0.00 0.12 0.00 0.00 56.93 57.64 2jhu s PHE 102 Cb -0.06 -2.43 -0.05 0.00 -0.57 0.00 0.00 43.02 39.91 2jhu s PHE 102 CO 0.03 0.32 0.27 0.08 -0.10 0.00 0.00 175.22 175.82 2jhu s VAL 103 N 0.10 5.31 -0.02 -0.44 1.01 -1.26 -0.73 120.40 124.37 2jhu s VAL 103 Ca 0.23 0.50 0.08 0.00 0.00 0.00 0.00 61.98 62.79 2jhu s VAL 103 Cb -0.15 -3.60 -0.02 0.00 0.00 0.00 0.00 36.38 32.61 2jhu s VAL 103 CO 0.10 0.44 -0.25 -0.76 0.00 0.00 0.00 175.10 174.62 2jhu s LEU 104 N 0.13 2.08 0.18 3.92 1.43 -0.22 -4.96 118.68 121.25 2jhu s LEU 104 Ca 0.16 -0.46 -0.30 0.00 -1.03 0.00 0.00 54.13 52.50 2jhu s LEU 104 Cb -0.13 -1.35 -0.08 0.00 0.03 0.00 0.00 46.19 44.66 2jhu s LEU 104 CO 0.04 0.32 1.25 -0.75 0.23 0.00 0.00 176.35 177.44 2jhu s LYS 105 N -0.58 4.43 0.30 1.70 2.20 -1.26 -1.47 119.74 125.06 2jhu s LYS 105 Ca 0.09 1.95 -0.28 0.00 -0.36 0.00 0.00 55.97 57.37 2jhu s LYS 105 Cb -0.10 -3.23 -0.14 0.00 -1.51 0.00 0.00 37.83 32.85 2jhu s LYS 105 CO -0.01 -0.19 1.05 -0.85 -0.36 0.00 0.00 175.35 175.00 2jhu n GLU 106 N 2.75 1.48 0.00 4.03 0.28 0.29 -2.44 120.64 127.03 2jhu n GLU 106 Ca 0.06 0.52 0.00 0.00 -0.16 0.00 0.00 57.16 57.58 2jhu n GLU 106 Cb 0.44 -1.92 0.00 0.00 1.43 0.00 0.00 31.44 31.39 2jhu n GLU 106 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2jhu n GLY 107 N 1.15 2.25 3.80 -1.84 0.00 -0.17 -4.93 105.19 105.44 2jhu n GLY 107 Ca 0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2jhu n GLY 107 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2jhu s VAL 108 N -2.30 3.91 0.28 1.61 -7.23 -1.02 -4.48 120.40 111.17 2jhu s VAL 108 Ca 0.00 1.16 -0.16 0.00 -1.81 0.00 0.00 61.98 61.17 2jhu s VAL 108 Cb 0.00 -3.48 -0.09 0.00 0.56 0.00 0.00 36.38 33.38 2jhu s VAL 108 CO 0.00 -0.29 0.71 -1.61 -0.31 0.00 0.00 175.10 173.60 2jhu s GLU 109 N -3.32 4.05 0.12 4.82 2.02 -1.26 -0.35 118.70 124.77 2jhu s GLU 109 Ca 0.66 0.68 -0.19 0.00 0.02 0.00 0.00 54.97 56.13 2jhu s GLU 109 Cb -0.15 -2.58 0.05 0.00 0.10 0.00 0.00 34.13 31.54 2jhu s GLU 109 CO 0.20 0.24 0.48 1.52 0.02 0.00 0.00 175.26 177.73 2jhu s TYR 110 N -1.83 -0.34 0.27 1.61 1.13 0.34 -4.53 117.35 114.00 2jhu s TYR 110 Ca 0.50 0.13 0.08 0.00 -1.41 0.00 0.00 57.07 56.37 2jhu s TYR 110 Cb -0.12 0.36 -0.05 0.00 -1.10 0.00 0.00 41.96 41.04 2jhu s TYR 110 CO 0.19 -0.73 -0.11 1.03 -2.51 0.00 0.00 175.55 173.42 2jhu s ARG 111 N -3.50 1.55 -0.14 -3.49 0.52 -0.50 -0.94 118.95 112.45 2jhu s ARG 111 Ca 0.01 -1.75 -0.03 0.00 -0.52 0.00 0.00 55.73 53.43 2jhu s ARG 111 Cb 0.01 -1.32 -0.03 0.00 0.52 0.00 0.00 34.95 34.13 2jhu s ARG 111 CO -0.10 0.14 -0.04 0.42 0.02 0.00 0.00 175.30 175.74 2jhu s ILE 112 N -2.87 3.89 -0.13 1.52 1.01 -1.26 -0.39 121.20 122.96 2jhu s ILE 112 Ca 0.28 -0.37 0.01 0.00 0.00 0.00 0.00 60.65 60.57 2jhu s ILE 112 Cb 0.01 -2.68 -0.01 0.00 0.01 0.00 0.00 42.46 39.79 2jhu s ILE 112 CO 0.12 0.52 -0.15 -0.75 0.00 0.00 0.00 174.94 174.67 2jhu s LYS 113 N 0.11 3.27 -0.16 2.79 2.20 0.15 -0.97 119.74 127.13 2jhu s LYS 113 Ca -0.01 -0.74 -0.02 0.00 -0.36 0.00 0.00 55.97 54.84 2jhu s LYS 113 Cb -0.14 -2.58 -0.02 0.00 -1.51 0.00 0.00 37.83 33.59 2jhu s LYS 113 CO 0.03 0.13 -0.08 0.42 -0.36 0.00 0.00 175.35 175.49 2jhu s ILE 114 N 0.53 3.40 -0.05 5.43 -1.09 0.29 -0.90 121.20 128.81 2jhu s ILE 114 Ca -0.10 -0.52 -0.01 0.00 -2.23 0.00 0.00 60.65 57.79 2jhu s ILE 114 Cb -0.16 -2.48 -0.03 0.00 -1.58 0.00 0.00 42.46 38.20 2jhu s ILE 114 CO 0.04 0.49 0.01 -0.44 -1.23 0.00 0.00 174.94 173.81 2jhu s SER 115 N 0.68 5.25 -0.13 3.58 0.01 -0.58 -0.85 113.70 121.66 2jhu s SER 115 Ca -0.04 0.10 -0.28 0.00 1.31 0.00 0.00 55.95 57.03 2jhu s SER 115 Cb -0.15 -1.45 0.07 0.00 0.21 0.00 0.00 66.02 64.70 2jhu s SER 115 CO 0.02 0.34 0.69 0.72 0.41 0.00 0.00 173.24 175.41 2jhu s PHE 116 N -0.98 -0.70 -0.08 2.43 -0.71 -0.59 -0.78 117.98 116.57 2jhu s PHE 116 Ca 0.16 1.41 -0.01 0.00 -1.04 0.00 0.00 56.93 57.45 2jhu s PHE 116 Cb -0.11 0.35 -0.03 0.00 -1.21 0.00 0.00 43.02 42.02 2jhu s PHE 116 CO 0.06 -0.52 -0.02 1.03 -1.34 0.00 0.00 175.22 174.44 2jhu s ARG 117 N -0.61 2.92 -0.20 1.99 0.52 0.77 -0.01 118.95 124.34 2jhu s ARG 117 Ca -0.07 -0.44 -0.03 0.00 -0.52 0.00 0.00 55.73 54.67 2jhu s ARG 117 Cb -0.02 -2.74 -0.01 0.00 0.52 0.00 0.00 34.95 32.70 2jhu s ARG 117 CO 0.07 0.69 -0.05 0.08 0.02 0.00 0.00 175.30 176.10 2jhu s VAL 118 N -0.86 3.40 -0.24 3.52 1.01 -1.26 -1.04 120.40 124.93 2jhu s VAL 118 Ca 0.13 -0.50 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 2jhu s VAL 118 Cb -0.11 -2.52 -0.18 0.00 0.00 0.00 0.00 36.38 33.56 2jhu s VAL 118 CO 0.02 0.45 -0.15 0.59 0.00 0.00 0.00 175.10 176.01 2jhu n ASN 119 N 4.43 2.00 0.00 3.32 3.02 0.87 -1.86 115.26 127.04 2jhu n ASN 119 Ca -0.18 -0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.31 2jhu n ASN 119 Cb 0.51 -0.50 0.00 0.00 -0.61 0.00 0.00 39.78 39.18 2jhu n ASN 119 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2jhu n ARG 120 N -3.35 0.11 -4.10 3.52 1.74 -1.26 -4.71 116.66 108.61 2jhu n ARG 120 Ca -0.44 0.00 -0.14 0.00 -0.77 0.00 0.00 57.85 56.50 2jhu n ARG 120 Cb 0.99 -0.70 -0.11 0.00 -1.02 0.00 0.00 32.46 31.62 2jhu n ARG 120 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2jhu s GLU 121 N -1.40 0.63 0.57 5.56 2.02 -1.26 -4.78 118.70 120.04 2jhu s GLU 121 Ca 0.00 -0.88 -0.19 0.00 0.02 0.00 0.00 54.97 53.92 2jhu s GLU 121 Cb 0.00 -0.39 -0.05 0.00 0.10 0.00 0.00 34.13 33.80 2jhu s GLU 121 CO 0.00 0.07 1.16 0.42 0.02 0.00 0.00 175.26 176.93 2jhu s ILE 122 N -1.67 2.95 0.10 -1.63 1.01 -1.26 -4.46 121.20 116.24 2jhu s ILE 122 Ca -0.05 0.59 0.07 0.00 0.00 0.00 0.00 60.65 61.26 2jhu s ILE 122 Cb -0.08 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.13 2jhu s ILE 122 CO 0.00 -0.13 -0.19 -0.69 0.00 0.00 0.00 174.94 173.93 2jhu s VAL 123 N -1.71 1.56 0.05 2.92 1.01 0.05 -5.01 120.40 119.28 2jhu s VAL 123 Ca 0.75 -1.51 0.03 0.00 0.00 0.00 0.00 61.98 61.25 2jhu s VAL 123 Cb -0.26 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 2jhu s VAL 123 CO 0.30 -0.12 -0.10 -0.94 0.00 0.00 0.00 175.10 174.23 2jhu s SER 124 N -1.92 1.18 -1.18 3.32 1.04 -1.26 -1.68 113.70 113.19 2jhu s SER 124 Ca 0.05 -0.58 -0.00 0.00 0.48 0.00 0.00 55.95 55.90 2jhu s SER 124 Cb -0.10 0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.03 2jhu s SER 124 CO 0.04 -0.16 0.04 0.61 0.98 0.00 0.00 173.24 174.76 2jhu n GLY 125 N 1.38 -0.20 3.62 7.32 0.00 -1.14 -1.77 105.19 114.39 2jhu n GLY 125 Ca -0.22 -0.29 -0.46 0.00 0.00 0.00 0.00 46.02 45.06 2jhu n GLY 125 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2jhu n MET 126 N -2.41 1.54 -3.76 1.61 2.81 -0.01 -3.28 117.12 113.62 2jhu n MET 126 Ca -0.16 0.54 -0.13 0.00 -1.81 0.00 0.00 57.70 56.15 2jhu n MET 126 Cb 0.62 -2.04 -0.14 0.00 -0.71 0.00 0.00 33.22 30.95 2jhu n MET 126 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 2jhu s LYS 127 N -0.93 0.14 -0.18 0.03 2.20 -0.01 -0.33 119.74 120.66 2jhu s LYS 127 Ca 0.65 0.38 -0.05 0.00 -0.36 0.00 0.00 55.97 56.59 2jhu s LYS 127 Cb -0.72 -0.10 -0.03 0.00 -1.51 0.00 0.00 37.83 35.47 2jhu s LYS 127 CO 0.55 -0.13 -0.00 -0.47 -0.36 0.00 0.00 175.35 174.94 2jhu s TYR 128 N 0.93 3.07 -0.07 4.03 5.04 -0.22 -0.99 117.35 129.14 2jhu s TYR 128 Ca -0.07 -0.29 0.05 0.00 -2.44 0.00 0.00 57.07 54.31 2jhu s TYR 128 Cb -0.09 -2.04 -0.00 0.00 0.35 0.00 0.00 41.96 40.18 2jhu s TYR 128 CO -0.05 -0.09 -0.23 0.42 -1.34 0.00 0.00 175.55 174.26 2jhu s ILE 129 N 0.65 1.94 -0.11 3.14 1.01 0.08 -0.29 121.20 127.61 2jhu s ILE 129 Ca -0.00 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.68 2jhu s ILE 129 Cb -0.14 -1.66 0.02 0.00 0.01 0.00 0.00 42.46 40.68 2jhu s ILE 129 CO 0.02 0.54 -0.14 -1.10 0.00 0.00 0.00 174.94 174.25 2jhu s GLN 130 N 0.13 2.16 -0.20 2.79 -0.21 -0.02 -0.86 119.66 123.44 2jhu s GLN 130 Ca -0.11 -0.53 -0.06 0.00 0.02 0.00 0.00 55.36 54.68 2jhu s GLN 130 Cb -0.15 -1.88 -0.03 0.00 1.00 0.00 0.00 33.01 31.94 2jhu s GLN 130 CO 0.06 -0.11 0.03 -1.01 -2.12 0.00 0.00 175.29 172.14 2jhu s HIS 131 N 1.12 3.11 -0.09 0.91 3.76 0.30 -1.27 115.29 123.13 2jhu s HIS 131 Ca -0.04 -0.24 -0.01 0.00 -0.15 0.00 0.00 55.06 54.62 2jhu s HIS 131 Cb -0.14 -2.09 -0.03 0.00 1.11 0.00 0.00 32.58 31.42 2jhu s HIS 131 CO -0.03 -0.10 -0.05 0.99 -0.85 0.00 0.00 174.74 174.70 2jhu s THR 132 N 0.82 3.88 0.10 1.30 2.01 0.06 -0.59 115.64 123.22 2jhu s THR 132 Ca 0.02 -0.40 0.08 0.00 0.31 0.00 0.00 61.69 61.69 2jhu s THR 132 Cb -0.14 -2.62 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 2jhu s THR 132 CO 0.02 0.58 -0.20 -0.31 -0.69 0.00 0.00 174.62 174.03 2jhu s TYR 133 N -0.59 1.68 -0.06 4.92 1.51 0.95 -0.06 117.35 125.70 2jhu s TYR 133 Ca 0.09 -0.43 0.03 0.00 -1.01 0.00 0.00 57.07 55.75 2jhu s TYR 133 Cb -0.12 -0.92 0.01 0.00 -0.11 0.00 0.00 41.96 40.82 2jhu s TYR 133 CO 0.02 0.18 -0.14 1.03 -1.11 0.00 0.00 175.55 175.52 2jhu s ARG 134 N -1.90 1.79 -1.60 -0.62 0.52 -0.15 -1.03 118.95 115.95 2jhu s ARG 134 Ca 0.05 -0.50 -0.10 0.00 -0.52 0.00 0.00 55.73 54.66 2jhu s ARG 134 Cb -0.10 -1.49 0.09 0.00 0.52 0.00 0.00 34.95 33.97 2jhu s ARG 134 CO 0.04 0.11 0.48 1.63 0.02 0.00 0.00 175.30 177.58 2jhu n LYS 135 N 3.54 -2.42 -0.99 3.54 4.76 -1.26 -1.26 118.16 124.08 2jhu n LYS 135 Ca -0.21 0.29 0.00 0.00 -2.87 0.00 0.00 58.31 55.53 2jhu n LYS 135 Cb 0.52 -4.55 0.00 0.00 -1.84 0.00 0.00 35.03 29.16 2jhu n LYS 135 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2jhu n GLY 136 N -1.79 0.75 3.38 0.72 0.00 -1.26 -5.01 105.19 101.98 2jhu n GLY 136 Ca -0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.57 2jhu n GLY 136 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jhu s VAL 137 N -3.04 3.10 -0.01 1.61 1.01 -0.39 -5.09 120.40 117.59 2jhu s VAL 137 Ca 0.00 -0.65 -0.30 0.00 0.00 0.00 0.00 61.98 61.03 2jhu s VAL 137 Cb 0.00 -2.30 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 2jhu s VAL 137 CO 0.00 0.53 1.42 -0.75 0.00 0.00 0.00 175.10 176.30 2jhu s LYS 138 N 0.31 4.27 -0.01 2.72 2.20 -1.26 -0.97 119.74 126.99 2jhu s LYS 138 Ca -0.10 1.98 0.10 0.00 -0.36 0.00 0.00 55.97 57.59 2jhu s LYS 138 Cb -0.16 -3.62 -0.13 0.00 -1.51 0.00 0.00 37.83 32.42 2jhu s LYS 138 CO 0.05 -0.61 0.31 0.44 -0.36 0.00 0.00 175.35 175.18 2jhu n ILE 139 N 4.77 0.00 -3.64 5.43 -5.35 0.91 -4.94 119.36 116.54 2jhu n ILE 139 Ca 0.14 -0.25 -0.15 0.00 -0.27 0.00 0.00 62.75 62.22 2jhu n ILE 139 Cb 0.44 0.63 -0.08 0.00 -1.74 0.00 0.00 39.64 38.89 2jhu n ILE 139 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 2jhu s ASP 140 N -2.53 -0.54 -0.09 7.28 -1.08 -1.01 -4.98 116.67 113.72 2jhu s ASP 140 Ca -0.00 0.81 0.01 0.00 -0.52 0.00 0.00 52.55 52.85 2jhu s ASP 140 Cb 0.07 0.80 0.02 0.00 -1.46 0.00 0.00 42.92 42.35 2jhu s ASP 140 CO 0.40 -0.39 -0.11 -0.75 0.52 0.00 0.00 175.17 174.84 2jhu s LYS 141 N -0.51 1.77 -0.03 4.34 2.20 -1.26 -0.76 119.74 125.48 2jhu s LYS 141 Ca -0.06 -0.40 0.01 0.00 -0.36 0.00 0.00 55.97 55.16 2jhu s LYS 141 Cb -0.03 -1.58 0.02 0.00 -1.51 0.00 0.00 37.83 34.73 2jhu s LYS 141 CO 0.05 -0.10 -0.03 0.99 -0.36 0.00 0.00 175.35 175.90 2jhu s THR 142 N 1.10 0.41 -0.01 3.43 2.01 -0.39 -5.01 115.64 117.17 2jhu s THR 142 Ca -0.06 -0.07 -0.00 0.00 0.31 0.00 0.00 61.69 61.87 2jhu s THR 142 Cb -0.14 -0.45 -0.04 0.00 0.01 0.00 0.00 72.50 71.88 2jhu s THR 142 CO -0.02 0.19 0.05 -1.81 -0.69 0.00 0.00 174.62 172.34 2jhu s ASP 143 N 0.80 5.47 -0.09 3.53 -0.00 -1.26 -0.84 116.67 124.28 2jhu s ASP 143 Ca -0.10 0.10 0.02 0.00 -0.00 0.00 0.00 52.55 52.57 2jhu s ASP 143 Cb -0.13 -1.53 0.02 0.00 -0.00 0.00 0.00 42.92 41.28 2jhu s ASP 143 CO -0.00 0.29 -0.12 -0.31 -0.00 0.00 0.00 175.17 175.02 2jhu s TYR 144 N -1.13 1.65 -0.10 4.23 2.02 0.60 -4.99 117.35 119.62 2jhu s TYR 144 Ca 0.21 -0.72 -0.29 0.00 -0.37 0.00 0.00 57.07 55.90 2jhu s TYR 144 Cb -0.12 -1.23 -0.01 0.00 -0.40 0.00 0.00 41.96 40.20 2jhu s TYR 144 CO 0.12 -0.40 0.98 1.41 -1.57 0.00 0.00 175.55 176.08 2jhu s MET 145 N 0.99 4.42 -0.21 -0.62 1.75 -1.26 -1.06 119.30 123.31 2jhu s MET 145 Ca -0.08 1.34 0.04 0.00 -1.25 0.00 0.00 55.69 55.74 2jhu s MET 145 Cb -0.15 -3.54 -0.15 0.00 2.84 0.00 0.00 34.83 33.83 2jhu s MET 145 CO -0.01 -0.29 -0.15 0.28 -0.65 0.00 0.00 175.02 174.21 2jhu n VAL 146 N 4.50 1.24 0.00 10.11 0.31 0.55 -4.95 118.33 130.09 2jhu n VAL 146 Ca 0.08 -0.52 0.00 0.00 -0.01 0.00 0.00 64.34 63.88 2jhu n VAL 146 Cb 0.49 -1.14 0.00 0.00 -0.91 0.00 0.00 33.84 32.28 2jhu n VAL 146 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jhu n GLY 147 N 2.37 0.51 3.61 2.92 0.00 -0.96 -4.92 105.19 108.71 2jhu n GLY 147 Ca -0.37 -2.28 -0.34 0.00 0.00 0.00 0.00 46.02 43.04 2jhu n GLY 147 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jhu s SER 148 N -4.00 4.78 0.01 1.61 0.01 -1.26 -0.83 113.70 114.02 2jhu s SER 148 Ca 0.00 0.00 0.00 0.00 1.31 0.00 0.00 55.95 57.27 2jhu s SER 148 Cb 0.00 -1.23 -0.01 0.00 0.21 0.00 0.00 66.02 64.99 2jhu s SER 148 CO 0.00 0.36 -0.02 -0.31 0.41 0.00 0.00 173.24 173.68 2jhu s TYR 149 N -0.85 0.20 0.40 2.43 2.02 -0.67 -5.00 117.35 115.87 2jhu s TYR 149 Ca 0.13 -0.26 0.08 0.00 -0.37 0.00 0.00 57.07 56.64 2jhu s TYR 149 Cb -0.11 -0.13 -0.02 0.00 -0.40 0.00 0.00 41.96 41.30 2jhu s TYR 149 CO 0.02 -0.09 0.39 0.20 -1.57 0.00 0.00 175.55 174.51 2jhu s GLY 150 N -0.74 2.00 0.25 0.71 0.00 -1.26 -0.77 107.32 107.53 2jhu s GLY 150 Ca -0.07 -1.78 -0.30 0.00 0.00 0.00 0.00 44.72 42.57 2jhu s GLY 150 CO -0.00 -1.62 1.19 2.56 0.00 0.00 0.00 173.10 175.22 2jhu s PRO 151 N -4.14 4.51 0.23 2.90 0.04 -1.26 -4.76 135.00 132.53 2jhu s PRO 151 Ca 0.47 1.93 -0.18 0.00 0.04 0.00 0.00 61.00 63.27 2jhu s PRO 151 Cb -0.05 -3.18 0.02 0.00 0.04 0.00 0.00 34.50 31.33 2jhu s PRO 151 CO 0.29 -0.00 0.58 -0.98 0.04 0.00 0.00 177.00 176.92 2jhu s ARG 152 N -1.03 1.55 0.09 4.56 1.70 -0.78 -4.99 118.95 120.05 2jhu s ARG 152 Ca 0.49 -0.98 -0.18 0.00 -0.47 0.00 0.00 55.73 54.59 2jhu s ARG 152 Cb -0.34 0.54 -0.07 0.00 -0.57 0.00 0.00 34.95 34.51 2jhu s ARG 152 CO 0.42 -0.67 1.55 0.00 -1.08 0.00 0.00 175.30 175.52 2jhu h ALA 153 N 2.14 0.37 -2.64 7.88 0.00 -1.95 -3.41 119.26 121.65 2jhu h ALA 153 Ca -0.25 -0.21 -0.52 0.00 0.00 0.00 0.00 54.91 53.93 2jhu h ALA 153 Cb 1.26 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.92 2jhu h ALA 153 CO 0.32 0.08 0.28 0.00 0.00 0.00 0.00 179.25 179.93 2jhu s ALA 154 N -5.09 3.32 0.50 0.00 0.00 -1.26 -4.99 121.76 114.24 2jhu s ALA 154 Ca -0.13 0.46 -0.21 0.00 0.00 0.00 0.00 51.96 52.08 2jhu s ALA 154 Cb 0.08 -3.14 -0.08 0.00 0.00 0.00 0.00 23.12 19.97 2jhu s ALA 154 CO 0.75 0.07 0.91 0.00 0.00 0.00 0.00 175.76 177.48 2jhu n ALA 155 N 2.50 -0.07 -2.61 0.00 0.00 -1.26 -4.82 120.51 114.25 2jhu n ALA 155 Ca -0.01 0.11 -0.26 0.00 0.00 0.00 0.00 53.44 53.28 2jhu n ALA 155 Cb 0.49 -2.04 -0.02 0.00 0.00 0.00 0.00 19.45 17.88 2jhu n ALA 155 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2jhu s TYR 156 N -1.43 3.49 -0.02 0.00 2.02 0.99 -4.91 117.35 117.48 2jhu s TYR 156 Ca 0.68 0.47 0.04 0.00 -0.37 0.00 0.00 57.07 57.89 2jhu s TYR 156 Cb -0.49 -1.98 -0.01 0.00 -0.40 0.00 0.00 41.96 39.08 2jhu s TYR 156 CO 0.53 0.17 -0.14 -1.21 -1.57 0.00 0.00 175.55 173.33 2jhu s GLU 157 N -3.88 1.26 -0.09 -0.62 2.02 -1.26 -1.54 118.70 114.60 2jhu s GLU 157 Ca 0.41 -0.49 0.04 0.00 0.02 0.00 0.00 54.97 54.96 2jhu s GLU 157 Cb -0.10 -1.18 -0.00 0.00 0.10 0.00 0.00 34.13 32.95 2jhu s GLU 157 CO 0.33 0.25 -0.23 0.12 0.02 0.00 0.00 175.26 175.75 2jhu s PHE 158 N -0.13 2.46 -0.10 1.61 5.36 -0.03 -4.98 117.98 122.17 2jhu s PHE 158 Ca 0.01 -0.95 0.01 0.00 -0.96 0.00 0.00 56.93 55.05 2jhu s PHE 158 Cb -0.08 -1.64 -0.02 0.00 -0.34 0.00 0.00 43.02 40.95 2jhu s PHE 158 CO 0.00 -0.37 -0.15 -0.51 -1.46 0.00 0.00 175.22 172.74 2jhu s LEU 159 N 0.26 2.65 0.85 6.12 2.01 -1.26 -0.55 118.68 128.77 2jhu s LEU 159 Ca -0.16 -0.32 -0.11 0.00 0.01 0.00 0.00 54.13 53.55 2jhu s LEU 159 Cb -0.17 -1.57 0.10 0.00 0.01 0.00 0.00 46.19 44.56 2jhu s LEU 159 CO 0.08 0.21 1.09 0.42 1.01 0.00 0.00 176.35 179.16 2jhu s THR 160 N 0.06 2.82 0.86 5.49 -4.23 -0.14 -4.98 115.64 115.52 2jhu s THR 160 Ca -0.06 0.27 -0.12 0.00 -1.18 0.00 0.00 61.69 60.60 2jhu s THR 160 Cb -0.15 -2.86 0.10 0.00 1.34 0.00 0.00 72.50 70.94 2jhu s THR 160 CO 0.05 -0.35 1.08 -2.65 -0.54 0.00 0.00 174.62 172.21 2jhu n PRO 161 N -3.70 -0.11 -1.93 3.99 -0.02 -1.26 -4.55 135.00 127.42 2jhu n PRO 161 Ca 0.07 0.04 -0.42 0.00 -2.02 0.00 0.00 63.50 61.17 2jhu n PRO 161 Cb 0.56 -2.34 -0.02 0.00 -0.02 0.00 0.00 33.50 31.68 2jhu n PRO 161 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2jhu s VAL 162 N -2.34 2.51 0.36 -1.45 1.01 -1.26 -4.66 120.40 114.56 2jhu s VAL 162 Ca 0.69 0.40 0.04 0.00 0.00 0.00 0.00 61.98 63.11 2jhu s VAL 162 Cb -0.26 -3.26 -0.06 0.00 0.00 0.00 0.00 36.38 32.80 2jhu s VAL 162 CO 0.55 0.05 0.06 -1.83 0.00 0.00 0.00 175.10 173.93 2jhu s GLU 163 N 0.28 1.75 -0.05 2.72 1.03 -0.12 -4.96 118.70 119.35 2jhu s GLU 163 Ca 0.65 -2.00 0.04 0.00 0.03 0.00 0.00 54.97 53.70 2jhu s GLU 163 Cb -0.44 -0.97 -0.02 0.00 -0.80 0.00 0.00 34.13 31.89 2jhu s GLU 163 CO 0.39 -0.21 -0.18 -1.21 -1.33 0.00 0.00 175.26 172.72 2jhu s GLU 164 N -3.85 2.54 0.37 -4.83 2.02 -1.26 -0.50 118.70 113.19 2jhu s GLU 164 Ca 0.33 -0.77 -0.27 0.00 0.02 0.00 0.00 54.97 54.28 2jhu s GLU 164 Cb 0.08 -2.32 -0.10 0.00 0.10 0.00 0.00 34.13 31.90 2jhu s GLU 164 CO 0.15 0.53 1.32 0.00 0.02 0.00 0.00 175.26 177.28 2jhu s ALA 165 N -0.51 3.39 0.83 5.21 0.00 0.52 -4.92 121.76 126.29 2jhu s ALA 165 Ca 0.07 1.27 -0.11 0.00 0.00 0.00 0.00 51.96 53.18 2jhu s ALA 165 Cb -0.12 -3.49 0.09 0.00 0.00 0.00 0.00 23.12 19.60 2jhu s ALA 165 CO 0.01 -0.75 1.09 -1.25 0.00 0.00 0.00 175.76 174.86 2jhu s PRO 166 N -2.02 1.80 0.26 0.00 0.04 -1.26 -1.00 135.00 132.81 2jhu s PRO 166 Ca 0.53 0.75 0.11 0.00 0.04 0.00 0.00 61.00 62.43 2jhu s PRO 166 Cb -0.39 -1.88 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 2jhu s PRO 166 CO 0.52 -1.85 -0.20 0.15 0.04 0.00 0.00 177.00 175.66 2jhu s LYS 167 N -5.05 1.60 0.00 4.56 1.02 -1.26 -3.26 119.74 117.35 2jhu s LYS 167 Ca 0.62 -1.71 0.00 0.00 0.02 0.00 0.00 55.97 54.90 2jhu s LYS 167 Cb -0.16 -1.68 0.00 0.00 -0.52 0.00 0.00 37.83 35.47 2jhu s LYS 167 CO 0.55 0.32 0.00 0.41 -0.92 0.00 0.00 175.35 175.71 2jhu n GLY 168 N -0.47 2.09 0.21 -3.33 0.00 -1.26 -4.47 105.19 97.97 2jhu n GLY 168 Ca -0.06 -1.95 -0.02 0.00 0.00 0.00 0.00 46.02 43.99 2jhu n GLY 168 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2jhu h MET 169 N 0.00 0.36 -0.33 1.61 4.05 -1.99 -1.14 114.93 117.49 2jhu h MET 169 Ca 0.00 -0.02 -0.01 0.00 -0.28 0.00 0.00 59.70 59.38 2jhu h MET 169 Cb 0.00 -0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 30.70 2jhu h MET 169 CO 0.00 0.24 0.15 -0.07 0.23 0.00 0.00 176.91 177.47 2jhu h LEU 170 N 0.38 0.44 0.00 3.39 4.07 -2.03 -3.19 115.31 118.36 2jhu h LEU 170 Ca 0.26 -0.13 -0.04 0.00 0.08 0.00 0.00 57.88 58.05 2jhu h LEU 170 Cb 0.29 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 41.92 2jhu h LEU 170 CO -0.27 0.45 -0.24 0.00 -1.08 0.00 0.00 178.44 177.30 2jhu h ALA 171 N 1.01 0.86 -2.51 1.53 0.00 -1.73 -3.45 119.26 114.98 2jhu h ALA 171 Ca 0.11 -0.17 -0.53 0.00 0.00 0.00 0.00 54.91 54.33 2jhu h ALA 171 Cb 0.13 -0.02 0.17 0.00 0.00 0.00 0.00 17.79 18.07 2jhu h ALA 171 CO -0.01 0.22 0.33 1.03 0.00 0.00 0.00 179.25 180.82 2jhu s ARG 172 N -3.13 1.74 0.00 0.00 0.52 -0.45 -4.79 118.95 112.83 2jhu s ARG 172 Ca 0.05 1.63 0.00 0.00 -0.52 0.00 0.00 55.73 56.90 2jhu s ARG 172 Cb 0.06 -1.80 0.00 0.00 0.52 0.00 0.00 34.95 33.73 2jhu s ARG 172 CO 0.70 -2.11 0.00 0.41 0.02 0.00 0.00 175.30 174.32 2jhu n GLY 173 N 0.18 -0.51 3.84 -3.53 0.00 -0.20 -4.91 105.19 100.06 2jhu n GLY 173 Ca 0.12 -2.15 -0.36 0.00 0.00 0.00 0.00 46.02 43.64 2jhu n GLY 173 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jhu s SER 174 N -4.00 6.85 0.01 1.61 0.01 -1.26 -1.12 113.70 115.81 2jhu s SER 174 Ca 0.00 1.10 0.02 0.00 1.31 0.00 0.00 55.95 58.37 2jhu s SER 174 Cb 0.00 -2.30 -0.01 0.00 0.21 0.00 0.00 66.02 63.92 2jhu s SER 174 CO 0.00 0.13 -0.06 -0.31 0.41 0.00 0.00 173.24 173.42 2jhu s TYR 175 N -1.40 0.51 -0.03 2.43 1.51 0.58 -4.73 117.35 116.21 2jhu s TYR 175 Ca 0.36 -0.23 0.05 0.00 -1.01 0.00 0.00 57.07 56.24 2jhu s TYR 175 Cb -0.16 -0.32 -0.03 0.00 -0.11 0.00 0.00 41.96 41.35 2jhu s TYR 175 CO 0.19 -0.04 -0.17 -1.54 -1.11 0.00 0.00 175.55 172.88 2jhu s SER 176 N -0.62 3.79 -0.08 2.29 1.04 -0.20 -1.21 113.70 118.71 2jhu s SER 176 Ca -0.02 -0.28 0.04 0.00 0.48 0.00 0.00 55.95 56.17 2jhu s SER 176 Cb -0.05 -0.71 0.00 0.00 0.10 0.00 0.00 66.02 65.36 2jhu s SER 176 CO -0.00 0.33 -0.20 -0.63 0.98 0.00 0.00 173.24 173.72 2jhu s ILE 177 N -0.72 1.73 -0.30 -1.02 1.01 0.49 -0.03 121.20 122.35 2jhu s ILE 177 Ca 0.11 -0.84 -0.07 0.00 0.00 0.00 0.00 60.65 59.86 2jhu s ILE 177 Cb -0.10 -1.51 0.01 0.00 0.01 0.00 0.00 42.46 40.87 2jhu s ILE 177 CO 0.01 0.49 0.09 -0.54 0.00 0.00 0.00 174.94 174.98 2jhu s LYS 178 N 0.37 3.12 -0.03 2.79 1.02 0.24 -1.29 119.74 125.96 2jhu s LYS 178 Ca -0.15 -0.84 -0.00 0.00 0.02 0.00 0.00 55.97 54.99 2jhu s LYS 178 Cb -0.16 -3.40 -0.04 0.00 -0.52 0.00 0.00 37.83 33.71 2jhu s LYS 178 CO 0.06 -0.44 0.03 -1.12 -0.92 0.00 0.00 175.35 172.97 2jhu s SER 179 N 1.51 5.39 -0.00 2.83 0.01 0.60 -0.54 113.70 123.49 2jhu s SER 179 Ca 0.03 0.11 0.01 0.00 1.31 0.00 0.00 55.95 57.40 2jhu s SER 179 Cb -0.17 -1.50 -0.00 0.00 0.21 0.00 0.00 66.02 64.56 2jhu s SER 179 CO 0.03 0.31 -0.03 -0.13 0.41 0.00 0.00 173.24 173.83 2jhu s ARG 180 N -1.40 0.27 -0.20 12.44 3.00 -0.04 -1.30 118.95 131.72 2jhu s ARG 180 Ca 0.19 -0.10 -0.01 0.00 0.00 0.00 0.00 55.73 55.81 2jhu s ARG 180 Cb -0.12 -0.27 0.01 0.00 0.00 0.00 0.00 34.95 34.58 2jhu s ARG 180 CO 0.09 0.06 -0.14 0.12 0.00 0.00 0.00 175.30 175.43 2jhu s PHE 181 N -0.01 2.88 0.00 -0.53 2.19 0.17 -0.74 117.98 121.93 2jhu s PHE 181 Ca 0.00 -1.47 0.00 0.00 0.33 0.00 0.00 56.93 55.80 2jhu s PHE 181 Cb -0.02 -1.99 0.00 0.00 -1.31 0.00 0.00 43.02 39.70 2jhu s PHE 181 CO -0.00 -0.73 0.00 -2.37 1.83 0.00 0.00 175.22 173.95 2jhu n THR 182 N 4.67 0.00 -3.26 0.12 5.66 -0.16 -1.34 114.28 119.98 2jhu n THR 182 Ca -0.19 0.00 -0.01 0.00 -3.05 0.00 0.00 64.05 60.80 2jhu n THR 182 Cb 0.50 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.28 2jhu n THR 182 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 2jhu n ASP 183 N -2.25 -0.17 0.00 1.09 5.68 -1.26 -0.83 116.55 118.81 2jhu n ASP 183 Ca 0.00 -1.15 0.12 0.00 -0.50 0.00 0.00 54.79 53.26 2jhu n ASP 183 Cb 0.00 0.30 0.57 0.00 -1.14 0.00 0.00 41.12 40.85 2jhu n ASP 183 CO 0.00 0.00 0.00 -0.90 -1.33 0.00 0.00 177.20 174.97 2jhu n ASP 184 N -1.41 0.00 -0.32 -1.12 5.68 -0.73 -0.79 116.55 117.87 2jhu n ASP 184 Ca -0.00 0.09 0.15 0.00 -0.50 0.00 0.00 54.79 54.52 2jhu n ASP 184 Cb 0.05 -0.34 0.66 0.00 -1.14 0.00 0.00 41.12 40.36 2jhu n ASP 184 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2jhu n ASP 185 N -1.34 0.99 -1.56 -1.12 8.00 -1.26 -4.94 116.55 115.31 2jhu n ASP 185 Ca 0.10 -1.31 -0.17 0.00 0.71 0.00 0.00 54.79 54.12 2jhu n ASP 185 Cb 0.21 -0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.27 2jhu n ASP 185 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2jhu n LYS 186 N -0.24 -1.23 -2.11 -1.24 5.02 0.03 -4.98 118.16 113.42 2jhu n LYS 186 Ca 0.20 0.95 -0.41 0.00 -2.02 0.00 0.00 58.31 57.03 2jhu n LYS 186 Cb 0.27 -5.26 -0.02 0.00 -0.02 0.00 0.00 35.03 30.00 2jhu n LYS 186 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2jhu s THR 187 N -2.71 2.85 -1.17 -0.18 2.01 -1.26 -4.84 115.64 110.34 2jhu s THR 187 Ca 0.00 0.74 -0.18 0.00 0.31 0.00 0.00 61.69 62.56 2jhu s THR 187 Cb 0.00 -3.47 0.10 0.00 0.01 0.00 0.00 72.50 69.14 2jhu s THR 187 CO 0.00 0.13 1.51 -0.62 -0.69 0.00 0.00 174.62 174.95 2jhu s ASP 188 N 0.14 6.82 0.14 3.53 2.15 -1.26 -3.98 116.67 124.20 2jhu s ASP 188 Ca 0.56 -2.37 -0.16 0.00 0.43 0.00 0.00 52.55 51.01 2jhu s ASP 188 Cb -0.40 -2.50 -0.00 0.00 -0.30 0.00 0.00 42.92 39.72 2jhu s ASP 188 CO 0.44 -1.09 1.69 0.45 -0.17 0.00 0.00 175.17 176.48 2jhu h HIS 189 N 8.03 0.62 -1.84 -5.34 3.86 -1.57 -3.44 115.15 115.47 2jhu h HIS 189 Ca 0.32 -0.05 -0.00 0.00 -1.16 0.00 0.00 60.37 59.48 2jhu h HIS 189 Cb 0.92 -0.19 -0.22 0.00 1.06 0.00 0.00 27.41 28.98 2jhu h HIS 189 CO 1.27 0.54 0.27 -1.17 0.86 0.00 0.00 177.93 179.70 2jhu s LEU 190 N -9.80 -0.61 -0.05 2.43 2.96 -1.16 -4.68 118.68 107.76 2jhu s LEU 190 Ca -0.13 1.07 0.05 0.00 -0.22 0.00 0.00 54.13 54.90 2jhu s LEU 190 Cb 0.10 2.26 -0.01 0.00 0.50 0.00 0.00 46.19 49.04 2jhu s LEU 190 CO 0.75 -0.29 -0.21 -0.44 -1.32 0.00 0.00 176.35 174.84 2jhu s SER 191 N -0.04 2.65 0.12 3.68 0.01 -1.26 -0.66 113.70 118.19 2jhu s SER 191 Ca -0.01 -0.44 -0.16 0.00 1.31 0.00 0.00 55.95 56.65 2jhu s SER 191 Cb -0.04 -0.76 0.03 0.00 0.21 0.00 0.00 66.02 65.47 2jhu s SER 191 CO 0.00 0.20 0.39 -1.66 0.41 0.00 0.00 173.24 172.59 2jhu s TRP 192 N -0.04 -0.19 -0.02 2.43 -2.14 -0.42 -5.01 118.94 113.54 2jhu s TRP 192 Ca -0.04 -0.13 0.06 0.00 2.66 0.00 0.00 56.10 58.64 2jhu s TRP 192 Cb -0.13 0.25 -0.01 0.00 -3.10 0.00 0.00 33.47 30.48 2jhu s TRP 192 CO 0.03 -0.70 -0.19 -2.00 -2.66 0.00 0.00 176.95 171.44 2jhu s GLU 193 N -3.80 1.66 0.24 3.25 2.12 -1.26 -0.29 118.70 120.61 2jhu s GLU 193 Ca 0.03 -0.68 -0.11 0.00 0.36 0.00 0.00 54.97 54.57 2jhu s GLU 193 Cb 0.02 -1.55 -0.01 0.00 0.26 0.00 0.00 34.13 32.85 2jhu s GLU 193 CO -0.12 0.37 0.43 1.67 -0.54 0.00 0.00 175.26 177.07 2jhu s TRP 194 N -0.32 0.50 0.13 5.30 1.48 -0.41 -4.35 118.94 121.26 2jhu s TRP 194 Ca 0.04 -0.84 0.07 0.00 -1.06 0.00 0.00 56.10 54.32 2jhu s TRP 194 Cb -0.09 0.07 -0.04 0.00 -1.16 0.00 0.00 33.47 32.26 2jhu s TRP 194 CO 0.00 -0.94 -0.17 -0.80 -4.06 0.00 0.00 176.95 170.97 2jhu s ASN 195 N -3.04 2.36 -0.02 -2.66 0.01 -1.26 -0.38 114.94 109.95 2jhu s ASN 195 Ca 0.25 -0.77 0.01 0.00 -0.71 0.00 0.00 52.86 51.64 2jhu s ASN 195 Cb 0.00 -0.12 0.01 0.00 0.41 0.00 0.00 41.25 41.56 2jhu s ASN 195 CO 0.10 -0.04 -0.03 -0.22 -1.51 0.00 0.00 177.10 175.40 2jhu s LEU 196 N -2.31 1.60 -0.09 0.60 2.96 -0.35 -1.56 118.68 119.54 2jhu s LEU 196 Ca 0.10 -0.06 0.02 0.00 -0.22 0.00 0.00 54.13 53.96 2jhu s LEU 196 Cb -0.07 -0.25 0.01 0.00 0.50 0.00 0.00 46.19 46.39 2jhu s LEU 196 CO 0.05 -0.02 -0.13 -0.89 -1.32 0.00 0.00 176.35 174.03 2jhu s THR 197 N 0.46 1.30 -0.26 3.68 2.01 0.09 -0.31 115.64 122.62 2jhu s THR 197 Ca -0.05 -0.54 -0.12 0.00 0.31 0.00 0.00 61.69 61.30 2jhu s THR 197 Cb -0.08 -1.20 -0.05 0.00 0.01 0.00 0.00 72.50 71.18 2jhu s THR 197 CO -0.01 0.40 0.22 -0.63 -0.69 0.00 0.00 174.62 173.91 2jhu s ILE 198 N 0.92 5.31 0.31 1.82 -1.09 -0.27 -1.05 121.20 127.15 2jhu s ILE 198 Ca -0.09 0.27 0.08 0.00 -2.23 0.00 0.00 60.65 58.68 2jhu s ILE 198 Cb -0.15 -3.55 -0.06 0.00 -1.58 0.00 0.00 42.46 37.11 2jhu s ILE 198 CO 0.00 0.28 -0.09 -0.54 -1.23 0.00 0.00 174.94 173.36 2jhu s LYS 199 N 1.47 1.70 0.36 2.79 1.02 -0.54 -1.03 119.74 125.50 2jhu s LYS 199 Ca 0.09 -1.87 0.08 0.00 0.02 0.00 0.00 55.97 54.30 2jhu s LYS 199 Cb -0.15 -1.49 0.67 0.00 -0.52 0.00 0.00 37.83 36.34 2jhu s LYS 199 CO 0.08 0.11 1.85 -0.22 -0.92 0.00 0.00 175.35 176.25 2jhu h LYS 200 N 2.14 0.26 -4.32 1.68 3.64 -1.96 0.85 116.57 118.85 2jhu h LYS 200 Ca -0.41 -0.08 -0.15 0.00 -1.27 0.00 0.00 60.65 58.74 2jhu h LYS 200 Cb 1.24 -0.03 -0.15 0.00 -0.41 0.00 0.00 32.23 32.89 2jhu h LYS 200 CO 0.69 0.46 -0.65 -0.51 -2.27 0.00 0.00 179.45 177.16 2jhu s ASP 201 N -6.87 0.38 0.00 4.20 -0.00 -1.26 -4.55 116.67 108.57 2jhu s ASP 201 Ca -0.05 -1.10 0.05 0.00 -0.00 0.00 0.00 52.55 51.45 2jhu s ASP 201 Cb 0.15 0.26 0.30 0.00 -0.00 0.00 0.00 42.92 43.63 2jhu s ASP 201 CO 0.75 -0.67 0.77 0.79 -0.00 0.00 0.00 175.17 176.81